*HEADER    HYDROLASE                               14-AUG-07   2JU4              
*TITLE     NMR STRUCTURE OF THE GAMMA SUBUNIT OF CGMP PHOSPHODIESTERASE          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RETINAL ROD RHODOPSIN-SENSITIVE CGMP 3',5'-                
*COMPND   3 CYCLIC PHOSPHODIESTERASE SUBUNIT GAMMA;                              
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 SYNONYM: GMP-PDE GAMMA;                                              
*COMPND   6 EC: 3.1.4.17;                                                        
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BOS TAURUS;                                     
*SOURCE   3 ORGANISM_COMMON: BOVINE;                                             
*SOURCE   4 TISSUE: RETINA;                                                      
*SOURCE   5 GENE: PDE6G, PDEG;                                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PTXBI                                     
*KEYWDS    INTRINSIC DISORDERED PROTEIN, PARAMAGNETIC RELAXATION                 
*KEYWDS   2 ENHANCEMENT, CGMP, HYDROLASE, POLYMORPHISM, SENSORY                  
*KEYWDS   3 TRANSDUCTION, VISION, STRUCTURAL GENOMICS, PSI-2, PROTEIN            
*KEYWDS   4 STRUCTURE INITIATIVE, CENTER FOR EUKARYOTIC STRUCTURAL               
*KEYWDS   5 GENOMICS, CESG                                                       
*EXPDTA    NMR, 100 STRUCTURES                                                   
*AUTHOR    J.SONG, L.GUO, A.E.RUOHO, J.L.MARKLEY, CENTER FOR                     
*AUTHOR   2 EUKARYOTIC STRUCTURAL GENOMICS (CESG)                                
*REVDAT   1   16-OCT-07 2JU4    0                                                


!Paramagnetic Relaxation Enhancement Restraints
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assign  (resid 73  and name  O1J)  (resid 84  and name HN) 14.00 5  5
assign  (resid 73  and name  O1J)  (resid 85  and name HN) 12.50 5  5
assign  (resid 73  and name  O1J)  (resid 86  and name HN) 13.40 5  5
assign  (resid 73  and name  O1J)  (resid 87  and name HN) 13.40 5  5
assign  (resid 76  and name  O1J)  (resid  2  and name HN) 23.60 5  999
assign  (resid 76  and name  O1J)  (resid  3  and name HN) 23.60 5  999
assign  (resid 76  and name  O1J)  (resid  4  and name HN) 23.30 5  999
assign  (resid 76  and name  O1J)  (resid  7  and name HN) 22.80 5  999
assign  (resid 76  and name  O1J)  (resid  8  and name HN) 19.30 5  999
assign  (resid 76  and name  O1J)  (resid  9  and name HN) 23.00 5  999
assign  (resid 76  and name  O1J)  (resid 10  and name HN) 24.10 5  999
assign  (resid 76  and name  O1J)  (resid 11  and name HN) 22.70 5  999
assign  (resid 76  and name  O1J)  (resid 12  and name HN) 22.20 5  999
assign  (resid 76  and name  O1J)  (resid 13  and name HN) 23.30 5  999
assign  (resid 76  and name  O1J)  (resid 14  and name HN) 23.30 5  999
assign  (resid 76  and name  O1J)  (resid 15  and name HN) 23.20 5  999
assign  (resid 76  and name  O1J)  (resid 16  and name HN) 22.50 5  999
assign  (resid 76  and name  O1J)  (resid 17  and name HN) 18.00 5  5 
assign  (resid 76  and name  O1J)  (resid 18  and name HN) 20.30 5  5 
assign  (resid 76  and name  O1J)  (resid 19  and name HN) 24.30 5  999
assign  (resid 76  and name  O1J)  (resid 21  and name HN) 22.30 5  999
assign  (resid 76  and name  O1J)  (resid 22  and name HN) 22.60 5  999
assign  (resid 76  and name  O1J)  (resid 24  and name HN) 16.10 5  5
assign  (resid 76  and name  O1J)  (resid 25  and name HN) 19.00 5  5
assign  (resid 76  and name  O1J)  (resid 26  and name HN) 18.30 5  5
assign  (resid 76  and name  O1J)  (resid 29  and name HN) 15.50 5  5
assign  (resid 76  and name  O1J)  (resid 30  and name HN) 15.30 5  5
assign  (resid 76  and name  O1J)  (resid 31  and name HN) 13.80 5  5
assign  (resid 76  and name  O1J)  (resid 32  and name HN) 16.40 5  5
assign  (resid 76  and name  O1J)  (resid 33  and name HN) 13.80 5  5
assign  (resid 76  and name  O1J)  (resid 34  and name HN) 14.30 5  5
assign  (resid 76  and name  O1J)  (resid 35  and name HN) 15.80 5  5
assign  (resid 76  and name  O1J)  (resid 36  and name HN) 13.50 5  5
assign  (resid 76  and name  O1J)  (resid 37  and name HN) 13.60 5  5
assign  (resid 76  and name  O1J)  (resid 38  and name HN) 14.30 5  5
assign  (resid 76  and name  O1J)  (resid 39  and name HN) 13.30 5  5
assign  (resid 76  and name  O1J)  (resid 40  and name HN) 16.30 5  5
assign  (resid 76  and name  O1J)  (resid 41  and name HN) 15.60 5  5
assign  (resid 76  and name  O1J)  (resid 44  and name HN) 15.70 5  5
assign  (resid 76  and name  O1J)  (resid 45  and name HN) 17.70 5  5
assign  (resid 76  and name  O1J)  (resid 46  and name HN) 13.70 5  5
assign  (resid 76  and name  O1J)  (resid 47  and name HN) 16.30 5  5
assign  (resid 76  and name  O1J)  (resid 48  and name HN) 14.70 5  5
assign  (resid 76  and name  O1J)  (resid 49  and name HN) 14.10 5  5
assign  (resid 76  and name  O1J)  (resid 50  and name HN) 13.80 5  5
assign  (resid 76  and name  O1J)  (resid 51  and name HN) 12.20 5  5
assign  (resid 76  and name  O1J)  (resid 52  and name HN) 13.70 5  5
assign  (resid 76  and name  O1J)  (resid 53  and name HN) 13.60 5  5
assign  (resid 76  and name  O1J)  (resid 54  and name HN) 15.20 5  5
assign  (resid 76  and name  O1J)  (resid 56  and name HN) 11.70 5  5
assign  (resid 76  and name  O1J)  (resid 57  and name HN) 13.40 5  5
assign  (resid 76  and name  O1J)  (resid 58  and name HN) 13.30 5  5
assign  (resid 76  and name  O1J)  (resid 59  and name HN) 12.30 5  5
assign  (resid 76  and name  O1J)  (resid 60  and name HN) 13.40 5  5
assign  (resid 76  and name  O1J)  (resid 61  and name HN) 12.20 5  5
assign  (resid 76  and name  O1J)  (resid 62  and name HN) 15.10 5  5
assign  (resid 76  and name  O1J)  (resid 63  and name HN) 13.20 5  5
assign  (resid 76  and name  O1J)  (resid 64  and name HN) 14.00 5  5
assign  (resid 76  and name  O1J)  (resid 65  and name HN) 12.80 5  5
assign  (resid 76  and name  O1J)  (resid 66  and name HN) 12.30 5  5
assign  (resid 76  and name  O1J)  (resid 67  and name HN) 10.80 5  5
assign  (resid 76  and name  O1J)  (resid 68  and name HN) 11.00 5  5
assign  (resid 76  and name  O1J)  (resid 70  and name HN) 11.30 5  5
assign  (resid 76  and name  O1J)  (resid 70 and name HE1) 10.70 5  5
assign  (resid 76  and name  O1J)  (resid 71  and name HN) 11.30 5  5
assign  (resid 76  and name  O1J)  (resid 72  and name HN) 12.10 12.10  5
assign  (resid 76  and name  O1J)  (resid 73  and name HN) 11.70 11.70  5
assign  (resid 76  and name  O1J)  (resid 81  and name HN) 10.70 10.70  5
assign  (resid 76  and name  O1J)  (resid 82  and name HN) 11.20 11.20  5
assign  (resid 76  and name  O1J)  (resid 83  and name HN) 10.50 10.50  5
assign  (resid 76  and name  O1J)  (resid 84  and name HN) 11.00 11.00  5
assign  (resid 76  and name  O1J)  (resid 85  and name HN) 11.00 5  5
assign  (resid 76  and name  O1J)  (resid 86  and name HN) 13.10 5  5
assign  (resid 76  and name  O1J)  (resid 87  and name HN) 15.00 5  5
assign  (resid 87  and name  O1J)  (resid 2   and name HN) 22.70 5  999       
assign  (resid 87  and name  O1J)  (resid 3   and name HN) 24.30 5  999       
assign  (resid 87  and name  O1J)  (resid 4   and name HN) 22.30 5  999     
assign  (resid 87  and name  O1J)  (resid 7   and name HN) 22.60 5  999       
assign  (resid 87  and name  O1J)  (resid 8   and name HN) 22.30 5  999       
assign  (resid 87  and name  O1J)  (resid 9   and name HN) 22.40 5  999       
assign  (resid 87  and name  O1J)  (resid 10  and name HN) 22.60 5  999      
assign  (resid 87  and name  O1J)  (resid 11  and name HN) 22.80 5  999      
assign  (resid 87  and name  O1J)  (resid 12  and name HN) 22.50 5  999      
assign  (resid 87  and name  O1J)  (resid 13  and name HN) 22.30 5  999      
assign  (resid 87  and name  O1J)  (resid 14  and name HN) 22.60 5  999      
assign  (resid 87  and name  O1J)  (resid 15  and name HN) 23.60 5  5        
assign  (resid 87  and name  O1J)  (resid 16  and name HN) 22.10 5  5        
assign  (resid 87  and name  O1J)  (resid 17  and name HN) 21.30 5  5        
assign  (resid 87  and name  O1J)  (resid 18  and name HN) 22.00 5  5        
assign  (resid 87  and name  O1J)  (resid 19  and name HN) 24.20 5  5        
assign  (resid 87  and name  O1J)  (resid 21  and name HN) 23.00 5  5        
assign  (resid 87  and name  O1J)  (resid 22  and name HN) 21.30 5  5        
assign  (resid 87  and name  O1J)  (resid 24  and name HN) 15.60 5  5        
assign  (resid 87  and name  O1J)  (resid 25  and name HN) 17.60 5  5        
assign  (resid 87  and name  O1J)  (resid 26  and name HN) 18.70 5  5        
assign  (resid 87  and name  O1J)  (resid 29  and name HN) 15.60 5  5        
assign  (resid 87  and name  O1J)  (resid 30  and name HN) 17.20 5  5        
assign  (resid 87  and name  O1J)  (resid 31  and name HN) 15.00 5  5        
assign  (resid 87  and name  O1J)  (resid 32  and name HN) 17.00 5  5        
assign  (resid 87  and name  O1J)  (resid 33  and name HN) 15.10 5  5        
assign  (resid 87  and name  O1J)  (resid 34  and name HN) 14.30 5  5        
assign  (resid 87  and name  O1J)  (resid 35  and name HN) 16.20 5  5        
assign  (resid 87  and name  O1J)  (resid 36  and name HN) 14.30 5  5        
assign  (resid 87  and name  O1J)  (resid 37  and name HN) 14.30 5  5        
assign  (resid 87  and name  O1J)  (resid 38  and name HN) 16.20 5  5        
assign  (resid 87  and name  O1J)  (resid 40  and name HN) 14.70 5  5        
assign  (resid 87  and name  O1J)  (resid 41  and name HN) 16.50 5  5        
assign  (resid 87  and name  O1J)  (resid 44  and name HN) 17.60 5  5        
assign  (resid 87  and name  O1J)  (resid 45  and name HN) 18.30 5  5        
assign  (resid 87  and name  O1J)  (resid 46  and name HN) 14.40 5  5        
assign  (resid 87  and name  O1J)  (resid 47  and name HN) 17.10 5  5        
assign  (resid 87  and name  O1J)  (resid 48  and name HN) 17.70 5  5        
assign  (resid 87  and name  O1J)  (resid 49  and name HN) 14.10 5  5        
assign  (resid 87  and name  O1J)  (resid 50  and name HN) 15.60 5  5        
assign  (resid 87  and name  O1J)  (resid 51  and name HN) 14.30 5  5        
assign  (resid 87  and name  O1J)  (resid 52  and name HN) 15.60 5  5        
assign  (resid 87  and name  O1J)  (resid 53  and name HN) 15.30 5  5        
assign  (resid 87  and name  O1J)  (resid 54  and name HN) 16.80 5  5        
assign  (resid 87  and name  O1J)  (resid 56  and name HN) 13.60 5  5        
assign  (resid 87  and name  O1J)  (resid 57  and name HN) 15.40 5  5        
assign  (resid 87  and name  O1J)  (resid 58  and name HN) 15.00 5  5        
assign  (resid 87  and name  O1J)  (resid 59  and name HN) 14.70 5  5        
assign  (resid 87  and name  O1J)  (resid 60  and name HN) 14.30 5  5        
assign  (resid 87  and name  O1J)  (resid 61  and name HN) 13.80 5  5        
assign  (resid 87  and name  O1J)  (resid 62  and name HN) 16.30 5  5        
assign  (resid 87  and name  O1J)  (resid 63  and name HN) 14.70 5  5        
assign  (resid 87  and name  O1J)  (resid 64  and name HN) 15.20 5  5        
assign  (resid 87  and name  O1J)  (resid 65  and name HN) 14.10 5  5        
assign  (resid 87  and name  O1J)  (resid 66  and name HN) 13.10 5  5        
assign  (resid 87  and name  O1J)  (resid 67  and name HN) 11.80 5  5        
assign  (resid 87  and name  O1J)  (resid 68  and name HN) 12.00 5  5        
assign  (resid 87  and name  O1J)  (resid 70  and name HN) 11.50 5  5        
assign  (resid 87  and name  O1J)  (resid 70 and name HE1) 12.40 5  5       
assign  (resid 87  and name  O1J)  (resid 71  and name HN) 13.00 5  5        
assign  (resid 87  and name  O1J)  (resid 72  and name HN) 12.50 5  5        
assign  (resid 87  and name  O1J)  (resid 73  and name HN) 13.40 5  5        
assign  (resid 87  and name  O1J)  (resid 74  and name HN) 12.30 5  5        
assign  (resid 87  and name  O1J)  (resid 75  and name HN) 13.70 5  5        
assign  (resid 87  and name  O1J)  (resid 76  and name HN) 13.60 5  5        
assign  (resid 87  and name  O1J)  (resid 77  and name HN) 13.50 5  5        
assign  (resid 87  and name  O1J)  (resid 78  and name HN) 13.30 5  5        
assign  (resid 87  and name  O1J)  (resid 79  and name HN) 12.60 5  5        
assign  (resid 87  and name  O1J)  (resid 80  and name HN) 12.70 5  5        
assign  (resid 87  and name  O1J)  (resid 81  and name HN) 12.20 5  5        
assign  (resid 87  and name  O1J)  (resid 82  and name HN) 13.30 5  5        
assign  (resid 87  and name  O1J)  (resid 83  and name HN) 12.30 5  5        
assign  (resid 87  and name  O1J)  (resid 84  and name HN) 12.20 5  5        
! NOE Restraints
! Converted from 1xxx.noe (AQUA version 3.2)
assign (resid   1 and name HA   ) (resid   2 and name HN   )    0.000    0.000    5.590
assign (resid   2 and name HA   ) (resid   3 and name HN   )    0.000    0.000    4.780
assign (resid   2 and name HN   ) (resid   2 and name HA   )    0.000    0.000    3.960
assign (resid   3 and name HA   ) (resid   4 and name HN   )    0.000    0.000    4.100
assign (resid   3 and name HB2  ) (resid   3 and name HD1# )    0.000    0.000    5.300
assign (resid   3 and name HN   ) (resid   3 and name HA   )    0.000    0.000    5.710
assign (resid   3 and name HN   ) (resid   3 and name HB2  )    0.000    0.000    5.330
assign (resid   6 and name HA   ) (resid   7 and name HN   )    0.000    0.000    3.760
assign (resid   6 and name HB1  ) (resid   7 and name HN   )    0.000    0.000    5.580
assign (resid   7 and name HA   ) (resid   8 and name HN   )    0.000    0.000    3.410
assign (resid   7 and name HB1  ) (resid   8 and name HN   )    0.000    0.000    5.800
assign (resid   7 and name HG1  ) (resid   8 and name HN   )    0.000    0.000    5.800
assign (resid   7 and name HN   ) (resid   7 and name HA   )    0.000    0.000    4.680
assign (resid   7 and name HN   ) (resid   7 and name HE1  )    0.000    0.000    5.090
assign (resid   7 and name HN   ) (resid   7 and name HG1  )    0.000    0.000    5.540
assign (resid   8 and name HA   ) (resid   9 and name HN   )    0.000    0.000    3.600
assign (resid   8 and name HB#  ) (resid   9 and name HN   )    0.000    0.000    5.790
assign (resid   8 and name HN   ) (resid   8 and name HB#  )    0.000    0.000    4.650
assign (resid   9 and name HN   ) (resid   9 and name HB1  )    0.000    0.000    5.010
assign (resid   9 and name HN   ) (resid   9 and name HG2  )    0.000    0.000    5.800
assign (resid  10 and name HA   ) (resid  11 and name HN   )    0.000    0.000    3.750
assign (resid  10 and name HN   ) (resid  10 and name HA   )    0.000    0.000    5.340
assign (resid  11 and name HA   ) (resid  11 and name HG1  )    0.000    0.000    4.080
assign (resid  11 and name HA   ) (resid  12 and name HN   )    0.000    0.000    3.630
assign (resid  11 and name HG1  ) (resid  12 and name HN   )    0.000    0.000    5.800
assign (resid  11 and name HN   ) (resid  11 and name HA   )    0.000    0.000    4.710
assign (resid  11 and name HN   ) (resid  11 and name HB1  )    0.000    0.000    4.960
assign (resid  11 and name HN   ) (resid  11 and name HG1  )    0.000    0.000    5.410
assign (resid  12 and name HB1  ) (resid  13 and name HN   )    0.000    0.000    3.940
assign (resid  12 and name HB2  ) (resid  13 and name HN   )    0.000    0.000    5.800
assign (resid  12 and name HN   ) (resid  12 and name HB2  )    0.000    0.000    5.190
assign (resid  13 and name HA   ) (resid  14 and name HN   )    0.000    0.000    3.870
assign (resid  13 and name HB#  ) (resid  14 and name HN   )    0.000    0.000    5.330
assign (resid  13 and name HN   ) (resid  13 and name HB#  )    0.000    0.000    4.440
assign (resid  13 and name HN   ) (resid  14 and name HA   )    0.000    0.000    5.800
assign (resid  13 and name HN   ) (resid  14 and name HN   )    0.000    0.000    5.260
assign (resid  14 and name HA   ) (resid  15 and name HB1  )    0.000    0.000    5.800
assign (resid  14 and name HA   ) (resid  15 and name HN   )    0.000    0.000    3.890
assign (resid  14 and name HB   ) (resid  15 and name HN   )    0.000    0.000    5.800
assign (resid  14 and name HG2# ) (resid  15 and name HN   )    0.000    0.000    5.800
assign (resid  14 and name HN   ) (resid  14 and name HA   )    0.000    0.000    5.000
assign (resid  14 and name HN   ) (resid  14 and name HB   )    0.000    0.000    5.150
assign (resid  14 and name HN   ) (resid  14 and name HG2# )    0.000    0.000    5.330
assign (resid  14 and name HN   ) (resid  15 and name HA   )    0.000    0.000    5.250
assign (resid  14 and name HN   ) (resid  15 and name HN   )    0.000    0.000    5.070
assign (resid  15 and name HA   ) (resid  16 and name HB   )    0.000    0.000    5.800
assign (resid  15 and name HA   ) (resid  16 and name HN   )    0.000    0.000    3.910
assign (resid  15 and name HN   ) (resid  15 and name HA   )    0.000    0.000    4.780
assign (resid  15 and name HN   ) (resid  15 and name HB1  )    0.000    0.000    5.060
assign (resid  15 and name HN   ) (resid  15 and name HG1  )    0.000    0.000    5.800
assign (resid  16 and name HA   ) (resid  17 and name HN   )    0.000    0.000    3.820
assign (resid  16 and name HB   ) (resid  17 and name HN   )    0.000    0.000    5.050
assign (resid  16 and name HG2# ) (resid  16 and name HB   )    0.000    0.000    3.850
assign (resid  16 and name HG2# ) (resid  17 and name HN   )    0.000    0.000    5.530
assign (resid  16 and name HN   ) (resid  16 and name HA   )    0.000    0.000    5.200
assign (resid  16 and name HN   ) (resid  16 and name HB   )    0.000    0.000    4.680
assign (resid  16 and name HN   ) (resid  16 and name HG2# )    0.000    0.000    4.920
assign (resid  17 and name HA   ) (resid  18 and name HN   )    0.000    0.000    4.040
assign (resid  17 and name HB2  ) (resid  18 and name HN   )    0.000    0.000    5.800
assign (resid  17 and name HN   ) (resid  17 and name HA   )    0.000    0.000    5.160
assign (resid  17 and name HN   ) (resid  17 and name HG1  )    0.000    0.000    5.800
assign (resid  18 and name HA1  ) (resid  19 and name HN   )    0.000    0.000    4.060
assign (resid  20 and name HA   ) (resid  21 and name HN   )    0.000    0.000    3.770
assign (resid  20 and name HB1  ) (resid  21 and name HN   )    0.000    0.000    4.680
assign (resid  20 and name HB2  ) (resid  20 and name HA   )    0.000    0.000    5.750
assign (resid  20 and name HD1  ) (resid  20 and name HB2  )    0.000    0.000    5.640
assign (resid  21 and name HA   ) (resid  22 and name HN   )    0.000    0.000    3.680
assign (resid  23 and name HA   ) (resid  23 and name HB1  )    0.000    0.000    5.040
assign (resid  23 and name HB2  ) (resid  24 and name HN   )    0.000    0.000    5.800
assign (resid  24 and name HA   ) (resid  25 and name HN   )    0.000    0.000    3.530
assign (resid  24 and name HN   ) (resid  24 and name HA   )    0.000    0.000    4.410
assign (resid  24 and name HN   ) (resid  24 and name HB1  )    0.000    0.000    4.650
assign (resid  24 and name HN   ) (resid  24 and name HG1  )    0.000    0.000    5.580
assign (resid  25 and name HA   ) (resid  25 and name HB2  )    0.000    0.000    4.550
assign (resid  25 and name HA   ) (resid  25 and name HG1  )    0.000    0.000    5.800
assign (resid  25 and name HA   ) (resid  26 and name HN   )    0.000    0.000    3.590
assign (resid  25 and name HB2  ) (resid  26 and name HN   )    0.000    0.000    4.960
assign (resid  25 and name HD1  ) (resid  26 and name HN   )    0.000    0.000    5.800
assign (resid  25 and name HG1  ) (resid  25 and name HE1  )    0.000    0.000    5.350
assign (resid  25 and name HN   ) (resid  25 and name HD1  )    0.000    0.000    4.210
assign (resid  25 and name HN   ) (resid  25 and name HG1  )    0.000    0.000    5.610
assign (resid  26 and name HA1  ) (resid  27 and name HD1  )    0.000    0.000    3.490
assign (resid  26 and name HA1  ) (resid  27 and name HD1  )    0.000    0.000    5.560
assign (resid  26 and name HN   ) (resid  26 and name HA1  )    0.000    0.000    4.890
assign (resid  26 and name HN   ) (resid  26 and name HA1  )    0.000    0.000    5.140
assign (resid  28 and name HA   ) (resid  29 and name HN   )    0.000    0.000    3.880
assign (resid  29 and name HA   ) (resid  29 and name HB1  )    0.000    0.000    4.260
assign (resid  29 and name HA   ) (resid  30 and name HN   )    0.000    0.000    3.720
assign (resid  29 and name HB1  ) (resid  30 and name HN   )    0.000    0.000    4.950
assign (resid  30 and name HA   ) (resid  30 and name HB1  )    0.000    0.000    4.250
assign (resid  30 and name HA   ) (resid  30 and name HB2  )    0.000    0.000    3.960
assign (resid  30 and name HA   ) (resid  31 and name HN   )    0.000    0.000    3.490
assign (resid  30 and name HB1  ) (resid  31 and name HN   )    0.000    0.000    5.530
assign (resid  30 and name HB2  ) (resid  31 and name HN   )    0.000    0.000    5.460
assign (resid  30 and name HN   ) (resid  30 and name HA   )    0.000    0.000    5.040
assign (resid  30 and name HN   ) (resid  30 and name HB1  )    0.000    0.000    4.590
assign (resid  30 and name HN   ) (resid  30 and name HB2  )    0.000    0.000    4.380
assign (resid  31 and name HA   ) (resid  31 and name HG1  )    0.000    0.000    5.390
assign (resid  31 and name HA   ) (resid  32 and name HN   )    0.000    0.000    3.370
assign (resid  31 and name HN   ) (resid  31 and name HA   )    0.000    0.000    4.530
assign (resid  31 and name HN   ) (resid  31 and name HB1  )    0.000    0.000    4.970
assign (resid  31 and name HN   ) (resid  31 and name HD2  )    0.000    0.000    4.470
assign (resid  31 and name HN   ) (resid  31 and name HG1  )    0.000    0.000    5.320
assign (resid  32 and name HA   ) (resid  33 and name HN   )    0.000    0.000    3.410
assign (resid  32 and name HB1  ) (resid  33 and name HN   )    0.000    0.000    5.530
assign (resid  32 and name HG1  ) (resid  33 and name HN   )    0.000    0.000    5.800
assign (resid  32 and name HN   ) (resid  32 and name HB1  )    0.000    0.000    5.110
assign (resid  32 and name HN   ) (resid  32 and name HG1  )    0.000    0.000    5.340
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assign (resid  69 and name HD1  ) (resid  70 and name HN   )    0.000    0.000    5.800
assign (resid  69 and name HD2  ) (resid  70 and name HN   )    0.000    0.000    5.800
assign (resid  69 and name HG2  ) (resid  69 and name HA   )    0.000    0.000    5.420
assign (resid  69 and name HG2  ) (resid  69 and name HB1  )    0.000    0.000    4.010
assign (resid  69 and name HG2  ) (resid  69 and name HD1  )    0.000    0.000    4.730
assign (resid  69 and name HG2  ) (resid  70 and name HN   )    0.000    0.000    5.800
assign (resid  70 and name HA   ) (resid  70 and name HB1  )    0.000    0.000    4.940
assign (resid  70 and name HA   ) (resid  70 and name HD1  )    0.000    0.000    5.350
assign (resid  70 and name HA   ) (resid  71 and name HN   )    0.000    0.000    4.540
assign (resid  70 and name HA   ) (resid  72 and name HN   )    0.000    0.000    5.800
assign (resid  70 and name HB1  ) (resid  71 and name HN   )    0.000    0.000    5.800
assign (resid  70 and name HB2  ) (resid  71 and name HN   )    0.000    0.000    5.800
assign (resid  70 and name HN   ) (resid  70 and name HA   )    0.000    0.000    4.960
assign (resid  70 and name HN   ) (resid  70 and name HB1  )    0.000    0.000    5.040
assign (resid  70 and name HN   ) (resid  70 and name HB2  )    0.000    0.000    5.150
assign (resid  70 and name HN   ) (resid  70 and name HE3  )    0.000    0.000    5.800
assign (resid  70 and name HN   ) (resid  71 and name HN   )    0.000    0.000    5.080
assign (resid  71 and name HA   ) (resid  71 and name HB1  )    0.000    0.000    4.640
assign (resid  71 and name HA   ) (resid  71 and name HB2  )    0.000    0.000    4.560
assign (resid  71 and name HA   ) (resid  71 and name HG1  )    0.000    0.000    4.810
assign (resid  71 and name HA   ) (resid  72 and name HN   )    0.000    0.000    4.250
assign (resid  71 and name HB1  ) (resid  72 and name HN   )    0.000    0.000    5.750
assign (resid  71 and name HB2  ) (resid  72 and name HN   )    0.000    0.000    5.740
assign (resid  71 and name HG1  ) (resid  72 and name HN   )    0.000    0.000    5.800
assign (resid  71 and name HN   ) (resid  71 and name HA   )    0.000    0.000    4.940
assign (resid  71 and name HN   ) (resid  71 and name HB1  )    0.000    0.000    5.090
assign (resid  71 and name HN   ) (resid  71 and name HB2  )    0.000    0.000    5.560
assign (resid  71 and name HN   ) (resid  71 and name HG1  )    0.000    0.000    5.760
assign (resid  71 and name HN   ) (resid  72 and name HB#  )    0.000    0.000    5.800
assign (resid  71 and name HN   ) (resid  72 and name HN   )    0.000    0.000    4.730
assign (resid  72 and name HA   ) (resid  73 and name HN   )    0.000    0.000    4.350
assign (resid  72 and name HB#  ) (resid  72 and name HA   )    0.000    0.000    4.100
assign (resid  72 and name HB#  ) (resid  73 and name HA   )    0.000    0.000    5.800
assign (resid  72 and name HB#  ) (resid  73 and name HN   )    0.000    0.000    5.030
assign (resid  72 and name HB#  ) (resid  74 and name HN   )    0.000    0.000    5.800
assign (resid  72 and name HN   ) (resid  72 and name HA   )    0.000    0.000    4.850
assign (resid  72 and name HN   ) (resid  72 and name HB#  )    0.000    0.000    4.140
assign (resid  72 and name HN   ) (resid  73 and name HN   )    0.000    0.000    4.770
assign (resid  73 and name HA   ) (resid  73 and name HB1  )    0.000    0.000    5.800
assign (resid  73 and name HA   ) (resid  74 and name HN   )    0.000    0.000    4.610
assign (resid  73 and name HB1  ) (resid  74 and name HN   )    0.000    0.000    5.800
assign (resid  73 and name HB2  ) (resid  74 and name HN   )    0.000    0.000    5.800
assign (resid  73 and name HN   ) (resid  73 and name HA   )    0.000    0.000    4.800
assign (resid  73 and name HN   ) (resid  73 and name HB1  )    0.000    0.000    4.540
assign (resid  73 and name HN   ) (resid  73 and name HB2  )    0.000    0.000    5.000
assign (resid  73 and name HN   ) (resid  74 and name HN   )    0.000    0.000    4.770
assign (resid  74 and name HA   ) (resid  74 and name HB1  )    0.000    0.000    4.870
assign (resid  74 and name HA   ) (resid  75 and name HN   )    0.000    0.000    4.400
assign (resid  74 and name HB1  ) (resid  74 and name HD21 )    0.000    0.000    5.300
assign (resid  74 and name HB1  ) (resid  75 and name HN   )    0.000    0.000    5.540
assign (resid  74 and name HN   ) (resid  74 and name HA   )    0.000    0.000    4.810
assign (resid  74 and name HN   ) (resid  74 and name HB1  )    0.000    0.000    4.980
assign (resid  74 and name HN   ) (resid  75 and name HN   )    0.000    0.000    5.340
assign (resid  75 and name HA   ) (resid  75 and name HB1  )    0.000    0.000    4.750
assign (resid  75 and name HA   ) (resid  75 and name HB2  )    0.000    0.000    4.890
assign (resid  75 and name HA   ) (resid  76 and name HN   )    0.000    0.000    4.430
assign (resid  75 and name HB1  ) (resid  76 and name HN   )    0.000    0.000    5.800
assign (resid  75 and name HB2  ) (resid  76 and name HN   )    0.000    0.000    5.800
assign (resid  75 and name HN   ) (resid  75 and name HB1  )    0.000    0.000    5.420
assign (resid  75 and name HN   ) (resid  75 and name HB2  )    0.000    0.000    5.210
assign (resid  75 and name HN   ) (resid  76 and name HN   )    0.000    0.000    5.230
assign (resid  76 and name HB1  ) (resid  77 and name HN   )    0.000    0.000    5.800
assign (resid  76 and name HB2  ) (resid  77 and name HN   )    0.000    0.000    5.420
assign (resid  76 and name HN   ) (resid  76 and name HA   )    0.000    0.000    4.050
assign (resid  76 and name HN   ) (resid  76 and name HB1  )    0.000    0.000    4.090
assign (resid  76 and name HN   ) (resid  77 and name HN   )    0.000    0.000    4.190
assign (resid  77 and name HA   ) (resid  78 and name HN   )    0.000    0.000    4.150
assign (resid  77 and name HB1  ) (resid  78 and name HN   )    0.000    0.000    5.800
assign (resid  77 and name HG2  ) (resid  78 and name HN   )    0.000    0.000    5.800
assign (resid  77 and name HN   ) (resid  77 and name HB1  )    0.000    0.000    4.420
assign (resid  77 and name HN   ) (resid  77 and name HG1  )    0.000    0.000    5.800
assign (resid  78 and name HA   ) (resid  78 and name HD1# )    0.000    0.000    4.350
assign (resid  78 and name HA   ) (resid  79 and name HN   )    0.000    0.000    4.730
assign (resid  78 and name HB1  ) (resid  79 and name HN   )    0.000    0.000    5.760
assign (resid  78 and name HB2  ) (resid  79 and name HN   )    0.000    0.000    5.540
assign (resid  78 and name HD1# ) (resid  79 and name HN   )    0.000    0.000    5.800
assign (resid  78 and name HN   ) (resid  78 and name HA   )    0.000    0.000    4.510
assign (resid  78 and name HN   ) (resid  78 and name HB1  )    0.000    0.000    4.840
assign (resid  78 and name HN   ) (resid  79 and name HN   )    0.000    0.000    5.070
assign (resid  79 and name HA   ) (resid  80 and name HN   )    0.000    0.000    4.670
assign (resid  79 and name HA   ) (resid  82 and name HB#  )    0.000    0.000    5.800
assign (resid  79 and name HB1  ) (resid  80 and name HN   )    0.000    0.000    5.480
assign (resid  79 and name HN   ) (resid  79 and name HA   )    0.000    0.000    4.940
assign (resid  79 and name HN   ) (resid  79 and name HB1  )    0.000    0.000    5.110
assign (resid  79 and name HN   ) (resid  79 and name HB2  )    0.000    0.000    5.010
assign (resid  79 and name HN   ) (resid  80 and name HN   )    0.000    0.000    5.010
assign (resid  80 and name HA   ) (resid  80 and name HG1  )    0.000    0.000    4.370
assign (resid  80 and name HA   ) (resid  81 and name HN   )    0.000    0.000    4.170
assign (resid  80 and name HB2  ) (resid  81 and name HN   )    0.000    0.000    5.800
assign (resid  80 and name HG1  ) (resid  81 and name HN   )    0.000    0.000    5.800
assign (resid  80 and name HN   ) (resid  80 and name HA   )    0.000    0.000    4.890
assign (resid  80 and name HN   ) (resid  80 and name HB1  )    0.000    0.000    5.100
assign (resid  80 and name HN   ) (resid  80 and name HB2  )    0.000    0.000    4.750
assign (resid  80 and name HN   ) (resid  80 and name HG1  )    0.000    0.000    5.190
assign (resid  80 and name HN   ) (resid  81 and name HD2# )    0.000    0.000    5.800
assign (resid  81 and name HA   ) (resid  81 and name HB1  )    0.000    0.000    5.280
assign (resid  81 and name HA   ) (resid  81 and name HD1# )    0.000    0.000    5.200
assign (resid  81 and name HA   ) (resid  82 and name HN   )    0.000    0.000    4.470
assign (resid  81 and name HB1  ) (resid  82 and name HN   )    0.000    0.000    5.510
assign (resid  81 and name HD2# ) (resid  82 and name HN   )    0.000    0.000    5.800
assign (resid  81 and name HN   ) (resid  81 and name HB1  )    0.000    0.000    4.170
assign (resid  81 and name HN   ) (resid  81 and name HD1# )    0.000    0.000    5.800
assign (resid  81 and name HN   ) (resid  82 and name HN   )    0.000    0.000    3.560
assign (resid  82 and name HA   ) (resid  82 and name HB#  )    0.000    0.000    4.200
assign (resid  82 and name HA   ) (resid  83 and name HN   )    0.000    0.000    4.490
assign (resid  82 and name HA   ) (resid  85 and name HN   )    0.000    0.000    5.800
assign (resid  82 and name HA   ) (resid  86 and name HN   )    0.000    0.000    5.800
assign (resid  82 and name HB#  ) (resid  83 and name HN   )    0.000    0.000    5.710
assign (resid  82 and name HN   ) (resid  82 and name HA   )    0.000    0.000    4.760
assign (resid  82 and name HN   ) (resid  82 and name HB#  )    0.000    0.000    4.410
assign (resid  83 and name HA   ) (resid  83 and name HB1  )    0.000    0.000    4.540
assign (resid  83 and name HA   ) (resid  83 and name HG1  )    0.000    0.000    5.070
assign (resid  83 and name HA   ) (resid  84 and name HN   )    0.000    0.000    4.800
assign (resid  83 and name HB1  ) (resid  84 and name HN   )    0.000    0.000    5.800
assign (resid  83 and name HG1  ) (resid  84 and name HN   )    0.000    0.000    5.800
assign (resid  83 and name HN   ) (resid  83 and name HB1  )    0.000    0.000    4.810
assign (resid  83 and name HN   ) (resid  83 and name HG1  )    0.000    0.000    5.470
assign (resid  84 and name HA   ) (resid  84 and name HD#  )    0.000    0.000    5.350
assign (resid  84 and name HA   ) (resid  85 and name HN   )    0.000    0.000    5.030
assign (resid  84 and name HB1  ) (resid  85 and name HN   )    0.000    0.000    5.800
assign (resid  84 and name HB2  ) (resid  85 and name HN   )    0.000    0.000    5.800
assign (resid  84 and name HB2  ) (resid  86 and name HN   )    0.000    0.000    5.800
assign (resid  84 and name HD#  ) (resid  84 and name HB1  )    0.000    0.000    5.800
assign (resid  84 and name HD#  ) (resid  84 and name HB2  )    0.000    0.000    5.800
assign (resid  84 and name HN   ) (resid  84 and name HA   )    0.000    0.000    5.230
assign (resid  84 and name HN   ) (resid  84 and name HB1  )    0.000    0.000    5.650
assign (resid  84 and name HN   ) (resid  84 and name HB2  )    0.000    0.000    4.880
assign (resid  84 and name HN   ) (resid  85 and name HN   )    0.000    0.000    4.850
assign (resid  85 and name HA1  ) (resid  86 and name HN   )    0.000    0.000    5.390
assign (resid  85 and name HA1  ) (resid  86 and name HN   )    0.000    0.000    5.800
assign (resid  85 and name HN   ) (resid  85 and name HA1  )    0.000    0.000    4.880
assign (resid  85 and name HN   ) (resid  85 and name HA1  )    0.000    0.000    5.070
assign (resid  85 and name HN   ) (resid  86 and name HN   )    0.000    0.000    5.640
assign (resid  86 and name HA   ) (resid  86 and name HB   )    0.000    0.000    5.570
assign (resid  86 and name HA   ) (resid  86 and name HD1# )    0.000    0.000    5.800
assign (resid  86 and name HA   ) (resid  86 and name HG2# )    0.000    0.000    5.800
assign (resid  86 and name HA   ) (resid  87 and name HN   )    0.000    0.000    5.570
assign (resid  86 and name HB   ) (resid  87 and name HN   )    0.000    0.000    5.800
assign (resid  86 and name HG11 ) (resid  87 and name HN   )    0.000    0.000    5.800
assign (resid  86 and name HG12 ) (resid  87 and name HN   )    0.000    0.000    5.800
assign (resid  86 and name HG2# ) (resid  87 and name HN   )    0.000    0.000    5.800
assign (resid  86 and name HN   ) (resid  86 and name HA   )    0.000    0.000    5.800
assign (resid  86 and name HN   ) (resid  86 and name HB   )    0.000    0.000    5.460
assign (resid  86 and name HN   ) (resid  86 and name HG11 )    0.000    0.000    5.800
assign (resid  86 and name HN   ) (resid  86 and name HG12 )    0.000    0.000    5.800
assign (resid  86 and name HN   ) (resid  87 and name HN   )    0.000    0.000    5.800
assign (resid  87 and name HN   ) (resid  87 and name HA   )    0.000    0.000    5.800
!Dihedral Angle Restraints
assign
     (segi "    " and resi 3 and name c ) (segi "    " and resi 4 and name n ) 
     (segi "    " and resi 4 and name ca ) (segi "    " and resi 4 and name c ) 
         1 -89.375 39.925 2
assign
     (segi "    " and resi 4 and name n ) (segi "    " and resi 4 and name ca ) 
     (segi "    " and resi 4 and name c ) (segi "    " and resi 5 and name n ) 
         1 147.27 31.52 2
assign
     (segi "    " and resi 5 and name n ) (segi "    " and resi 5 and name ca ) 
     (segi "    " and resi 5 and name c ) (segi "    " and resi 6 and name n ) 
         1 136.59 49.72 2
assign
     (segi "    " and resi 6 and name n ) (segi "    " and resi 6 and name ca ) 
     (segi "    " and resi 6 and name c ) (segi "    " and resi 7 and name n ) 
         1 147.8 16.98 2
assign
     (segi "    " and resi 20 and name c ) (segi "    " and resi 21 and name n )
     (segi "    " and resi 21 and name ca ) (segi "    " and resi 21 and name c ) 
         1 -99.885 37.515 2
assign
     (segi "    " and resi 21 and name n ) (segi "    " and resi 21 and name ca ) 
     (segi "    " and resi 21 and name c ) (segi "    " and resi 22 and name n ) 
         1 130.35 33.54 2
assign
     (segi "    " and resi 21 and name c ) (segi "    " and resi 22 and name n ) 
     (segi "    " and resi 22 and name ca ) (segi "    " and resi 22 and name c ) 
         1 -97.82 45.08 2
assign
     (segi "    " and resi 22 and name n ) (segi "    " and resi 22 and name ca ) 
     (segi "    " and resi 22 and name c ) (segi "    " and resi 23 and name n ) 
         1 139.79 41.34 2
assign
     (segi "    " and resi 27 and name n ) (segi "    " and resi 27 and name ca ) 
     (segi "    " and resi 27 and name c ) (segi "    " and resi 28 and name n ) 
         1 151.6 29.52 2
assign
     (segi "    " and resi 28 and name n ) (segi "    " and resi 28 and name ca ) 
     (segi "    " and resi 28 and name c ) (segi "    " and resi 29 and name n ) 
         1 147.4 17.66 2
assign
     (segi "    " and resi 40 and name c ) (segi "    " and resi 41 and name n ) 
     (segi "    " and resi 41 and name ca ) (segi "    " and resi 41 and name c ) 
         1 -92.715 54.585 2
assign
     (segi "    " and resi 41 and name n ) (segi "    " and resi 41 and name ca ) 
     (segi "    " and resi 41 and name c ) (segi "    " and resi 42 and name n ) 
         1 138.19 54.74 2
assign
     (segi "    " and resi 42 and name n ) (segi "    " and resi 42 and name ca ) 
     (segi "    " and resi 42 and name c ) (segi "    " and resi 43 and name n ) 
         1 165.595 13.025 2
assign
     (segi "    " and resi 43 and name n ) (segi "    " and resi 43 and name ca ) 
     (segi "    " and resi 43 and name c ) (segi "    " and resi 44 and name n ) 
         1 144.09 20.76 2
assign
     (segi "    " and resi 53 and name c ) (segi "    " and resi 54 and name n ) 
     (segi "    " and resi 54 and name ca ) (segi "    " and resi 54 and name c ) 
         1 -98.975 52.425 2
assign
     (segi "    " and resi 54 and name n ) (segi "    " and resi 54 and name ca ) 
     (segi "    " and resi 54 and name c ) (segi "    " and resi 55 and name n ) 
         1 133.255 53.475 2
assign
     (segi "    " and resi 62 and name c ) (segi "    " and resi 63 and name n ) 
     (segi "    " and resi 63 and name ca ) (segi "    " and resi 63 and name c ) 
         1 -60 10 2
assign
     (segi "    " and resi 66 and name c ) (segi "    " and resi 67 and name n ) 
     (segi "    " and resi 67 and name ca ) (segi "    " and resi 67 and name c ) 
         1 -101.215 33.085 2
assign
     (segi "    " and resi 67 and name n ) (segi "    " and resi 67 and name ca ) 
     (segi "    " and resi 67 and name c ) (segi "    " and resi 68 and name n ) 
         1 125.97 34.24 2
assign
     (segi "    " and resi 67 and name c ) (segi "    " and resi 68 and name n ) 
     (segi "    " and resi 68 and name ca ) (segi "    " and resi 68 and name c ) 
         1 -94.52 28.38 2
assign
     (segi "    " and resi 68 and name n ) (segi "    " and resi 68 and name ca ) 
     (segi "    " and resi 68 and name c ) (segi "    " and resi 69 and name n ) 
         1 121.55 55.12 2
assign
     (segi "    " and resi 69 and name c ) (segi "    " and resi 70 and name n ) 
     (segi "    " and resi 70 and name ca ) (segi "    " and resi 70 and name c ) 
         1 -70 10 2
assign
     (segi "    " and resi 71 and name c ) (segi "    " and resi 72 and name n ) 
     (segi "    " and resi 72 and name ca ) (segi "    " and resi 72 and name c ) 
         1 -67 10 2
assign
     (segi "    " and resi 72 and name c ) (segi "    " and resi 73 and name n ) 
     (segi "    " and resi 73 and name ca ) (segi "    " and resi 73 and name c ) 
         1 -65 15 2
assign
     (segi "    " and resi 76 and name c ) (segi "    " and resi 77 and name n ) 
     (segi "    " and resi 77 and name ca ) (segi "    " and resi 77 and name c ) 
         1 -62 10 2
assign
     (segi "    " and resi 80 and name c ) (segi "    " and resi 81 and name n ) 
     (segi "    " and resi 81 and name ca ) (segi "    " and resi 81 and name c ) 
         1 -75.64 24.06 2
assign
     (segi "    " and resi 81 and name n ) (segi "    " and resi 81 and name ca ) 
     (segi "    " and resi 81 and name c ) (segi "    " and resi 82 and name n ) 
         1 -21.77 46.48 2
assign
     (segi "    " and resi 81 and name c ) (segi "    " and resi 82 and name n ) 
     (segi "    " and resi 82 and name ca ) (segi "    " and resi 82 and name c ) 
         1 -58 10 2
assign
     (segi "    " and resi 86 and name c ) (segi "    " and resi 87 and name n ) 
     (segi "    " and resi 87 and name ca ) (segi "    " and resi 87 and name c ) 
         1 -67.61 12.78 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1  54.486  27.236   5.618
    2    HB2  MET   1           HB2      MET   1  52.688  25.250   5.805
    3    HB3  MET   1           HB1      MET   1  52.246  26.933   6.091
    4    HG2  MET   1           HG2      MET   1  52.103  25.737   3.325
    5    HG3  MET   1           HG1      MET   1  50.767  25.566   4.463
    6    HE1  MET   1           HE1      MET   1  49.987  27.509   5.901
    7    HE2  MET   1           HE2      MET   1  48.854  27.320   4.565
    8    HE3  MET   1           HE3      MET   1  49.353  28.933   5.068
    9    H    ASN   2           HN       ASN   2  56.395  26.151   5.447
   10    HA   ASN   2           HA       ASN   2  57.965  24.547   4.708
   11    HB2  ASN   2           HB2      ASN   2  57.218  22.234   5.242
   12    HB3  ASN   2           HB1      ASN   2  56.833  23.374   6.531
   13   HD21  ASN   2          HD21      ASN   2  55.438  21.331   4.015
   14   HD22  ASN   2          HD22      ASN   2  53.819  21.553   4.477
   15    H    LEU   3           HN       LEU   3  57.540  22.045   3.454
   16    HA   LEU   3           HA       LEU   3  57.097  22.959   0.701
   17    HG   LEU   3           HG       LEU   3  59.288  22.212  -0.076
   18    HB2  LEU   3           HB2      LEU   3  57.997  20.363   1.953
   19    HB3  LEU   3           HB1      LEU   3  57.623  20.467   0.232
   20   HD11  LEU   3          HD11      LEU   3  60.773  22.731   1.973
   21   HD12  LEU   3          HD12      LEU   3  59.454  22.063   2.935
   22   HD13  LEU   3          HD13      LEU   3  59.177  23.480   1.922
   23   HD21  LEU   3          HD21      LEU   3  60.431  19.978   1.632
   24   HD22  LEU   3          HD22      LEU   3  61.313  20.939   0.445
   25   HD23  LEU   3          HD23      LEU   3  60.044  19.833  -0.082
   26    H    GLU   4           HN       GLU   4  55.657  21.642  -0.763
   27    HA   GLU   4           HA       GLU   4  52.991  21.538   0.281
   28    HB2  GLU   4           HB2      GLU   4  54.261  20.541  -2.273
   29    HB3  GLU   4           HB1      GLU   4  52.548  20.292  -1.937
   30    HG2  GLU   4           HG2      GLU   4  52.161  22.668  -1.768
   31    HG3  GLU   4           HG1      GLU   4  53.891  23.006  -1.850
   32    HA   PRO   5           HA       PRO   5  52.463  17.656   2.308
   33    HB2  PRO   5           HB2      PRO   5  50.518  17.054   0.101
   34    HB3  PRO   5           HB1      PRO   5  50.331  16.840   1.853
   35    HG2  PRO   5           HG2      PRO   5  49.256  18.919   0.543
   36    HG3  PRO   5           HG1      PRO   5  49.846  19.048   2.207
   37    HD2  PRO   5           HD2      PRO   5  50.972  20.220  -0.253
   38    HD3  PRO   5           HD1      PRO   5  51.276  20.658   1.442
   39    HA   PRO   6           HA       PRO   6  55.106  15.219  -0.471
   40    HB2  PRO   6           HB2      PRO   6  56.196  13.597   1.410
   41    HB3  PRO   6           HB1      PRO   6  56.691  15.290   1.219
   42    HG2  PRO   6           HG2      PRO   6  54.876  14.074   3.236
   43    HG3  PRO   6           HG1      PRO   6  56.074  15.364   3.425
   44    HD2  PRO   6           HD2      PRO   6  53.344  15.794   3.166
   45    HD3  PRO   6           HD1      PRO   6  54.591  17.003   2.790
   46    H    LYS   7           HN       LYS   7  55.164  12.957  -1.185
   47    HA   LYS   7           HA       LYS   7  52.571  11.643  -0.908
   48    HB2  LYS   7           HB2      LYS   7  55.050  10.549  -2.260
   49    HB3  LYS   7           HB1      LYS   7  53.371  10.112  -2.576
   50    HG2  LYS   7           HG2      LYS   7  52.925  12.412  -3.369
   51    HG3  LYS   7           HG1      LYS   7  54.613  12.834  -3.075
   52    HD2  LYS   7           HD2      LYS   7  55.224  10.905  -4.635
   53    HD3  LYS   7           HD1      LYS   7  53.519  10.858  -5.087
   54    HE2  LYS   7           HE2      LYS   7  53.620  13.201  -5.803
   55    HE3  LYS   7           HE1      LYS   7  55.306  13.300  -5.297
   56    HZ1  LYS   7           HZ1      LYS   7  55.959  12.374  -7.186
   57    HZ2  LYS   7           HZ2      LYS   7  54.366  12.517  -7.757
   58    HZ3  LYS   7           HZ3      LYS   7  54.878  11.078  -7.014
   59    H    ALA   8           HN       ALA   8  53.115  11.508   1.572
   60    HA   ALA   8           HA       ALA   8  54.922   9.314   2.304
   61    HB1  ALA   8           HB1      ALA   8  54.077   9.753   4.609
   62    HB2  ALA   8           HB2      ALA   8  52.947  10.932   3.944
   63    HB3  ALA   8           HB3      ALA   8  54.684  11.212   3.828
   64    H    GLU   9           HN       GLU   9  53.581   7.860   0.766
   65    HA   GLU   9           HA       GLU   9  51.885   6.169   2.409
   66    HB2  GLU   9           HB2      GLU   9  50.406   8.139   1.542
   67    HB3  GLU   9           HB1      GLU   9  50.506   7.317  -0.015
   68    HG2  GLU   9           HG2      GLU   9  49.556   6.040   2.568
   69    HG3  GLU   9           HG1      GLU   9  48.504   6.608   1.272
   70    H1U  RCY  10           H1U      RCY  10  58.899   1.307  -3.770
   71    H1S  RCY  10           H1S      RCY  10  56.000   4.608  -4.473
   72    HB1  RCY  10           HB1      RCY  10  54.498   3.799  -2.175
   73    HB2  RCY  10           HB2      RCY  10  54.588   4.965  -0.855
   74    HA   RCY  10           HA       RCY  10  52.440   5.371  -2.887
   75    HN1  RCY  10           HN1      RCY  10  51.955   6.827  -1.108
   76    H    ARG  11           HN       ARG  11  50.624   4.047  -3.025
   77    HA   ARG  11           HA       ARG  11  50.224   1.831  -1.161
   78    HE   ARG  11           HE       ARG  11  46.980  -1.193  -0.535
   79    HB2  ARG  11           HB2      ARG  11  48.527   3.281  -2.729
   80    HB3  ARG  11           HB1      ARG  11  48.740   1.852  -3.738
   81    HG2  ARG  11           HG2      ARG  11  47.954   1.797  -0.808
   82    HG3  ARG  11           HG1      ARG  11  46.831   1.608  -2.155
   83    HD2  ARG  11           HD2      ARG  11  48.425  -0.303  -2.919
   84    HD3  ARG  11           HD1      ARG  11  49.028  -0.249  -1.262
   85   HH11  ARG  11          HH21      ARG  11  46.837  -0.041  -3.782
   86   HH12  ARG  11          HH22      ARG  11  45.287  -0.743  -4.103
   87   HH21  ARG  11          HH11      ARG  11  44.956  -2.116  -0.936
   88   HH22  ARG  11          HH12      ARG  11  44.222  -1.918  -2.492
   89    H    SER  12           HN       SER  12  51.992   2.329  -4.052
   90    HA   SER  12           HA       SER  12  51.908  -0.093  -5.414
   91    HG   SER  12           HG       SER  12  53.646   1.669  -7.262
   92    HB2  SER  12           HB2      SER  12  54.317   1.610  -4.730
   93    HB3  SER  12           HB1      SER  12  54.365   0.274  -5.876
   94    H    ALA  13           HN       ALA  13  53.709   0.617  -2.421
   95    HA   ALA  13           HA       ALA  13  55.066  -1.836  -2.138
   96    HB1  ALA  13           HB1      ALA  13  53.845  -0.024  -0.039
   97    HB2  ALA  13           HB2      ALA  13  55.518  -0.036  -0.596
   98    HB3  ALA  13           HB3      ALA  13  54.893  -1.389   0.346
   99    H    THR  14           HN       THR  14  54.403  -3.477  -0.297
  100    HA   THR  14           HA       THR  14  51.520  -3.979  -0.104
  101    HB   THR  14           HB       THR  14  53.297  -5.946  -1.580
  102    HG1  THR  14           HG1      THR  14  52.818  -4.558  -3.109
  103   HG21  THR  14          HG21      THR  14  51.139  -7.129  -1.961
  104   HG22  THR  14          HG22      THR  14  50.342  -5.961  -0.907
  105   HG23  THR  14          HG23      THR  14  51.569  -7.046  -0.252
  106    H    ARG  15           HN       ARG  15  54.108  -6.397  -0.054
  107    HA   ARG  15           HA       ARG  15  53.666  -6.667   2.894
  108    HE   ARG  15           HE       ARG  15  56.220 -11.068  -1.075
  109    HB2  ARG  15           HB2      ARG  15  54.587  -8.983   2.560
  110    HB3  ARG  15           HB1      ARG  15  53.079  -8.691   1.691
  111    HG2  ARG  15           HG2      ARG  15  54.382  -8.182  -0.361
  112    HG3  ARG  15           HG1      ARG  15  55.870  -8.550   0.513
  113    HD2  ARG  15           HD2      ARG  15  55.022 -10.844   0.949
  114    HD3  ARG  15           HD1      ARG  15  53.578 -10.471   0.006
  115   HH11  ARG  15          HH21      ARG  15  53.212  -9.438  -1.503
  116   HH12  ARG  15          HH22      ARG  15  53.311  -9.429  -3.232
  117   HH21  ARG  15          HH11      ARG  15  56.367 -11.065  -3.331
  118   HH22  ARG  15          HH12      ARG  15  55.097 -10.350  -4.267
  119    H    VAL  16           HN       VAL  16  55.791  -5.322   0.770
  120    HA   VAL  16           HA       VAL  16  58.279  -6.221   2.051
  121    HB   VAL  16           HB       VAL  16  57.979  -3.845   0.208
  122   HG11  VAL  16          HG11      VAL  16  60.263  -4.336  -0.359
  123   HG12  VAL  16          HG12      VAL  16  60.201  -5.885   0.481
  124   HG13  VAL  16          HG13      VAL  16  60.158  -4.380   1.401
  125   HG21  VAL  16          HG21      VAL  16  58.021  -6.799  -0.460
  126   HG22  VAL  16          HG22      VAL  16  58.453  -5.552  -1.630
  127   HG23  VAL  16          HG23      VAL  16  56.826  -5.599  -0.952
  128    H    MET  17           HN       MET  17  56.615  -5.231   4.009
  129    HA   MET  17           HA       MET  17  58.225  -3.141   5.168
  130    HB2  MET  17           HB2      MET  17  56.792  -1.889   3.449
  131    HB3  MET  17           HB1      MET  17  55.409  -2.285   4.471
  132    HG2  MET  17           HG2      MET  17  56.125  -0.137   5.206
  133    HG3  MET  17           HG1      MET  17  56.749  -1.266   6.409
  134    HE1  MET  17           HE1      MET  17  57.927   0.997   6.910
  135    HE2  MET  17           HE2      MET  17  57.849   1.897   5.397
  136    HE3  MET  17           HE3      MET  17  59.414   1.548   6.128
  137    H    GLY  18           HN       GLY  18  57.746  -2.907   7.390
  138    HA2  GLY  18           HA2      GLY  18  56.472  -3.238   9.388
  139    HA3  GLY  18           HA1      GLY  18  55.299  -4.172   8.458
  140    H    GLY  19           HN       GLY  19  55.638  -5.612  10.459
  141    HA2  GLY  19           HA2      GLY  19  56.294  -7.835  10.991
  142    HA3  GLY  19           HA1      GLY  19  57.495  -7.761   9.701
  143    HA   PRO  20           HA       PRO  20  59.227  -7.396  14.236
  144    HB2  PRO  20           HB2      PRO  20  60.975  -9.400  12.844
  145    HB3  PRO  20           HB1      PRO  20  60.465  -9.340  14.543
  146    HG2  PRO  20           HG2      PRO  20  59.329 -11.001  12.782
  147    HG3  PRO  20           HG1      PRO  20  58.412 -10.255  14.100
  148    HD2  PRO  20           HD2      PRO  20  58.282  -9.703  11.195
  149    HD3  PRO  20           HD1      PRO  20  57.078  -9.373  12.460
  150    H1U  RCY  21           H1U      RCY  21  63.190  -3.517   5.516
  151    H1S  RCY  21           H1S      RCY  21  61.261  -3.162   9.328
  152    HB1  RCY  21           HB1      RCY  21  60.622  -3.050  12.193
  153    HB2  RCY  21           HB2      RCY  21  60.842  -4.326  10.996
  154    HA   RCY  21           HA       RCY  21  62.701  -5.234  12.470
  155    HN1  RCY  21           HN1      RCY  21  60.067  -5.306  13.866
  156    H    THR  22           HN       THR  22  64.205  -4.378  13.806
  157    HA   THR  22           HA       THR  22  63.401  -2.272  15.745
  158    HB   THR  22           HB       THR  22  64.765  -3.477  17.509
  159    HG1  THR  22           HG1      THR  22  65.884  -4.990  16.489
  160   HG21  THR  22          HG21      THR  22  62.944  -4.998  18.113
  161   HG22  THR  22          HG22      THR  22  62.324  -4.940  16.463
  162   HG23  THR  22          HG23      THR  22  62.283  -3.494  17.473
  163    HA   PRO  23           HA       PRO  23  67.156  -0.943  13.439
  164    HB2  PRO  23           HB2      PRO  23  66.567   1.441  15.151
  165    HB3  PRO  23           HB1      PRO  23  66.961   1.364  13.422
  166    HG2  PRO  23           HG2      PRO  23  64.472   1.789  14.261
  167    HG3  PRO  23           HG1      PRO  23  64.809   0.808  12.824
  168    HD2  PRO  23           HD2      PRO  23  63.938  -0.074  15.542
  169    HD3  PRO  23           HD1      PRO  23  63.610  -0.809  13.957
  170    H    ARG  24           HN       ARG  24  69.249   0.130  14.329
  171    HA   ARG  24           HA       ARG  24  69.727  -0.511  17.194
  172    HE   ARG  24           HE       ARG  24  72.830  -3.846  14.872
  173    HB2  ARG  24           HB2      ARG  24  71.428  -1.544  14.902
  174    HB3  ARG  24           HB1      ARG  24  71.803  -1.724  16.616
  175    HG2  ARG  24           HG2      ARG  24  69.510  -2.859  16.835
  176    HG3  ARG  24           HG1      ARG  24  69.511  -2.947  15.074
  177    HD2  ARG  24           HD2      ARG  24  71.634  -4.102  16.906
  178    HD3  ARG  24           HD1      ARG  24  70.410  -5.025  16.035
  179   HH11  ARG  24          HH21      ARG  24  69.635  -5.058  14.411
  180   HH12  ARG  24          HH22      ARG  24  69.879  -5.442  12.740
  181   HH21  ARG  24          HH11      ARG  24  73.167  -4.340  12.693
  182   HH22  ARG  24          HH12      ARG  24  71.878  -5.035  11.767
  183    H    LYS  25           HN       LYS  25  70.447   1.415  17.968
  184    HA   LYS  25           HA       LYS  25  71.605   3.457  18.081
  185    HB2  LYS  25           HB2      LYS  25  73.604   2.026  16.306
  186    HB3  LYS  25           HB1      LYS  25  73.925   3.374  17.396
  187    HG2  LYS  25           HG2      LYS  25  72.806   0.751  18.395
  188    HG3  LYS  25           HG1      LYS  25  74.542   1.031  18.256
  189    HD2  LYS  25           HD2      LYS  25  74.197   3.133  19.646
  190    HD3  LYS  25           HD1      LYS  25  72.558   2.558  19.956
  191    HE2  LYS  25           HE2      LYS  25  73.399   0.535  20.992
  192    HE3  LYS  25           HE1      LYS  25  75.055   0.943  20.541
  193    HZ1  LYS  25           HZ1      LYS  25  74.789   1.574  22.781
  194    HZ2  LYS  25           HZ2      LYS  25  73.303   2.341  22.479
  195    HZ3  LYS  25           HZ3      LYS  25  74.746   3.016  21.889
  196    H    GLY  26           HN       GLY  26  69.764   2.867  15.739
  197    HA2  GLY  26           HA2      GLY  26  69.092   3.967  13.779
  198    HA3  GLY  26           HA1      GLY  26  70.062   5.325  14.351
  199    HA   PRO  27           HA       PRO  27  71.693   3.123  10.341
  200    HB2  PRO  27           HB2      PRO  27  71.708   6.045   9.667
  201    HB3  PRO  27           HB1      PRO  27  71.359   4.652   8.624
  202    HG2  PRO  27           HG2      PRO  27  69.417   6.203   9.605
  203    HG3  PRO  27           HG1      PRO  27  69.202   4.461   9.371
  204    HD2  PRO  27           HD2      PRO  27  69.486   5.985  11.899
  205    HD3  PRO  27           HD1      PRO  27  68.735   4.400  11.616
  206    HA   PRO  28           HA       PRO  28  75.971   3.633  11.367
  207    HB2  PRO  28           HB2      PRO  28  76.329   4.670   8.574
  208    HB3  PRO  28           HB1      PRO  28  77.257   3.430   9.441
  209    HG2  PRO  28           HG2      PRO  28  75.415   2.799   7.606
  210    HG3  PRO  28           HG1      PRO  28  75.708   1.793   9.033
  211    HD2  PRO  28           HD2      PRO  28  73.378   3.511   8.409
  212    HD3  PRO  28           HD1      PRO  28  73.496   2.135   9.526
  213    H    LYS  29           HN       LYS  29  77.612   5.326  11.710
  214    HA   LYS  29           HA       LYS  29  76.382   8.018  11.879
  215    HB2  LYS  29           HB2      LYS  29  78.976   6.901  12.989
  216    HB3  LYS  29           HB1      LYS  29  78.406   8.550  13.249
  217    HG2  LYS  29           HG2      LYS  29  76.520   7.820  14.493
  218    HG3  LYS  29           HG1      LYS  29  76.701   6.154  13.941
  219    HD2  LYS  29           HD2      LYS  29  78.973   7.401  15.437
  220    HD3  LYS  29           HD1      LYS  29  77.553   6.890  16.350
  221    HE2  LYS  29           HE2      LYS  29  77.787   4.633  15.669
  222    HE3  LYS  29           HE1      LYS  29  78.889   5.056  14.359
  223    HZ1  LYS  29           HZ1      LYS  29  80.633   5.096  15.734
  224    HZ2  LYS  29           HZ2      LYS  29  79.653   4.194  16.788
  225    HZ3  LYS  29           HZ3      LYS  29  79.781   5.878  16.975
  226    H1U  RCY  30           H1U      RCY  30  76.408   8.075   0.830
  227    H1S  RCY  30           H1S      RCY  30  76.228   9.171   4.974
  228    HB1  RCY  30           HB1      RCY  30  76.666  10.345   7.527
  229    HB2  RCY  30           HB2      RCY  30  76.653   8.604   7.248
  230    HA   RCY  30           HA       RCY  30  79.035   8.618   8.249
  231    HN1  RCY  30           HN1      RCY  30  76.506   8.753   9.717
  232    H    LYS  31           HN       LYS  31  78.012  11.545   7.387
  233    HA   LYS  31           HA       LYS  31  78.875  13.694   7.743
  234    HB2  LYS  31           HB2      LYS  31  77.976  12.658  10.356
  235    HB3  LYS  31           HB1      LYS  31  79.158  13.957  10.481
  236    HG2  LYS  31           HG2      LYS  31  76.805  14.205   8.615
  237    HG3  LYS  31           HG1      LYS  31  76.641  14.600  10.326
  238    HD2  LYS  31           HD2      LYS  31  78.765  15.784   8.518
  239    HD3  LYS  31           HD1      LYS  31  77.233  16.576   8.885
  240    HE2  LYS  31           HE2      LYS  31  78.388  17.486  10.625
  241    HE3  LYS  31           HE1      LYS  31  78.095  15.926  11.395
  242    HZ1  LYS  31           HZ1      LYS  31  80.547  17.061  10.498
  243    HZ2  LYS  31           HZ2      LYS  31  80.288  15.534   9.799
  244    HZ3  LYS  31           HZ3      LYS  31  80.287  15.709  11.489
  245    H    GLN  32           HN       GLN  32  80.702  11.154   7.838
  246    HA   GLN  32           HA       GLN  32  83.176  12.605   8.083
  247    HB2  GLN  32           HB2      GLN  32  82.406  12.209  10.530
  248    HB3  GLN  32           HB1      GLN  32  82.824  10.521  10.237
  249    HG2  GLN  32           HG2      GLN  32  85.109  11.170   9.620
  250    HG3  GLN  32           HG1      GLN  32  84.702  12.871   9.851
  251   HE21  GLN  32          HE21      GLN  32  84.872  13.702  11.965
  252   HE22  GLN  32          HE22      GLN  32  85.168  12.753  13.341
  253    H    ARG  33           HN       ARG  33  82.028  10.937   6.117
  254    HA   ARG  33           HA       ARG  33  82.738   8.231   6.111
  255    HE   ARG  33           HE       ARG  33  81.279   7.522   5.452
  256    HB2  ARG  33           HB2      ARG  33  81.540   9.496   4.268
  257    HB3  ARG  33           HB1      ARG  33  83.117  10.088   3.747
  258    HG2  ARG  33           HG2      ARG  33  83.228   8.204   2.491
  259    HG3  ARG  33           HG1      ARG  33  83.547   7.366   4.010
  260    HD2  ARG  33           HD2      ARG  33  80.880   7.727   2.627
  261    HD3  ARG  33           HD1      ARG  33  81.714   6.214   2.981
  262   HH11  ARG  33          HH21      ARG  33  79.529   6.153   2.815
  263   HH12  ARG  33          HH22      ARG  33  78.170   5.690   3.784
  264   HH21  ARG  33          HH11      ARG  33  79.514   6.925   6.733
  265   HH22  ARG  33          HH12      ARG  33  78.162   6.127   6.002
  266    H    GLN  34           HN       GLN  34  84.678   7.346   6.617
  267    HA   GLN  34           HA       GLN  34  87.105   8.278   5.273
  268    HB2  GLN  34           HB2      GLN  34  86.859   9.772   7.307
  269    HB3  GLN  34           HB1      GLN  34  87.036   8.326   8.300
  270    HG2  GLN  34           HG2      GLN  34  89.238   9.139   8.164
  271    HG3  GLN  34           HG1      GLN  34  89.194   7.907   6.902
  272   HE21  GLN  34          HE21      GLN  34  89.946  11.176   7.491
  273   HE22  GLN  34          HE22      GLN  34  89.976  11.710   5.881
  274    H    THR  35           HN       THR  35  86.900   6.600   8.382
  275    HA   THR  35           HA       THR  35  87.132   3.965   7.099
  276    HB   THR  35           HB       THR  35  89.289   3.489   8.361
  277    HG1  THR  35           HG1      THR  35  89.496   6.307   8.393
  278   HG21  THR  35          HG21      THR  35  89.575   5.684   6.302
  279   HG22  THR  35          HG22      THR  35  89.083   4.044   5.878
  280   HG23  THR  35          HG23      THR  35  90.666   4.330   6.602
  281    H    ARG  36           HN       ARG  36  85.233   5.192   8.901
  282    HA   ARG  36           HA       ARG  36  85.791   3.946  11.531
  283    HE   ARG  36           HE       ARG  36  83.556   8.979  10.910
  284    HB2  ARG  36           HB2      ARG  36  83.402   5.559  10.582
  285    HB3  ARG  36           HB1      ARG  36  83.700   5.039  12.239
  286    HG2  ARG  36           HG2      ARG  36  84.667   7.111  12.407
  287    HG3  ARG  36           HG1      ARG  36  86.056   6.267  11.722
  288    HD2  ARG  36           HD2      ARG  36  85.801   8.178  10.345
  289    HD3  ARG  36           HD1      ARG  36  85.056   6.873   9.421
  290   HH11  ARG  36          HH21      ARG  36  83.783   6.359   8.681
  291   HH12  ARG  36          HH22      ARG  36  82.188   6.587   8.045
  292   HH21  ARG  36          HH11      ARG  36  81.472   9.292  10.093
  293   HH22  ARG  36          HH12      ARG  36  80.880   8.248   8.844
  294    H    GLN  37           HN       GLN  37  84.319   3.146   8.579
  295    HA   GLN  37           HA       GLN  37  82.926   0.844   9.887
  296    HB2  GLN  37           HB2      GLN  37  81.215   2.463   9.204
  297    HB3  GLN  37           HB1      GLN  37  81.895   2.521   7.578
  298    HG2  GLN  37           HG2      GLN  37  81.293   0.251   7.140
  299    HG3  GLN  37           HG1      GLN  37  80.921  -0.049   8.839
  300   HE21  GLN  37          HE21      GLN  37  78.670  -0.512   8.634
  301   HE22  GLN  37          HE22      GLN  37  77.541   0.613   8.049
  302    H1U  RCY  38           H1U      RCY  38  85.066   5.237  -0.705
  303    H1S  RCY  38           H1S      RCY  38  83.120   1.470   1.670
  304    HB1  RCY  38           HB1      RCY  38  86.281   1.433   4.487
  305    HB2  RCY  38           HB2      RCY  38  84.738   2.238   4.768
  306    HA   RCY  38           HA       RCY  38  84.350  -0.450   5.547
  307    HN1  RCY  38           HN1      RCY  38  84.182   2.145   6.802
  308    H    LYS  39           HN       LYS  39  85.600  -1.979   6.556
  309    HA   LYS  39           HA       LYS  39  88.489  -1.437   6.787
  310    HB2  LYS  39           HB2      LYS  39  88.578  -2.243   9.135
  311    HB3  LYS  39           HB1      LYS  39  87.654  -0.747   8.990
  312    HG2  LYS  39           HG2      LYS  39  85.556  -2.101   8.893
  313    HG3  LYS  39           HG1      LYS  39  86.518  -3.552   9.175
  314    HD2  LYS  39           HD2      LYS  39  86.821  -1.244  11.060
  315    HD3  LYS  39           HD1      LYS  39  85.397  -2.274  11.206
  316    HE2  LYS  39           HE2      LYS  39  86.753  -4.237  11.525
  317    HE3  LYS  39           HE1      LYS  39  88.224  -3.355  11.115
  318    HZ1  LYS  39           HZ1      LYS  39  87.246  -1.871  13.114
  319    HZ2  LYS  39           HZ2      LYS  39  88.384  -3.115  13.322
  320    HZ3  LYS  39           HZ3      LYS  39  86.734  -3.415  13.594
  321    H    SER  40           HN       SER  40  89.681  -3.312   6.476
  322    HA   SER  40           HA       SER  40  88.811  -5.961   7.005
  323    HG   SER  40           HG       SER  40  88.862  -4.638   3.532
  324    HB2  SER  40           HB2      SER  40  88.483  -6.563   4.473
  325    HB3  SER  40           HB1      SER  40  87.130  -5.889   5.376
  326    H    LYS  41           HN       LYS  41  90.139  -5.084   3.857
  327    HA   LYS  41           HA       LYS  41  92.833  -5.974   4.821
  328    HB2  LYS  41           HB2      LYS  41  91.324  -6.577   2.282
  329    HB3  LYS  41           HB1      LYS  41  93.085  -6.656   2.313
  330    HG2  LYS  41           HG2      LYS  41  93.015  -8.278   4.142
  331    HG3  LYS  41           HG1      LYS  41  91.257  -8.154   4.213
  332    HD2  LYS  41           HD2      LYS  41  91.184  -8.924   1.814
  333    HD3  LYS  41           HD1      LYS  41  92.918  -9.230   1.919
  334    HE2  LYS  41           HE2      LYS  41  92.376 -10.667   3.977
  335    HE3  LYS  41           HE1      LYS  41  90.693 -10.573   3.460
  336    HZ1  LYS  41           HZ1      LYS  41  91.600 -12.519   2.510
  337    HZ2  LYS  41           HZ2      LYS  41  92.987 -11.705   1.963
  338    HZ3  LYS  41           HZ3      LYS  41  91.478 -11.392   1.247
  339    HA   PRO  42           HA       PRO  42  94.769  -2.187   3.665
  340    HB2  PRO  42           HB2      PRO  42  96.228  -3.834   1.619
  341    HB3  PRO  42           HB1      PRO  42  96.871  -2.640   2.762
  342    HG2  PRO  42           HG2      PRO  42  97.052  -5.285   3.189
  343    HG3  PRO  42           HG1      PRO  42  96.884  -4.115   4.506
  344    HD2  PRO  42           HD2      PRO  42  94.937  -6.101   3.543
  345    HD3  PRO  42           HD1      PRO  42  94.953  -5.195   5.071
  346    HA   PRO  43           HA       PRO  43  92.560  -0.770   0.081
  347    HB2  PRO  43           HB2      PRO  43  94.054   1.413  -0.638
  348    HB3  PRO  43           HB1      PRO  43  92.986   1.388   0.779
  349    HG2  PRO  43           HG2      PRO  43  95.940   1.052   0.638
  350    HG3  PRO  43           HG1      PRO  43  94.957   1.925   1.826
  351    HD2  PRO  43           HD2      PRO  43  95.996  -0.564   2.302
  352    HD3  PRO  43           HD1      PRO  43  94.488   0.012   3.045
  353    H    LYS  44           HN       LYS  44  92.547  -1.284  -2.090
  354    HA   LYS  44           HA       LYS  44  94.997  -1.258  -3.680
  355    HB2  LYS  44           HB2      LYS  44  94.954  -3.481  -2.350
  356    HB3  LYS  44           HB1      LYS  44  93.619  -3.933  -3.409
  357    HG2  LYS  44           HG2      LYS  44  95.000  -3.670  -5.376
  358    HG3  LYS  44           HG1      LYS  44  96.315  -2.988  -4.419
  359    HD2  LYS  44           HD2      LYS  44  96.731  -5.369  -4.944
  360    HD3  LYS  44           HD1      LYS  44  96.555  -5.117  -3.207
  361    HE2  LYS  44           HE2      LYS  44  94.127  -5.793  -4.835
  362    HE3  LYS  44           HE1      LYS  44  95.248  -7.080  -4.391
  363    HZ1  LYS  44           HZ1      LYS  44  93.344  -5.721  -2.777
  364    HZ2  LYS  44           HZ2      LYS  44  94.901  -5.594  -2.107
  365    HZ3  LYS  44           HZ3      LYS  44  94.236  -7.123  -2.434
  366    H    LYS  45           HN       LYS  45  93.242  -3.583  -5.115
  367    HA   LYS  45           HA       LYS  45  91.016  -1.968  -6.124
  368    HB2  LYS  45           HB2      LYS  45  92.836  -1.040  -7.453
  369    HB3  LYS  45           HB1      LYS  45  93.382  -2.657  -7.893
  370    HG2  LYS  45           HG2      LYS  45  90.539  -2.184  -8.477
  371    HG3  LYS  45           HG1      LYS  45  91.628  -1.128  -9.378
  372    HD2  LYS  45           HD2      LYS  45  92.908  -3.095 -10.141
  373    HD3  LYS  45           HD1      LYS  45  91.819  -4.153  -9.244
  374    HE2  LYS  45           HE2      LYS  45  91.288  -3.910 -11.717
  375    HE3  LYS  45           HE1      LYS  45  89.952  -3.546 -10.625
  376    HZ1  LYS  45           HZ1      LYS  45  90.223  -1.875 -12.379
  377    HZ2  LYS  45           HZ2      LYS  45  91.782  -1.525 -11.802
  378    HZ3  LYS  45           HZ3      LYS  45  90.424  -1.212 -10.830
  379    H    GLY  46           HN       GLY  46  89.408  -3.320  -6.856
  380    HA2  GLY  46           HA2      GLY  46  88.407  -5.296  -7.693
  381    HA3  GLY  46           HA1      GLY  46  90.018  -5.977  -7.917
  382    H    VAL  47           HN       VAL  47  91.082  -6.923  -6.052
  383    HA   VAL  47           HA       VAL  47  89.530  -8.611  -4.467
  384    HB   VAL  47           HB       VAL  47  92.186  -7.347  -3.724
  385   HG11  VAL  47          HG11      VAL  47  90.677  -9.749  -2.665
  386   HG12  VAL  47          HG12      VAL  47  91.249  -8.348  -1.758
  387   HG13  VAL  47          HG13      VAL  47  92.405  -9.515  -2.401
  388   HG21  VAL  47          HG21      VAL  47  93.181  -9.301  -4.756
  389   HG22  VAL  47          HG22      VAL  47  92.083  -8.571  -5.927
  390   HG23  VAL  47          HG23      VAL  47  91.593 -10.015  -5.040
  391    H    GLN  48           HN       GLN  48  90.980  -5.532  -3.329
  392    HA   GLN  48           HA       GLN  48  89.309  -5.537  -0.942
  393    HB2  GLN  48           HB2      GLN  48  91.643  -4.470  -1.217
  394    HB3  GLN  48           HB1      GLN  48  90.808  -3.154  -2.041
  395    HG2  GLN  48           HG2      GLN  48  90.051  -4.137   0.722
  396    HG3  GLN  48           HG1      GLN  48  91.143  -2.781   0.437
  397   HE21  GLN  48          HE21      GLN  48  90.218  -0.872  -0.736
  398   HE22  GLN  48          HE22      GLN  48  88.547  -0.582  -0.674
  399    H    GLY  49           HN       GLY  49  89.575  -2.916  -3.353
  400    HA2  GLY  49           HA2      GLY  49  86.720  -3.007  -3.951
  401    HA3  GLY  49           HA1      GLY  49  87.163  -1.657  -2.905
  402    H1U  RCY  50           H1U      RCY  50  85.273   0.531  -0.101
  403    H1S  RCY  50           H1S      RCY  50  86.774   0.548  -4.316
  404    HB1  RCY  50           HB1      RCY  50  86.946   0.038  -6.916
  405    HB2  RCY  50           HB2      RCY  50  87.900   1.315  -7.669
  406    HA   RCY  50           HA       RCY  50  89.452  -0.028  -6.437
  407    HN1  RCY  50           HN1      RCY  50  88.173   0.121  -3.818
  408    H    GLY  51           HN       GLY  51  88.129   1.957  -3.821
  409    HA2  GLY  51           HA2      GLY  51  89.175   3.743  -2.685
  410    HA3  GLY  51           HA1      GLY  51  90.592   3.512  -3.711
  411    H    ASP  52           HN       ASP  52  87.173   4.478  -4.201
  412    HA   ASP  52           HA       ASP  52  87.863   6.201  -6.429
  413    HB2  ASP  52           HB2      ASP  52  85.600   5.078  -5.983
  414    HB3  ASP  52           HB1      ASP  52  85.326   6.349  -4.790
  415    H    ASP  53           HN       ASP  53  85.894   8.280  -5.204
  416    HA   ASP  53           HA       ASP  53  87.566   9.556  -3.149
  417    HB2  ASP  53           HB2      ASP  53  87.842  11.645  -4.499
  418    HB3  ASP  53           HB1      ASP  53  88.729  10.275  -5.169
  419    H    ILE  54           HN       ILE  54  85.014  10.339  -5.546
  420    HA   ILE  54           HA       ILE  54  83.261  11.141  -3.262
  421    HB   ILE  54           HB       ILE  54  83.582  12.696  -5.848
  422   HG12  ILE  54          HG12      ILE  54  84.422  13.431  -3.026
  423   HG13  ILE  54          HG11      ILE  54  85.531  12.881  -4.283
  424   HG21  ILE  54          HG21      ILE  54  82.135  14.343  -4.687
  425   HG22  ILE  54          HG22      ILE  54  81.982  13.233  -3.325
  426   HG23  ILE  54          HG23      ILE  54  81.316  12.795  -4.899
  427   HD11  ILE  54          HD11      ILE  54  83.872  15.409  -4.248
  428   HD12  ILE  54          HD12      ILE  54  84.625  14.794  -5.720
  429   HD13  ILE  54          HD13      ILE  54  85.627  15.265  -4.347
  430    HA   PRO  55           HA       PRO  55  81.270   8.022  -6.112
  431    HB2  PRO  55           HB2      PRO  55  79.827   7.551  -3.542
  432    HB3  PRO  55           HB1      PRO  55  80.532   6.378  -4.671
  433    HG2  PRO  55           HG2      PRO  55  81.691   6.945  -2.341
  434    HG3  PRO  55           HG1      PRO  55  82.643   6.603  -3.795
  435    HD2  PRO  55           HD2      PRO  55  82.128   9.229  -2.456
  436    HD3  PRO  55           HD1      PRO  55  83.567   8.676  -3.341
  437    H    GLY  56           HN       GLY  56  78.940   7.855  -6.704
  438    HA2  GLY  56           HA2      GLY  56  76.730   8.706  -6.889
  439    HA3  GLY  56           HA1      GLY  56  77.108   9.884  -5.632
  440    H    MET  57           HN       MET  57  79.462   9.745  -8.096
  441    HA   MET  57           HA       MET  57  78.153  11.726  -9.832
  442    HB2  MET  57           HB2      MET  57  79.119  12.967  -7.799
  443    HB3  MET  57           HB1      MET  57  80.708  12.529  -8.429
  444    HG2  MET  57           HG2      MET  57  80.231  13.667 -10.535
  445    HG3  MET  57           HG1      MET  57  78.589  14.024 -10.002
  446    HE1  MET  57           HE1      MET  57  79.230  16.361 -10.838
  447    HE2  MET  57           HE2      MET  57  79.479  17.568  -9.579
  448    HE3  MET  57           HE3      MET  57  78.128  16.444  -9.458
  449    H    GLU  58           HN       GLU  58  80.621   9.445  -9.120
  450    HA   GLU  58           HA       GLU  58  81.269   9.163 -11.939
  451    HB2  GLU  58           HB2      GLU  58  83.742   9.601 -11.589
  452    HB3  GLU  58           HB1      GLU  58  82.725  11.042 -11.548
  453    HG2  GLU  58           HG2      GLU  58  82.703  10.982  -9.093
  454    HG3  GLU  58           HG1      GLU  58  83.676   9.511  -9.108
  455    H    GLY  59           HN       GLY  59  81.138   8.086  -8.761
  456    HA2  GLY  59           HA2      GLY  59  83.043   5.872  -9.063
  457    HA3  GLY  59           HA1      GLY  59  81.978   6.141  -7.683
  458    H1U  RCY  60           H1U      RCY  60  74.561   4.044  -4.370
  459    H1S  RCY  60           H1S      RCY  60  78.692   1.973  -5.886
  460    HB1  RCY  60           HB1      RCY  60  77.977   2.560  -9.041
  461    HB2  RCY  60           HB2      RCY  60  77.490   3.983  -8.121
  462    HA   RCY  60           HA       RCY  60  79.229   3.801 -10.560
  463    HN1  RCY  60           HN1      RCY  60  79.491   6.237  -8.898
  464    H    GLY  61           HN       GLY  61  76.696   3.491 -10.949
  465    HA2  GLY  61           HA2      GLY  61  74.684   5.267 -10.731
  466    HA3  GLY  61           HA1      GLY  61  75.728   6.129 -11.862
  467    H    THR  62           HN       THR  62  76.609   3.400 -12.938
  468    HA   THR  62           HA       THR  62  74.331   3.124 -14.831
  469    HB   THR  62           HB       THR  62  76.176   3.265 -16.191
  470    HG1  THR  62           HG1      THR  62  76.500   0.578 -15.359
  471   HG21  THR  62          HG21      THR  62  78.439   2.298 -15.400
  472   HG22  THR  62          HG22      THR  62  77.677   2.174 -13.814
  473   HG23  THR  62          HG23      THR  62  77.844   3.748 -14.592
  474    H    ASP  63           HN       ASP  63  76.626   0.893 -13.201
  475    HA   ASP  63           HA       ASP  63  74.882  -1.381 -13.552
  476    HB2  ASP  63           HB2      ASP  63  77.211  -0.962 -11.654
  477    HB3  ASP  63           HB1      ASP  63  76.443  -2.514 -11.988
  478    H    ILE  64           HN       ILE  64  73.840   1.093 -12.086
  479    HA   ILE  64           HA       ILE  64  72.667  -0.417  -9.800
  480    HB   ILE  64           HB       ILE  64  73.888   2.355  -9.675
  481   HG12  ILE  64          HG12      ILE  64  74.387  -0.123  -7.999
  482   HG13  ILE  64          HG11      ILE  64  75.383   0.347  -9.377
  483   HG21  ILE  64          HG21      ILE  64  71.837   2.518  -8.469
  484   HG22  ILE  64          HG22      ILE  64  73.073   2.210  -7.250
  485   HG23  ILE  64          HG23      ILE  64  72.022   0.901  -7.791
  486   HD11  ILE  64          HD11      ILE  64  75.014   1.791  -6.753
  487   HD12  ILE  64          HD12      ILE  64  75.619   2.627  -8.184
  488   HD13  ILE  64          HD13      ILE  64  76.516   1.264  -7.514
  489    H    THR  65           HN       THR  65  72.511   2.574 -11.748
  490    HA   THR  65           HA       THR  65  69.717   3.035 -11.116
  491    HB   THR  65           HB       THR  65  71.310   4.120 -13.456
  492    HG1  THR  65           HG1      THR  65  71.852   5.782 -12.068
  493   HG21  THR  65          HG21      THR  65  68.804   5.018 -12.017
  494   HG22  THR  65          HG22      THR  65  68.954   4.541 -13.708
  495   HG23  THR  65          HG23      THR  65  69.695   6.039 -13.145
  496    H    VAL  66           HN       VAL  66  71.463   1.321 -13.646
  497    HA   VAL  66           HA       VAL  66  68.908   0.784 -15.079
  498    HB   VAL  66           HB       VAL  66  71.679  -0.105 -15.902
  499   HG11  VAL  66          HG11      VAL  66  69.229   0.554 -17.557
  500   HG12  VAL  66          HG12      VAL  66  69.594  -1.072 -16.980
  501   HG13  VAL  66          HG13      VAL  66  70.698  -0.262 -18.093
  502   HG21  VAL  66          HG21      VAL  66  71.598   1.979 -17.369
  503   HG22  VAL  66          HG22      VAL  66  71.866   2.275 -15.652
  504   HG23  VAL  66          HG23      VAL  66  70.269   2.538 -16.353
  505    H    ILE  67           HN       ILE  67  71.707  -1.009 -13.738
  506    HA   ILE  67           HA       ILE  67  69.842  -3.282 -13.193
  507    HB   ILE  67           HB       ILE  67  72.617  -3.460 -14.404
  508   HG12  ILE  67          HG12      ILE  67  69.960  -4.445 -15.477
  509   HG13  ILE  67          HG11      ILE  67  70.654  -2.883 -15.911
  510   HG21  ILE  67          HG21      ILE  67  72.035  -5.945 -14.441
  511   HG22  ILE  67          HG22      ILE  67  70.730  -5.562 -13.319
  512   HG23  ILE  67          HG23      ILE  67  72.407  -5.272 -12.854
  513   HD11  ILE  67          HD11      ILE  67  71.248  -4.571 -17.594
  514   HD12  ILE  67          HD12      ILE  67  71.960  -5.587 -16.340
  515   HD13  ILE  67          HD13      ILE  67  72.691  -4.031 -16.735
  516    H1U  RCY  68           H1U      RCY  68  68.078   2.235  -4.540
  517    H1S  RCY  68           H1S      RCY  68  71.051  -1.554  -4.979
  518    HB1  RCY  68           HB1      RCY  68  69.466  -2.339  -8.796
  519    HB2  RCY  68           HB2      RCY  68  70.804  -1.205  -8.616
  520    HA   RCY  68           HA       RCY  68  72.362  -2.700  -9.520
  521    HN1  RCY  68           HN1      RCY  68  69.789  -3.016 -10.969
  522    HA   PRO  69           HA       PRO  69  72.800  -7.087  -8.830
  523    HB2  PRO  69           HB2      PRO  69  73.557  -6.114  -6.092
  524    HB3  PRO  69           HB1      PRO  69  74.376  -7.297  -7.131
  525    HG2  PRO  69           HG2      PRO  69  75.251  -4.781  -6.889
  526    HG3  PRO  69           HG1      PRO  69  75.378  -5.678  -8.410
  527    HD2  PRO  69           HD2      PRO  69  73.612  -3.400  -7.732
  528    HD3  PRO  69           HD1      PRO  69  74.136  -3.984  -9.326
  529    H    TRP  70           HN       TRP  70  70.863  -4.983  -6.825
  530    HA   TRP  70           HA       TRP  70  69.704  -6.957  -5.108
  531    HD1  TRP  70           HD1      TRP  70  68.084  -7.104  -3.493
  532    HE1  TRP  70           HE1      TRP  70  65.612  -7.081  -2.766
  533    HE3  TRP  70           HE3      TRP  70  66.419  -3.083  -6.163
  534    HZ2  TRP  70           HZ2      TRP  70  63.237  -5.556  -3.254
  535    HZ3  TRP  70           HZ3      TRP  70  64.054  -2.368  -6.015
  536    HH2  TRP  70           HH2      TRP  70  62.461  -3.595  -4.567
  537    HB2  TRP  70           HB2      TRP  70  69.448  -4.588  -4.616
  538    HB3  TRP  70           HB1      TRP  70  68.591  -4.329  -6.135
  539    H    GLU  71           HN       GLU  71  69.041  -6.012  -8.424
  540    HA   GLU  71           HA       GLU  71  66.477  -7.368  -8.579
  541    HB2  GLU  71           HB2      GLU  71  68.417  -6.362 -10.675
  542    HB3  GLU  71           HB1      GLU  71  66.892  -7.148 -11.085
  543    HG2  GLU  71           HG2      GLU  71  65.703  -5.446  -9.674
  544    HG3  GLU  71           HG1      GLU  71  67.244  -4.614  -9.460
  545    H    ALA  72           HN       ALA  72  69.257  -8.172 -10.641
  546    HA   ALA  72           HA       ALA  72  68.528 -10.994 -10.573
  547    HB1  ALA  72           HB1      ALA  72  71.023  -9.690 -11.704
  548    HB2  ALA  72           HB2      ALA  72  69.508  -9.878 -12.588
  549    HB3  ALA  72           HB3      ALA  72  70.418 -11.302 -12.084
  550    H1U  RCY  73           H1U      RCY  73  73.708  -7.405  -0.579
  551    H1S  RCY  73           H1S      RCY  73  72.389  -9.586  -4.722
  552    HB1  RCY  73           HB1      RCY  73  69.104 -11.734  -5.680
  553    HB2  RCY  73           HB2      RCY  73  69.528 -10.022  -5.627
  554    HA   RCY  73           HA       RCY  73  71.587 -10.570  -6.974
  555    HN1  RCY  73           HN1      RCY  73  68.933 -10.399  -7.977
  556    H    ASN  74           HN       ASN  74  72.557 -12.166  -8.450
  557    HA   ASN  74           HA       ASN  74  72.560 -14.831  -7.293
  558    HB2  ASN  74           HB2      ASN  74  70.522 -14.961  -8.707
  559    HB3  ASN  74           HB1      ASN  74  71.486 -14.506 -10.112
  560   HD21  ASN  74          HD21      ASN  74  71.248 -17.038  -7.570
  561   HD22  ASN  74          HD22      ASN  74  71.939 -18.266  -8.516
  562    H    HIS  75           HN       HIS  75  73.330 -13.003 -10.272
  563    HA   HIS  75           HA       HIS  75  75.623 -14.503 -11.009
  564    HD1  HIS  75           HD1      HIS  75  76.938 -14.176 -13.390
  565    HD2  HIS  75           HD2      HIS  75  77.466 -10.388 -11.724
  566    HE1  HIS  75           HE1      HIS  75  79.240 -13.396 -14.102
  567    HE2  HIS  75           HE2      HIS  75  79.574 -11.092 -13.094
  568    HB2  HIS  75           HB2      HIS  75  74.675 -12.892 -12.549
  569    HB3  HIS  75           HB1      HIS  75  74.973 -11.570 -11.420
  570    H1U  RCY  76           H1U      RCY  76  77.753  -7.002  -1.940
  571    H1S  RCY  76           H1S      RCY  76  77.721  -9.065  -5.429
  572    HB1  RCY  76           HB1      RCY  76  77.259 -12.733  -7.041
  573    HB2  RCY  76           HB2      RCY  76  76.414 -11.190  -6.922
  574    HA   RCY  76           HA       RCY  76  77.869 -10.256  -8.684
  575    HN1  RCY  76           HN1      RCY  76  76.236 -11.179 -10.086
  576    H    GLU  77           HN       GLU  77  80.021 -10.236  -9.084
  577    HA   GLU  77           HA       GLU  77  81.372 -12.477 -10.269
  578    HB2  GLU  77           HB2      GLU  77  81.972 -10.011 -10.520
  579    HB3  GLU  77           HB1      GLU  77  82.702 -10.116  -8.919
  580    HG2  GLU  77           HG2      GLU  77  84.236 -11.840  -9.667
  581    HG3  GLU  77           HG1      GLU  77  83.434 -11.929 -11.235
  582    H    LEU  78           HN       LEU  78  82.545 -10.868  -7.314
  583    HA   LEU  78           HA       LEU  78  83.083 -13.586  -6.179
  584    HG   LEU  78           HG       LEU  78  85.141 -13.382  -7.205
  585    HB2  LEU  78           HB2      LEU  78  84.577 -11.022  -6.196
  586    HB3  LEU  78           HB1      LEU  78  84.588 -11.881  -4.657
  587   HD11  LEU  78          HD11      LEU  78  87.041 -11.602  -5.666
  588   HD12  LEU  78          HD12      LEU  78  86.718 -11.603  -7.400
  589   HD13  LEU  78          HD13      LEU  78  87.607 -12.939  -6.668
  590   HD21  LEU  78          HD21      LEU  78  86.027 -13.660  -4.315
  591   HD22  LEU  78          HD22      LEU  78  86.503 -14.744  -5.622
  592   HD23  LEU  78          HD23      LEU  78  84.812 -14.646  -5.130
  593    H    HIS  79           HN       HIS  79  83.294 -13.227  -3.582
  594    HA   HIS  79           HA       HIS  79  82.038 -12.962  -1.618
  595    HD1  HIS  79           HD1      HIS  79  84.129 -12.125  -1.947
  596    HD2  HIS  79           HD2      HIS  79  82.821  -8.240  -2.720
  597    HE1  HIS  79           HE1      HIS  79  86.212 -10.712  -2.230
  598    HE2  HIS  79           HE2      HIS  79  85.430  -8.345  -2.701
  599    HB2  HIS  79           HB2      HIS  79  80.948 -10.448  -2.894
  600    HB3  HIS  79           HB1      HIS  79  81.219 -10.771  -1.182
  601    H    GLU  80           HN       GLU  80  80.828 -14.797  -3.056
  602    HA   GLU  80           HA       GLU  80  78.041 -13.955  -3.631
  603    HB2  GLU  80           HB2      GLU  80  78.010 -16.594  -4.166
  604    HB3  GLU  80           HB1      GLU  80  78.605 -15.408  -5.327
  605    HG2  GLU  80           HG2      GLU  80  80.878 -15.826  -4.749
  606    HG3  GLU  80           HG1      GLU  80  80.423 -16.707  -3.290
  607    H    LEU  81           HN       LEU  81  79.896 -15.412  -1.124
  608    HA   LEU  81           HA       LEU  81  77.742 -16.962   0.061
  609    HG   LEU  81           HG       LEU  81  80.942 -18.347   1.105
  610    HB2  LEU  81           HB2      LEU  81  80.414 -15.967   1.061
  611    HB3  LEU  81           HB1      LEU  81  79.283 -16.782   2.138
  612   HD11  LEU  81          HD11      LEU  81  78.343 -19.114  -0.127
  613   HD12  LEU  81          HD12      LEU  81  78.327 -18.768   1.603
  614   HD13  LEU  81          HD13      LEU  81  79.383 -20.028   0.965
  615   HD21  LEU  81          HD21      LEU  81  80.945 -16.999  -1.090
  616   HD22  LEU  81          HD22      LEU  81  79.457 -17.860  -1.482
  617   HD23  LEU  81          HD23      LEU  81  80.955 -18.756  -1.238
  618    H    ALA  82           HN       ALA  82  78.578 -13.630  -0.017
  619    HA   ALA  82           HA       ALA  82  77.420 -12.810   2.487
  620    HB1  ALA  82           HB1      ALA  82  77.516 -10.570   1.597
  621    HB2  ALA  82           HB2      ALA  82  77.586 -11.174  -0.059
  622    HB3  ALA  82           HB3      ALA  82  78.953 -11.419   1.029
  623    H    GLN  83           HN       GLN  83  75.875 -14.519   0.303
  624    HA   GLN  83           HA       GLN  83  73.506 -12.874  -0.163
  625    HB2  GLN  83           HB2      GLN  83  74.541 -15.061  -1.424
  626    HB3  GLN  83           HB1      GLN  83  73.297 -15.826  -0.438
  627    HG2  GLN  83           HG2      GLN  83  71.599 -14.320  -1.349
  628    HG3  GLN  83           HG1      GLN  83  72.828 -13.458  -2.276
  629   HE21  GLN  83          HE21      GLN  83  72.748 -16.999  -1.850
  630   HE22  GLN  83          HE22      GLN  83  72.453 -17.354  -3.483
  631    H    TYR  84           HN       TYR  84  74.611 -15.101   2.280
  632    HA   TYR  84           HA       TYR  84  71.987 -15.686   3.378
  633    HD1  TYR  84           HD2      TYR  84  74.155 -17.236   1.883
  634    HD2  TYR  84           HD1      TYR  84  72.733 -18.406   5.764
  635    HE1  TYR  84           HE2      TYR  84  73.660 -19.507   1.017
  636    HE2  TYR  84           HE1      TYR  84  72.238 -20.676   4.898
  637    HH   TYR  84           HH       TYR  84  72.748 -22.124   3.143
  638    HB2  TYR  84           HB2      TYR  84  74.827 -16.076   4.273
  639    HB3  TYR  84           HB1      TYR  84  73.531 -16.246   5.457
  640    H    GLY  85           HN       GLY  85  74.170 -13.015   3.601
  641    HA2  GLY  85           HA2      GLY  85  73.757 -10.915   4.617
  642    HA3  GLY  85           HA1      GLY  85  72.267 -11.574   5.294
  643    H    ILE  86           HN       ILE  86  74.801 -13.681   5.904
  644    HA   ILE  86           HA       ILE  86  74.721 -13.193   8.737
  645    HB   ILE  86           HB       ILE  86  75.459 -15.313   7.194
  646   HG12  ILE  86          HG12      ILE  86  74.844 -15.367   9.588
  647   HG13  ILE  86          HG11      ILE  86  76.290 -16.332   9.288
  648   HG21  ILE  86          HG21      ILE  86  77.597 -14.013   6.645
  649   HG22  ILE  86          HG22      ILE  86  77.820 -15.655   7.248
  650   HG23  ILE  86          HG23      ILE  86  78.067 -14.279   8.324
  651   HD11  ILE  86          HD11      ILE  86  76.162 -13.533  10.440
  652   HD12  ILE  86          HD12      ILE  86  77.663 -14.310   9.936
  653   HD13  ILE  86          HD13      ILE  86  76.713 -14.998  11.253
  654    H1U  RCY  87           H1U      RCY  87  75.472  -4.797   5.374
  655    H1S  RCY  87           H1S      RCY  87  75.108  -8.043   4.312
  656    HB1  RCY  87           HB1      RCY  87  77.694  -9.570   5.292
  657    HB2  RCY  87           HB2      RCY  87  78.063  -8.314   6.474
  658    HA   RCY  87           HA       RCY  87  78.634 -10.691   7.191
  659    HN1  RCY  87           HN1      RCY  87  75.961 -11.251   6.483
  Start of MODEL    2
    1    HA   MET   1           HA       MET   1  54.281   9.450   6.887
    2    HB2  MET   1           HB2      MET   1  55.991  10.468   8.517
    3    HB3  MET   1           HB1      MET   1  56.251  11.707   7.288
    4    HG2  MET   1           HG2      MET   1  53.691  12.003   7.298
    5    HG3  MET   1           HG1      MET   1  53.714  11.080   8.801
    6    HE1  MET   1           HE1      MET   1  54.711  11.757  10.961
    7    HE2  MET   1           HE2      MET   1  53.143  12.509  10.678
    8    HE3  MET   1           HE3      MET   1  54.439  13.441  11.425
    9    H    ASN   2           HN       ASN   2  54.811   9.037   4.249
   10    HA   ASN   2           HA       ASN   2  53.631  11.324   2.984
   11    HB2  ASN   2           HB2      ASN   2  55.619  11.824   1.466
   12    HB3  ASN   2           HB1      ASN   2  55.771  12.391   3.129
   13   HD21  ASN   2          HD21      ASN   2  55.996   8.989   2.985
   14   HD22  ASN   2          HD22      ASN   2  57.688   8.861   3.025
   15    H    LEU   3           HN       LEU   3  53.600   8.306   3.168
   16    HA   LEU   3           HA       LEU   3  53.030   7.831   0.345
   17    HG   LEU   3           HG       LEU   3  53.990   4.769   0.484
   18    HB2  LEU   3           HB2      LEU   3  55.428   7.434   0.287
   19    HB3  LEU   3           HB1      LEU   3  55.329   6.394   1.706
   20   HD11  LEU   3          HD11      LEU   3  53.785   5.258  -2.080
   21   HD12  LEU   3          HD12      LEU   3  53.987   6.942  -1.597
   22   HD13  LEU   3          HD13      LEU   3  52.631   6.003  -0.973
   23   HD21  LEU   3          HD21      LEU   3  56.439   5.727  -1.027
   24   HD22  LEU   3          HD22      LEU   3  55.639   4.186  -1.339
   25   HD23  LEU   3          HD23      LEU   3  56.382   4.493   0.231
   26    H    GLU   4           HN       GLU   4  51.350   6.400   0.252
   27    HA   GLU   4           HA       GLU   4  49.999   5.439   2.494
   28    HB2  GLU   4           HB2      GLU   4  50.125   4.086  -0.215
   29    HB3  GLU   4           HB1      GLU   4  48.846   3.897   0.985
   30    HG2  GLU   4           HG2      GLU   4  49.605   6.522  -0.330
   31    HG3  GLU   4           HG1      GLU   4  48.230   5.522  -0.799
   32    HA   PRO   5           HA       PRO   5  53.013   2.527   4.196
   33    HB2  PRO   5           HB2      PRO   5  50.439   1.378   5.227
   34    HB3  PRO   5           HB1      PRO   5  51.966   1.668   6.085
   35    HG2  PRO   5           HG2      PRO   5  49.886   3.312   6.351
   36    HG3  PRO   5           HG1      PRO   5  51.550   3.918   6.333
   37    HD2  PRO   5           HD2      PRO   5  49.445   4.168   4.251
   38    HD3  PRO   5           HD1      PRO   5  50.860   5.200   4.555
   39    HA   PRO   6           HA       PRO   6  51.979  -0.558   0.978
   40    HB2  PRO   6           HB2      PRO   6  54.521  -1.156   0.255
   41    HB3  PRO   6           HB1      PRO   6  53.709   0.326  -0.288
   42    HG2  PRO   6           HG2      PRO   6  55.752  -0.038   1.835
   43    HG3  PRO   6           HG1      PRO   6  55.520   1.305   0.705
   44    HD2  PRO   6           HD2      PRO   6  54.691   1.292   3.377
   45    HD3  PRO   6           HD1      PRO   6  54.087   2.394   2.122
   46    H    LYS   7           HN       LYS   7  52.258  -2.895   0.882
   47    HA   LYS   7           HA       LYS   7  52.571  -4.133   3.474
   48    HB2  LYS   7           HB2      LYS   7  52.472  -6.284   2.040
   49    HB3  LYS   7           HB1      LYS   7  51.060  -5.230   2.021
   50    HG2  LYS   7           HG2      LYS   7  53.146  -4.618   0.001
   51    HG3  LYS   7           HG1      LYS   7  52.266  -6.128  -0.239
   52    HD2  LYS   7           HD2      LYS   7  50.732  -3.633   0.411
   53    HD3  LYS   7           HD1      LYS   7  51.313  -3.880  -1.236
   54    HE2  LYS   7           HE2      LYS   7  50.195  -6.095  -1.281
   55    HE3  LYS   7           HE1      LYS   7  49.575  -5.800   0.344
   56    HZ1  LYS   7           HZ1      LYS   7  48.573  -4.881  -2.141
   57    HZ2  LYS   7           HZ2      LYS   7  48.937  -3.561  -1.135
   58    HZ3  LYS   7           HZ3      LYS   7  47.872  -4.772  -0.599
   59    H    ALA   8           HN       ALA   8  54.083  -6.108   1.194
   60    HA   ALA   8           HA       ALA   8  56.271  -6.967   1.147
   61    HB1  ALA   8           HB1      ALA   8  57.054  -4.058   1.467
   62    HB2  ALA   8           HB2      ALA   8  56.485  -4.742  -0.056
   63    HB3  ALA   8           HB3      ALA   8  57.976  -5.336   0.675
   64    H    GLU   9           HN       GLU   9  55.277  -7.358   3.618
   65    HA   GLU   9           HA       GLU   9  56.789  -6.073   5.724
   66    HB2  GLU   9           HB2      GLU   9  55.257  -8.692   5.704
   67    HB3  GLU   9           HB1      GLU   9  55.876  -7.894   7.151
   68    HG2  GLU   9           HG2      GLU   9  54.005  -6.526   5.207
   69    HG3  GLU   9           HG1      GLU   9  53.429  -7.432   6.607
   70    H1U  RCY  10           H1U      RCY  10  58.552 -12.504   8.816
   71    H1S  RCY  10           H1S      RCY  10  58.609 -12.731   3.964
   72    HB1  RCY  10           HB1      RCY  10  60.718  -9.302   4.371
   73    HB2  RCY  10           HB2      RCY  10  59.260  -9.051   3.412
   74    HA   RCY  10           HA       RCY  10  58.611 -11.099   5.239
   75    HN1  RCY  10           HN1      RCY  10  56.820  -9.586   5.244
   76    H    ARG  11           HN       ARG  11  59.354 -11.651   7.229
   77    HA   ARG  11           HA       ARG  11  60.222  -9.732   9.186
   78    HE   ARG  11           HE       ARG  11  60.450 -11.300  13.526
   79    HB2  ARG  11           HB2      ARG  11  59.544 -12.443   9.185
   80    HB3  ARG  11           HB1      ARG  11  61.254 -12.445   9.608
   81    HG2  ARG  11           HG2      ARG  11  59.159 -10.718  10.962
   82    HG3  ARG  11           HG1      ARG  11  59.757 -12.247  11.606
   83    HD2  ARG  11           HD2      ARG  11  62.118 -11.144  11.287
   84    HD3  ARG  11           HD1      ARG  11  61.207  -9.634  11.289
   85   HH11  ARG  11          HH21      ARG  11  62.868  -9.194  12.259
   86   HH12  ARG  11          HH22      ARG  11  63.426  -8.680  13.816
   87   HH21  ARG  11          HH11      ARG  11  61.164 -10.641  15.567
   88   HH22  ARG  11          HH12      ARG  11  62.461  -9.499  15.689
   89    H    SER  12           HN       SER  12  62.414  -9.503  10.049
   90    HA   SER  12           HA       SER  12  64.400  -9.011   8.117
   91    HG   SER  12           HG       SER  12  66.741  -8.622  10.762
   92    HB2  SER  12           HB2      SER  12  64.550  -8.083  10.371
   93    HB3  SER  12           HB1      SER  12  64.729  -9.697  11.054
   94    H    ALA  13           HN       ALA  13  63.287 -12.010   9.277
   95    HA   ALA  13           HA       ALA  13  64.029 -14.204   8.907
   96    HB1  ALA  13           HB1      ALA  13  64.235 -13.140   6.555
   97    HB2  ALA  13           HB2      ALA  13  65.139 -14.623   6.861
   98    HB3  ALA  13           HB3      ALA  13  65.964 -13.065   6.891
   99    H    THR  14           HN       THR  14  65.876 -15.624   9.333
  100    HA   THR  14           HA       THR  14  68.385 -14.354  10.224
  101    HB   THR  14           HB       THR  14  68.209 -15.505  12.473
  102    HG1  THR  14           HG1      THR  14  65.577 -15.530  12.638
  103   HG21  THR  14          HG21      THR  14  66.025 -13.465  12.006
  104   HG22  THR  14          HG22      THR  14  67.738 -13.046  12.037
  105   HG23  THR  14          HG23      THR  14  66.968 -13.717  13.475
  106    H    ARG  15           HN       ARG  15  69.902 -15.646   9.310
  107    HA   ARG  15           HA       ARG  15  69.837 -18.534   9.767
  108    HE   ARG  15           HE       ARG  15  69.163 -14.574   5.300
  109    HB2  ARG  15           HB2      ARG  15  69.697 -19.246   7.493
  110    HB3  ARG  15           HB1      ARG  15  68.369 -18.110   7.716
  111    HG2  ARG  15           HG2      ARG  15  71.057 -17.531   6.438
  112    HG3  ARG  15           HG1      ARG  15  69.487 -17.557   5.634
  113    HD2  ARG  15           HD2      ARG  15  68.803 -15.724   7.318
  114    HD3  ARG  15           HD1      ARG  15  70.529 -15.558   7.641
  115   HH11  ARG  15          HH21      ARG  15  72.050 -16.071   6.447
  116   HH12  ARG  15          HH22      ARG  15  73.046 -15.420   5.188
  117   HH21  ARG  15          HH11      ARG  15  70.447 -13.716   3.650
  118   HH22  ARG  15          HH12      ARG  15  72.138 -14.086   3.605
  119    H    VAL  16           HN       VAL  16  71.742 -19.304   7.887
  120    HA   VAL  16           HA       VAL  16  73.981 -17.374   8.091
  121    HB   VAL  16           HB       VAL  16  74.180 -18.627  10.170
  122   HG11  VAL  16          HG11      VAL  16  74.094 -21.090   8.398
  123   HG12  VAL  16          HG12      VAL  16  72.820 -20.575   9.504
  124   HG13  VAL  16          HG13      VAL  16  74.382 -21.090  10.138
  125   HG21  VAL  16          HG21      VAL  16  76.415 -19.423   9.908
  126   HG22  VAL  16          HG22      VAL  16  76.224 -18.162   8.690
  127   HG23  VAL  16          HG23      VAL  16  76.140 -19.860   8.222
  128    H    MET  17           HN       MET  17  75.853 -18.106   6.760
  129    HA   MET  17           HA       MET  17  76.782 -19.095   4.843
  130    HB2  MET  17           HB2      MET  17  75.504 -21.175   6.054
  131    HB3  MET  17           HB1      MET  17  74.614 -21.109   4.535
  132    HG2  MET  17           HG2      MET  17  77.634 -21.256   4.789
  133    HG3  MET  17           HG1      MET  17  76.580 -22.603   4.361
  134    HE1  MET  17           HE1      MET  17  78.231 -22.883   2.465
  135    HE2  MET  17           HE2      MET  17  77.680 -22.398   0.864
  136    HE3  MET  17           HE3      MET  17  76.604 -23.309   1.920
  137    H    GLY  18           HN       GLY  18  76.284 -17.308   3.518
  138    HA2  GLY  18           HA2      GLY  18  73.704 -16.717   2.458
  139    HA3  GLY  18           HA1      GLY  18  75.228 -16.177   1.753
  140    H    GLY  19           HN       GLY  19  75.440 -19.465   1.979
  141    HA2  GLY  19           HA2      GLY  19  75.123 -21.229   0.453
  142    HA3  GLY  19           HA1      GLY  19  73.838 -20.277  -0.292
  143    HA   PRO  20           HA       PRO  20  77.624 -20.762  -3.149
  144    HB2  PRO  20           HB2      PRO  20  75.260 -20.855  -4.987
  145    HB3  PRO  20           HB1      PRO  20  76.766 -21.793  -5.039
  146    HG2  PRO  20           HG2      PRO  20  74.488 -22.860  -4.164
  147    HG3  PRO  20           HG1      PRO  20  76.050 -23.283  -3.445
  148    HD2  PRO  20           HD2      PRO  20  73.863 -21.599  -2.326
  149    HD3  PRO  20           HD1      PRO  20  75.089 -22.567  -1.479
  150    H1U  RCY  21           H1U      RCY  21  73.387 -10.173  -2.007
  151    H1S  RCY  21           H1S      RCY  21  75.455 -14.056  -4.090
  152    HB1  RCY  21           HB1      RCY  21  78.554 -16.143  -2.358
  153    HB2  RCY  21           HB2      RCY  21  76.791 -16.193  -2.374
  154    HA   RCY  21           HA       RCY  21  76.856 -16.686  -4.813
  155    HN1  RCY  21           HN1      RCY  21  78.489 -18.736  -3.389
  156    H    THR  22           HN       THR  22  77.982 -16.174  -6.619
  157    HA   THR  22           HA       THR  22  80.922 -15.769  -6.405
  158    HB   THR  22           HB       THR  22  79.657 -17.393  -8.628
  159    HG1  THR  22           HG1      THR  22  80.105 -18.127  -6.170
  160   HG21  THR  22          HG21      THR  22  81.768 -16.144  -9.129
  161   HG22  THR  22          HG22      THR  22  81.960 -17.895  -9.222
  162   HG23  THR  22          HG23      THR  22  82.551 -17.017  -7.811
  163    HA   PRO  23           HA       PRO  23  78.980 -12.135  -8.459
  164    HB2  PRO  23           HB2      PRO  23  81.838 -11.282  -8.224
  165    HB3  PRO  23           HB1      PRO  23  80.358 -10.388  -7.825
  166    HG2  PRO  23           HG2      PRO  23  81.896 -11.443  -5.928
  167    HG3  PRO  23           HG1      PRO  23  80.131 -11.420  -5.780
  168    HD2  PRO  23           HD2      PRO  23  81.938 -13.721  -6.392
  169    HD3  PRO  23           HD1      PRO  23  80.383 -13.704  -5.530
  170    H    ARG  24           HN       ARG  24  79.242 -11.257 -10.609
  171    HA   ARG  24           HA       ARG  24  81.442 -12.069 -12.315
  172    HE   ARG  24           HE       ARG  24  76.147 -14.671 -11.572
  173    HB2  ARG  24           HB2      ARG  24  79.761 -13.332 -13.891
  174    HB3  ARG  24           HB1      ARG  24  80.478 -14.191 -12.527
  175    HG2  ARG  24           HG2      ARG  24  78.506 -13.864 -11.184
  176    HG3  ARG  24           HG1      ARG  24  77.810 -12.765 -12.376
  177    HD2  ARG  24           HD2      ARG  24  77.498 -14.530 -13.960
  178    HD3  ARG  24           HD1      ARG  24  78.494 -15.641 -13.019
  179   HH11  ARG  24          HH21      ARG  24  77.477 -16.976 -13.764
  180   HH12  ARG  24          HH22      ARG  24  76.296 -18.193 -13.410
  181   HH21  ARG  24          HH11      ARG  24  74.597 -16.247 -11.097
  182   HH22  ARG  24          HH12      ARG  24  74.665 -17.780 -11.900
  183    H    LYS  25           HN       LYS  25  81.624 -10.083 -13.263
  184    HA   LYS  25           HA       LYS  25  79.435  -9.160 -14.986
  185    HB2  LYS  25           HB2      LYS  25  79.486  -6.847 -13.965
  186    HB3  LYS  25           HB1      LYS  25  78.731  -8.076 -12.953
  187    HG2  LYS  25           HG2      LYS  25  81.669  -7.658 -12.629
  188    HG3  LYS  25           HG1      LYS  25  80.599  -6.412 -11.986
  189    HD2  LYS  25           HD2      LYS  25  79.301  -8.331 -10.874
  190    HD3  LYS  25           HD1      LYS  25  80.693  -9.343 -11.260
  191    HE2  LYS  25           HE2      LYS  25  81.173  -8.566  -9.087
  192    HE3  LYS  25           HE1      LYS  25  82.094  -7.476 -10.122
  193    HZ1  LYS  25           HZ1      LYS  25  80.220  -6.760  -8.256
  194    HZ2  LYS  25           HZ2      LYS  25  79.425  -6.561  -9.744
  195    HZ3  LYS  25           HZ3      LYS  25  80.892  -5.756  -9.447
  196    H    GLY  26           HN       GLY  26  80.289  -6.802 -15.859
  197    HA2  GLY  26           HA2      GLY  26  82.957  -6.094 -15.999
  198    HA3  GLY  26           HA1      GLY  26  82.830  -7.433 -17.140
  199    HA   PRO  27           HA       PRO  27  80.984  -5.243 -20.475
  200    HB2  PRO  27           HB2      PRO  27  78.223  -6.046 -19.617
  201    HB3  PRO  27           HB1      PRO  27  78.975  -6.144 -21.222
  202    HG2  PRO  27           HG2      PRO  27  78.708  -8.295 -19.673
  203    HG3  PRO  27           HG1      PRO  27  80.123  -8.067 -20.714
  204    HD2  PRO  27           HD2      PRO  27  79.925  -7.876 -17.755
  205    HD3  PRO  27           HD1      PRO  27  81.334  -8.251 -18.770
  206    HA   PRO  28           HA       PRO  28  79.907  -1.121 -19.284
  207    HB2  PRO  28           HB2      PRO  28  77.587  -1.391 -21.169
  208    HB3  PRO  28           HB1      PRO  28  78.775  -0.080 -21.028
  209    HG2  PRO  28           HG2      PRO  28  78.924  -1.933 -22.955
  210    HG3  PRO  28           HG1      PRO  28  80.365  -1.209 -22.225
  211    HD2  PRO  28           HD2      PRO  28  79.317  -3.958 -21.939
  212    HD3  PRO  28           HD1      PRO  28  80.955  -3.340 -21.636
  213    H    LYS  29           HN       LYS  29  78.832  -0.477 -17.467
  214    HA   LYS  29           HA       LYS  29  76.081  -0.555 -16.984
  215    HB2  LYS  29           HB2      LYS  29  77.320  -3.168 -16.637
  216    HB3  LYS  29           HB1      LYS  29  76.651  -2.604 -15.111
  217    HG2  LYS  29           HG2      LYS  29  74.472  -2.381 -16.017
  218    HG3  LYS  29           HG1      LYS  29  75.065  -2.453 -17.677
  219    HD2  LYS  29           HD2      LYS  29  75.587  -4.787 -15.875
  220    HD3  LYS  29           HD1      LYS  29  73.967  -4.586 -16.544
  221    HE2  LYS  29           HE2      LYS  29  76.536  -4.690 -18.153
  222    HE3  LYS  29           HE1      LYS  29  75.355  -5.993 -18.019
  223    HZ1  LYS  29           HZ1      LYS  29  73.875  -3.819 -18.732
  224    HZ2  LYS  29           HZ2      LYS  29  74.374  -5.070 -19.768
  225    HZ3  LYS  29           HZ3      LYS  29  75.291  -3.644 -19.649
  226    H1U  RCY  30           H1U      RCY  30  74.448   2.488 -10.129
  227    H1S  RCY  30           H1S      RCY  30  73.761   3.340 -13.355
  228    HB1  RCY  30           HB1      RCY  30  77.216   2.652 -12.543
  229    HB2  RCY  30           HB2      RCY  30  77.025   0.907 -12.708
  230    HA   RCY  30           HA       RCY  30  78.271   2.849 -14.658
  231    HN1  RCY  30           HN1      RCY  30  77.427   1.452 -16.345
  232    H    LYS  31           HN       LYS  31  80.487   2.601 -14.680
  233    HA   LYS  31           HA       LYS  31  82.066   0.403 -14.183
  234    HB2  LYS  31           HB2      LYS  31  83.611   2.227 -12.942
  235    HB3  LYS  31           HB1      LYS  31  83.394   2.213 -14.690
  236    HG2  LYS  31           HG2      LYS  31  83.042   4.480 -13.753
  237    HG3  LYS  31           HG1      LYS  31  81.569   3.853 -14.494
  238    HD2  LYS  31           HD2      LYS  31  80.553   3.431 -12.419
  239    HD3  LYS  31           HD1      LYS  31  82.093   3.435 -11.558
  240    HE2  LYS  31           HE2      LYS  31  80.745   5.507 -11.158
  241    HE3  LYS  31           HE1      LYS  31  82.321   5.836 -11.877
  242    HZ1  LYS  31           HZ1      LYS  31  80.929   7.070 -13.197
  243    HZ2  LYS  31           HZ2      LYS  31  79.655   5.949 -13.111
  244    HZ3  LYS  31           HZ3      LYS  31  81.011   5.626 -14.084
  245    H    GLN  32           HN       GLN  32  83.005  -0.580 -12.328
  246    HA   GLN  32           HA       GLN  32  82.461   0.266  -9.635
  247    HB2  GLN  32           HB2      GLN  32  80.923  -1.689  -9.081
  248    HB3  GLN  32           HB1      GLN  32  80.184  -0.386 -10.014
  249    HG2  GLN  32           HG2      GLN  32  80.485  -1.636 -12.083
  250    HG3  GLN  32           HG1      GLN  32  81.356  -2.907 -11.224
  251   HE21  GLN  32          HE21      GLN  32  78.337  -1.176 -10.293
  252   HE22  GLN  32          HE22      GLN  32  77.388  -2.580 -10.190
  253    H    ARG  33           HN       ARG  33  84.129  -1.445 -11.851
  254    HA   ARG  33           HA       ARG  33  84.817  -3.887 -10.562
  255    HE   ARG  33           HE       ARG  33  86.072  -5.021 -15.044
  256    HB2  ARG  33           HB2      ARG  33  86.608  -2.130 -12.270
  257    HB3  ARG  33           HB1      ARG  33  86.829  -3.850 -11.956
  258    HG2  ARG  33           HG2      ARG  33  84.256  -2.848 -13.154
  259    HG3  ARG  33           HG1      ARG  33  85.664  -3.130 -14.178
  260    HD2  ARG  33           HD2      ARG  33  85.157  -5.324 -12.300
  261    HD3  ARG  33           HD1      ARG  33  83.825  -5.056 -13.424
  262   HH11  ARG  33          HH21      ARG  33  84.728  -7.134 -12.675
  263   HH12  ARG  33          HH22      ARG  33  85.357  -8.572 -13.407
  264   HH21  ARG  33          HH11      ARG  33  86.902  -6.887 -16.014
  265   HH22  ARG  33          HH12      ARG  33  86.588  -8.432 -15.297
  266    H    GLN  34           HN       GLN  34  87.727  -2.218 -10.849
  267    HA   GLN  34           HA       GLN  34  87.772  -1.461  -7.965
  268    HB2  GLN  34           HB2      GLN  34  90.011  -2.558  -7.752
  269    HB3  GLN  34           HB1      GLN  34  88.704  -3.707  -8.023
  270    HG2  GLN  34           HG2      GLN  34  90.221  -2.588 -10.367
  271    HG3  GLN  34           HG1      GLN  34  90.898  -3.927  -9.439
  272   HE21  GLN  34          HE21      GLN  34  88.405  -5.253  -8.795
  273   HE22  GLN  34          HE22      GLN  34  87.765  -5.878 -10.237
  274    H    THR  35           HN       THR  35  87.656   0.163 -10.380
  275    HA   THR  35           HA       THR  35  90.361   1.197 -10.828
  276    HB   THR  35           HB       THR  35  89.320   2.746 -12.350
  277    HG1  THR  35           HG1      THR  35  87.504   3.552 -11.723
  278   HG21  THR  35          HG21      THR  35  87.670   0.212 -12.483
  279   HG22  THR  35          HG22      THR  35  89.364   0.287 -12.967
  280   HG23  THR  35          HG23      THR  35  88.159   1.247 -13.825
  281    H    ARG  36           HN       ARG  36  88.520   3.898 -10.780
  282    HA   ARG  36           HA       ARG  36  88.370   4.496  -7.962
  283    HE   ARG  36           HE       ARG  36  92.429   4.754  -6.792
  284    HB2  ARG  36           HB2      ARG  36  90.900   4.438  -8.467
  285    HB3  ARG  36           HB1      ARG  36  90.623   5.912  -9.392
  286    HG2  ARG  36           HG2      ARG  36  91.116   6.814  -7.309
  287    HG3  ARG  36           HG1      ARG  36  89.362   6.674  -7.189
  288    HD2  ARG  36           HD2      ARG  36  90.459   5.763  -5.174
  289    HD3  ARG  36           HD1      ARG  36  89.607   4.497  -6.057
  290   HH11  ARG  36          HH21      ARG  36  90.061   3.368  -4.704
  291   HH12  ARG  36          HH22      ARG  36  91.036   1.998  -4.289
  292   HH21  ARG  36          HH11      ARG  36  93.716   2.973  -6.262
  293   HH22  ARG  36          HH12      ARG  36  93.105   1.774  -5.171
  294    H    GLN  37           HN       GLN  37  86.529   4.842  -9.975
  295    HA   GLN  37           HA       GLN  37  86.667   7.622 -10.938
  296    HB2  GLN  37           HB2      GLN  37  84.503   5.508 -11.168
  297    HB3  GLN  37           HB1      GLN  37  84.444   7.093 -11.941
  298    HG2  GLN  37           HG2      GLN  37  86.705   5.125 -12.370
  299    HG3  GLN  37           HG1      GLN  37  85.295   5.223 -13.425
  300   HE21  GLN  37          HE21      GLN  37  85.082   7.106 -14.806
  301   HE22  GLN  37          HE22      GLN  37  86.350   8.216 -15.011
  302    H1U  RCY  38           H1U      RCY  38  84.093   5.782  -1.858
  303    H1S  RCY  38           H1S      RCY  38  83.882   7.246  -4.560
  304    HB1  RCY  38           HB1      RCY  38  84.114   6.839  -7.060
  305    HB2  RCY  38           HB2      RCY  38  82.438   6.350  -7.303
  306    HA   RCY  38           HA       RCY  38  82.009   8.110  -8.800
  307    HN1  RCY  38           HN1      RCY  38  83.484   7.071 -10.308
  308    H    LYS  39           HN       LYS  39  82.271  10.295  -9.438
  309    HA   LYS  39           HA       LYS  39  84.463  11.887  -8.293
  310    HB2  LYS  39           HB2      LYS  39  82.047  12.767  -9.903
  311    HB3  LYS  39           HB1      LYS  39  83.471  13.744  -9.546
  312    HG2  LYS  39           HG2      LYS  39  84.865  12.003 -10.719
  313    HG3  LYS  39           HG1      LYS  39  83.366  11.218 -11.216
  314    HD2  LYS  39           HD2      LYS  39  83.789  14.147 -11.761
  315    HD3  LYS  39           HD1      LYS  39  84.481  12.935 -12.840
  316    HE2  LYS  39           HE2      LYS  39  81.552  13.183 -12.092
  317    HE3  LYS  39           HE1      LYS  39  82.264  13.614 -13.647
  318    HZ1  LYS  39           HZ1      LYS  39  81.608  11.013 -12.575
  319    HZ2  LYS  39           HZ2      LYS  39  83.134  11.099 -13.317
  320    HZ3  LYS  39           HZ3      LYS  39  81.738  11.522 -14.189
  321    H    SER  40           HN       SER  40  83.182  14.283  -7.694
  322    HA   SER  40           HA       SER  40  82.269  15.317  -5.785
  323    HG   SER  40           HG       SER  40  79.423  12.953  -5.189
  324    HB2  SER  40           HB2      SER  40  79.942  14.940  -5.525
  325    HB3  SER  40           HB1      SER  40  80.257  14.570  -7.218
  326    H    LYS  41           HN       LYS  41  84.209  13.812  -4.846
  327    HA   LYS  41           HA       LYS  41  83.181  11.796  -2.955
  328    HB2  LYS  41           HB2      LYS  41  85.994  12.834  -3.401
  329    HB3  LYS  41           HB1      LYS  41  85.555  11.446  -2.405
  330    HG2  LYS  41           HG2      LYS  41  84.834  10.186  -4.283
  331    HG3  LYS  41           HG1      LYS  41  84.790  11.612  -5.322
  332    HD2  LYS  41           HD2      LYS  41  86.781  10.304  -5.847
  333    HD3  LYS  41           HD1      LYS  41  87.268  11.815  -5.078
  334    HE2  LYS  41           HE2      LYS  41  87.708  10.744  -3.003
  335    HE3  LYS  41           HE1      LYS  41  86.842   9.285  -3.484
  336    HZ1  LYS  41           HZ1      LYS  41  88.780   9.658  -5.399
  337    HZ2  LYS  41           HZ2      LYS  41  88.781   8.493  -4.162
  338    HZ3  LYS  41           HZ3      LYS  41  89.558   9.986  -3.928
  339    HA   PRO  42           HA       PRO  42  82.966  15.198   0.034
  340    HB2  PRO  42           HB2      PRO  42  81.479  13.924   1.911
  341    HB3  PRO  42           HB1      PRO  42  80.774  14.536   0.402
  342    HG2  PRO  42           HG2      PRO  42  81.530  11.756   1.137
  343    HG3  PRO  42           HG1      PRO  42  80.145  12.342   0.202
  344    HD2  PRO  42           HD2      PRO  42  82.452  11.266  -0.915
  345    HD3  PRO  42           HD1      PRO  42  81.321  12.335  -1.773
  346    HA   PRO  43           HA       PRO  43  86.196  14.135   2.878
  347    HB2  PRO  43           HB2      PRO  43  85.599  15.726   5.026
  348    HB3  PRO  43           HB1      PRO  43  86.254  16.357   3.503
  349    HG2  PRO  43           HG2      PRO  43  83.446  16.347   4.488
  350    HG3  PRO  43           HG1      PRO  43  84.333  17.606   3.612
  351    HD2  PRO  43           HD2      PRO  43  82.544  15.924   2.395
  352    HD3  PRO  43           HD1      PRO  43  83.932  16.640   1.547
  353    H    LYS  44           HN       LYS  44  86.456  12.357   4.170
  354    HA   LYS  44           HA       LYS  44  84.378  10.802   5.217
  355    HB2  LYS  44           HB2      LYS  44  86.808  10.130   5.008
  356    HB3  LYS  44           HB1      LYS  44  87.121  11.051   6.479
  357    HG2  LYS  44           HG2      LYS  44  85.460   9.668   7.689
  358    HG3  LYS  44           HG1      LYS  44  85.188   8.728   6.222
  359    HD2  LYS  44           HD2      LYS  44  86.771   7.411   7.311
  360    HD3  LYS  44           HD1      LYS  44  87.804   8.413   6.291
  361    HE2  LYS  44           HE2      LYS  44  88.239   9.933   8.140
  362    HE3  LYS  44           HE1      LYS  44  87.098   9.064   9.167
  363    HZ1  LYS  44           HZ1      LYS  44  89.141   7.408   7.978
  364    HZ2  LYS  44           HZ2      LYS  44  88.569   7.453   9.578
  365    HZ3  LYS  44           HZ3      LYS  44  89.737   8.573   9.059
  366    H    LYS  45           HN       LYS  45  85.941  13.623   6.612
  367    HA   LYS  45           HA       LYS  45  85.080  13.345   9.301
  368    HB2  LYS  45           HB2      LYS  45  86.599  15.159   8.122
  369    HB3  LYS  45           HB1      LYS  45  85.080  16.041   7.970
  370    HG2  LYS  45           HG2      LYS  45  86.262  14.973  10.553
  371    HG3  LYS  45           HG1      LYS  45  86.217  16.665  10.058
  372    HD2  LYS  45           HD2      LYS  45  83.660  16.345   9.871
  373    HD3  LYS  45           HD1      LYS  45  83.909  14.874  10.812
  374    HE2  LYS  45           HE2      LYS  45  85.163  16.310  12.500
  375    HE3  LYS  45           HE1      LYS  45  84.558  17.716  11.623
  376    HZ1  LYS  45           HZ1      LYS  45  82.395  17.261  12.203
  377    HZ2  LYS  45           HZ2      LYS  45  83.221  16.776  13.606
  378    HZ3  LYS  45           HZ3      LYS  45  82.689  15.615  12.486
  379    H    GLY  46           HN       GLY  46  82.947  12.600   9.470
  380    HA2  GLY  46           HA2      GLY  46  80.868  14.628   9.121
  381    HA3  GLY  46           HA1      GLY  46  80.680  13.235   8.055
  382    H    VAL  47           HN       VAL  47  79.071  14.175  10.440
  383    HA   VAL  47           HA       VAL  47  78.938  11.522  11.765
  384    HB   VAL  47           HB       VAL  47  78.889  14.064  13.401
  385   HG11  VAL  47          HG11      VAL  47  79.257  11.124  14.047
  386   HG12  VAL  47          HG12      VAL  47  77.849  12.114  14.427
  387   HG13  VAL  47          HG13      VAL  47  79.389  12.427  15.227
  388   HG21  VAL  47          HG21      VAL  47  81.099  13.953  12.385
  389   HG22  VAL  47          HG22      VAL  47  81.233  12.240  12.780
  390   HG23  VAL  47          HG23      VAL  47  81.229  13.444  14.068
  391    H    GLN  48           HN       GLN  48  76.858  11.276  12.962
  392    HA   GLN  48           HA       GLN  48  74.529  11.499  13.109
  393    HB2  GLN  48           HB2      GLN  48  75.354  13.940  13.665
  394    HB3  GLN  48           HB1      GLN  48  74.723  14.313  12.061
  395    HG2  GLN  48           HG2      GLN  48  72.532  13.386  12.691
  396    HG3  GLN  48           HG1      GLN  48  73.156  12.978  14.289
  397   HE21  GLN  48          HE21      GLN  48  74.813  15.572  14.236
  398   HE22  GLN  48          HE22      GLN  48  73.688  16.787  14.609
  399    H    GLY  49           HN       GLY  49  75.338  13.643  10.354
  400    HA2  GLY  49           HA2      GLY  49  75.025  12.150   8.144
  401    HA3  GLY  49           HA1      GLY  49  73.355  12.189   8.712
  402    H1U  RCY  50           H1U      RCY  50  76.816   9.030   4.522
  403    H1S  RCY  50           H1S      RCY  50  75.620  12.876   4.395
  404    HB1  RCY  50           HB1      RCY  50  74.972  15.467   4.343
  405    HB2  RCY  50           HB2      RCY  50  73.308  15.983   4.068
  406    HA   RCY  50           HA       RCY  50  74.467  16.162   6.484
  407    HN1  RCY  50           HN1      RCY  50  73.927  13.314   6.258
  408    H    GLY  51           HN       GLY  51  71.545  14.820   4.973
  409    HA2  GLY  51           HA2      GLY  51  69.533  15.415   6.726
  410    HA3  GLY  51           HA1      GLY  51  69.961  17.011   6.107
  411    H    ASP  52           HN       ASP  52  68.432  13.979   5.356
  412    HA   ASP  52           HA       ASP  52  67.164  15.207   3.008
  413    HB2  ASP  52           HB2      ASP  52  68.932  12.754   2.752
  414    HB3  ASP  52           HB1      ASP  52  67.830  13.328   1.499
  415    H    ASP  53           HN       ASP  53  65.447  13.718   2.128
  416    HA   ASP  53           HA       ASP  53  64.696  11.411   3.763
  417    HB2  ASP  53           HB2      ASP  53  62.527  12.365   4.486
  418    HB3  ASP  53           HB1      ASP  53  63.884  13.254   5.179
  419    H    ILE  54           HN       ILE  54  65.190  12.228   0.908
  420    HA   ILE  54           HA       ILE  54  62.578  11.279  -0.213
  421    HB   ILE  54           HB       ILE  54  64.539  13.150  -1.579
  422   HG12  ILE  54          HG12      ILE  54  63.197  13.993   0.511
  423   HG13  ILE  54          HG11      ILE  54  63.194  14.970  -0.958
  424   HG21  ILE  54          HG21      ILE  54  61.814  12.039  -2.265
  425   HG22  ILE  54          HG22      ILE  54  63.294  11.968  -3.221
  426   HG23  ILE  54          HG23      ILE  54  62.441  13.500  -3.030
  427   HD11  ILE  54          HD11      ILE  54  60.911  14.534   0.150
  428   HD12  ILE  54          HD12      ILE  54  61.076  12.881  -0.441
  429   HD13  ILE  54          HD13      ILE  54  61.029  14.224  -1.582
  430    HA   PRO  55           HA       PRO  55  65.972   8.413  -1.472
  431    HB2  PRO  55           HB2      PRO  55  64.890   6.114  -0.553
  432    HB3  PRO  55           HB1      PRO  55  65.752   7.238   0.517
  433    HG2  PRO  55           HG2      PRO  55  62.835   6.797   0.197
  434    HG3  PRO  55           HG1      PRO  55  63.769   7.186   1.650
  435    HD2  PRO  55           HD2      PRO  55  62.294   9.024   0.130
  436    HD3  PRO  55           HD1      PRO  55  63.552   9.438   1.314
  437    H    GLY  56           HN       GLY  56  66.005   7.338  -3.440
  438    HA2  GLY  56           HA2      GLY  56  65.180   6.182  -5.331
  439    HA3  GLY  56           HA1      GLY  56  63.618   6.051  -4.523
  440    H    MET  57           HN       MET  57  62.568   8.382  -4.227
  441    HA   MET  57           HA       MET  57  61.761   9.334  -6.716
  442    HB2  MET  57           HB2      MET  57  61.739  10.407  -3.953
  443    HB3  MET  57           HB1      MET  57  61.584  11.621  -5.222
  444    HG2  MET  57           HG2      MET  57  59.894   9.109  -5.095
  445    HG3  MET  57           HG1      MET  57  59.384  10.662  -4.433
  446    HE1  MET  57           HE1      MET  57  57.578  11.827  -5.842
  447    HE2  MET  57           HE2      MET  57  57.346  10.081  -5.859
  448    HE3  MET  57           HE3      MET  57  57.128  11.007  -7.342
  449    H    GLU  58           HN       GLU  58  64.334  10.780  -4.673
  450    HA   GLU  58           HA       GLU  58  65.863  11.469  -7.070
  451    HB2  GLU  58           HB2      GLU  58  64.128  13.303  -6.865
  452    HB3  GLU  58           HB1      GLU  58  64.864  13.732  -5.321
  453    HG2  GLU  58           HG2      GLU  58  65.855  15.152  -6.995
  454    HG3  GLU  58           HG1      GLU  58  67.070  13.956  -6.543
  455    H    GLY  59           HN       GLY  59  68.032  11.776  -6.559
  456    HA2  GLY  59           HA2      GLY  59  69.967  11.658  -5.237
  457    HA3  GLY  59           HA1      GLY  59  69.079  12.650  -4.080
  458    H1U  RCY  60           H1U      RCY  60  72.071  12.192  -1.574
  459    H1S  RCY  60           H1S      RCY  60  71.376   9.571  -1.530
  460    HB1  RCY  60           HB1      RCY  60  69.938   7.847  -3.494
  461    HB2  RCY  60           HB2      RCY  60  70.221   7.139  -1.904
  462    HA   RCY  60           HA       RCY  60  68.766   9.048  -1.607
  463    HN1  RCY  60           HN1      RCY  60  70.595  11.033  -2.761
  464    H    GLY  61           HN       GLY  61  70.629  11.516  -1.065
  465    HA2  GLY  61           HA2      GLY  61  72.695  10.904   0.698
  466    HA3  GLY  61           HA1      GLY  61  71.650  12.310   0.904
  467    H    THR  62           HN       THR  62  69.341  10.238   1.086
  468    HA   THR  62           HA       THR  62  68.935  10.270   3.848
  469    HB   THR  62           HB       THR  62  67.449   8.267   3.469
  470    HG1  THR  62           HG1      THR  62  68.993   7.593   1.690
  471   HG21  THR  62          HG21      THR  62  65.878   9.459   2.102
  472   HG22  THR  62          HG22      THR  62  67.166  10.368   1.311
  473   HG23  THR  62          HG23      THR  62  66.787  10.671   3.006
  474    H    ASP  63           HN       ASP  63  70.869   9.781   4.981
  475    HA   ASP  63           HA       ASP  63  72.390   7.375   4.535
  476    HB2  ASP  63           HB2      ASP  63  73.167   9.490   5.741
  477    HB3  ASP  63           HB1      ASP  63  72.241   8.922   7.131
  478    H    ILE  64           HN       ILE  64  69.295   7.506   5.378
  479    HA   ILE  64           HA       ILE  64  69.490   5.028   7.026
  480    HB   ILE  64           HB       ILE  64  67.690   7.390   7.649
  481   HG12  ILE  64          HG12      ILE  64  69.902   6.130   9.299
  482   HG13  ILE  64          HG11      ILE  64  70.108   7.594   8.336
  483   HG21  ILE  64          HG21      ILE  64  67.905   4.600   8.802
  484   HG22  ILE  64          HG22      ILE  64  66.478   5.379   8.118
  485   HG23  ILE  64          HG23      ILE  64  67.128   5.929   9.662
  486   HD11  ILE  64          HD11      ILE  64  69.587   8.078  10.733
  487   HD12  ILE  64          HD12      ILE  64  68.038   7.261  10.527
  488   HD13  ILE  64          HD13      ILE  64  68.384   8.737   9.625
  489    H    THR  65           HN       THR  65  67.445   7.206   5.106
  490    HA   THR  65           HA       THR  65  65.509   6.745   3.848
  491    HB   THR  65           HB       THR  65  67.111   4.201   3.407
  492    HG1  THR  65           HG1      THR  65  67.259   5.563   1.306
  493   HG21  THR  65          HG21      THR  65  64.482   5.106   2.425
  494   HG22  THR  65          HG22      THR  65  65.170   3.483   2.470
  495   HG23  THR  65          HG23      THR  65  65.595   4.584   1.160
  496    H    VAL  66           HN       VAL  66  64.942   6.437   6.442
  497    HA   VAL  66           HA       VAL  66  63.415   5.408   7.891
  498    HB   VAL  66           HB       VAL  66  62.716   3.505   5.647
  499   HG11  VAL  66          HG11      VAL  66  61.779   3.303   8.023
  500   HG12  VAL  66          HG12      VAL  66  60.590   3.406   6.724
  501   HG13  VAL  66          HG13      VAL  66  60.943   4.824   7.711
  502   HG21  VAL  66          HG21      VAL  66  62.592   5.584   4.527
  503   HG22  VAL  66          HG22      VAL  66  62.038   6.428   5.974
  504   HG23  VAL  66          HG23      VAL  66  60.951   5.333   5.121
  505    H    ILE  67           HN       ILE  67  64.550   2.773   5.771
  506    HA   ILE  67           HA       ILE  67  65.952   1.567   8.109
  507    HB   ILE  67           HB       ILE  67  64.018   0.168   6.235
  508   HG12  ILE  67          HG12      ILE  67  63.029   1.325   8.195
  509   HG13  ILE  67          HG11      ILE  67  62.878  -0.427   8.335
  510   HG21  ILE  67          HG21      ILE  67  65.800  -1.368   6.435
  511   HG22  ILE  67          HG22      ILE  67  64.694  -1.846   7.722
  512   HG23  ILE  67          HG23      ILE  67  66.132  -0.899   8.103
  513   HD11  ILE  67          HD11      ILE  67  63.745  -0.032  10.420
  514   HD12  ILE  67          HD12      ILE  67  64.536   1.463   9.921
  515   HD13  ILE  67          HD13      ILE  67  65.272  -0.093   9.539
  516    H1U  RCY  68           H1U      RCY  68  73.725   5.549   0.404
  517    H1S  RCY  68           H1S      RCY  68  71.671   2.752   3.746
  518    HB1  RCY  68           HB1      RCY  68  71.012   1.926   5.493
  519    HB2  RCY  68           HB2      RCY  68  70.019   2.718   6.716
  520    HA   RCY  68           HA       RCY  68  68.567   1.562   4.391
  521    HN1  RCY  68           HN1      RCY  68  67.958   2.193   7.163
  522    HA   PRO  69           HA       PRO  69  69.802  -2.645   4.805
  523    HB2  PRO  69           HB2      PRO  69  71.966  -2.757   3.101
  524    HB3  PRO  69           HB1      PRO  69  70.279  -2.708   2.555
  525    HG2  PRO  69           HG2      PRO  69  72.278  -0.512   2.706
  526    HG3  PRO  69           HG1      PRO  69  71.051  -0.841   1.472
  527    HD2  PRO  69           HD2      PRO  69  70.726   1.080   3.383
  528    HD3  PRO  69           HD1      PRO  69  69.359   0.184   2.684
  529    H    TRP  70           HN       TRP  70  71.808  -0.145   5.896
  530    HA   TRP  70           HA       TRP  70  74.212  -1.519   6.549
  531    HD1  TRP  70           HD1      TRP  70  76.060  -1.268   7.941
  532    HE1  TRP  70           HE1      TRP  70  77.203  -0.928  10.225
  533    HE3  TRP  70           HE3      TRP  70  72.890   2.157  10.012
  534    HZ2  TRP  70           HZ2      TRP  70  76.824   0.598  12.619
  535    HZ3  TRP  70           HZ3      TRP  70  73.302   3.036  12.289
  536    HH2  TRP  70           HH2      TRP  70  75.261   2.264  13.595
  537    HB2  TRP  70           HB2      TRP  70  74.145   0.874   6.784
  538    HB3  TRP  70           HB1      TRP  70  72.790   0.785   7.909
  539    H    GLU  71           HN       GLU  71  71.038  -1.929   7.741
  540    HA   GLU  71           HA       GLU  71  72.096  -3.522  10.051
  541    HB2  GLU  71           HB2      GLU  71  69.635  -1.785   9.824
  542    HB3  GLU  71           HB1      GLU  71  69.759  -3.055  11.042
  543    HG2  GLU  71           HG2      GLU  71  71.874  -2.034  11.858
  544    HG3  GLU  71           HG1      GLU  71  71.678  -0.733  10.683
  545    H    ALA  72           HN       ALA  72  69.760  -3.295   7.417
  546    HA   ALA  72           HA       ALA  72  68.522  -5.865   8.018
  547    HB1  ALA  72           HB1      ALA  72  68.451  -4.475   5.339
  548    HB2  ALA  72           HB2      ALA  72  67.497  -3.890   6.702
  549    HB3  ALA  72           HB3      ALA  72  67.226  -5.513   6.069
  550    H1U  RCY  73           H1U      RCY  73  79.076  -3.586   1.848
  551    H1S  RCY  73           H1S      RCY  73  75.082  -4.900   3.895
  552    HB1  RCY  73           HB1      RCY  73  73.368  -4.952   4.763
  553    HB2  RCY  73           HB2      RCY  73  72.118  -5.146   3.534
  554    HA   RCY  73           HA       RCY  73  71.441  -7.290   4.595
  555    HN1  RCY  73           HN1      RCY  73  71.156  -4.723   5.966
  556    H    ASN  74           HN       ASN  74  73.107  -5.581   7.235
  557    HA   ASN  74           HA       ASN  74  73.805  -7.963   8.621
  558    HB2  ASN  74           HB2      ASN  74  76.363  -7.732   8.148
  559    HB3  ASN  74           HB1      ASN  74  75.364  -8.586   6.972
  560   HD21  ASN  74          HD21      ASN  74  76.113  -5.104   7.618
  561   HD22  ASN  74          HD22      ASN  74  76.464  -4.735   5.998
  562    H    HIS  75           HN       HIS  75  76.149  -7.216   9.891
  563    HA   HIS  75           HA       HIS  75  75.529  -4.479  10.945
  564    HD1  HIS  75           HD1      HIS  75  75.839  -8.526  11.182
  565    HD2  HIS  75           HD2      HIS  75  78.266  -6.765  14.082
  566    HE1  HIS  75           HE1      HIS  75  77.568 -10.263  11.819
  567    HE2  HIS  75           HE2      HIS  75  79.052  -9.204  13.584
  568    HB2  HIS  75           HB2      HIS  75  76.121  -5.277  13.178
  569    HB3  HIS  75           HB1      HIS  75  74.838  -6.290  12.517
  570    H1U  RCY  76           H1U      RCY  76  82.975  -1.991   3.530
  571    H1S  RCY  76           H1S      RCY  76  80.075  -0.595   7.039
  572    HB1  RCY  76           HB1      RCY  76  79.387  -4.465   8.758
  573    HB2  RCY  76           HB2      RCY  76  80.820  -3.484   9.064
  574    HA   RCY  76           HA       RCY  76  79.988  -4.129  11.215
  575    HN1  RCY  76           HN1      RCY  76  77.257  -3.116  10.902
  576    H    GLU  77           HN       GLU  77  81.044  -2.599  12.378
  577    HA   GLU  77           HA       GLU  77  79.852  -0.002  12.853
  578    HB2  GLU  77           HB2      GLU  77  82.668  -0.915  13.517
  579    HB3  GLU  77           HB1      GLU  77  81.781   0.413  14.266
  580    HG2  GLU  77           HG2      GLU  77  81.513  -1.364  15.797
  581    HG3  GLU  77           HG1      GLU  77  80.011  -1.383  14.871
  582    H    LEU  78           HN       LEU  78  82.647   1.261  12.834
  583    HA   LEU  78           HA       LEU  78  82.408   2.436  10.178
  584    HG   LEU  78           HG       LEU  78  82.356   4.621  11.051
  585    HB2  LEU  78           HB2      LEU  78  84.313   2.803  12.492
  586    HB3  LEU  78           HB1      LEU  78  84.607   3.584  10.938
  587   HD11  LEU  78          HD11      LEU  78  81.288   4.528  13.405
  588   HD12  LEU  78          HD12      LEU  78  82.285   3.095  13.655
  589   HD13  LEU  78          HD13      LEU  78  81.083   3.119  12.364
  590   HD21  LEU  78          HD21      LEU  78  82.861   6.150  12.992
  591   HD22  LEU  78          HD22      LEU  78  84.222   5.919  11.894
  592   HD23  LEU  78          HD23      LEU  78  84.177   5.064  13.436
  593    H    HIS  79           HN       HIS  79  82.709   0.191   9.160
  594    HA   HIS  79           HA       HIS  79  85.586  -0.585   8.988
  595    HD1  HIS  79           HD1      HIS  79  84.154  -0.902  11.078
  596    HD2  HIS  79           HD2      HIS  79  84.433  -4.800   9.619
  597    HE1  HIS  79           HE1      HIS  79  84.457  -2.402  13.097
  598    HE2  HIS  79           HE2      HIS  79  84.629  -4.777  12.223
  599    HB2  HIS  79           HB2      HIS  79  83.022  -2.010   8.241
  600    HB3  HIS  79           HB1      HIS  79  84.616  -2.609   7.779
  601    H    GLU  80           HN       GLU  80  86.465  -1.014   6.817
  602    HA   GLU  80           HA       GLU  80  85.011   0.310   4.581
  603    HB2  GLU  80           HB2      GLU  80  87.907   0.905   5.265
  604    HB3  GLU  80           HB1      GLU  80  86.959   1.623   3.963
  605    HG2  GLU  80           HG2      GLU  80  86.880   3.246   5.682
  606    HG3  GLU  80           HG1      GLU  80  85.341   2.396   5.829
  607    H    LEU  81           HN       LEU  81  88.128  -1.280   5.369
  608    HA   LEU  81           HA       LEU  81  88.083  -2.634   2.746
  609    HG   LEU  81           HG       LEU  81  89.904  -0.671   4.733
  610    HB2  LEU  81           HB2      LEU  81  90.112  -3.094   4.934
  611    HB3  LEU  81           HB1      LEU  81  90.322  -3.246   3.189
  612   HD11  LEU  81          HD11      LEU  81  92.164  -0.150   4.082
  613   HD12  LEU  81          HD12      LEU  81  92.249  -1.569   3.039
  614   HD13  LEU  81          HD13      LEU  81  92.190  -1.765   4.790
  615   HD21  LEU  81          HD21      LEU  81  88.773  -0.401   2.649
  616   HD22  LEU  81          HD22      LEU  81  90.024  -1.283   1.773
  617   HD23  LEU  81          HD23      LEU  81  90.363   0.325   2.412
  618    H    ALA  82           HN       ALA  82  87.628  -3.387   6.163
  619    HA   ALA  82           HA       ALA  82  87.689  -6.242   5.914
  620    HB1  ALA  82           HB1      ALA  82  86.252  -6.132   8.034
  621    HB2  ALA  82           HB2      ALA  82  86.364  -4.378   7.891
  622    HB3  ALA  82           HB3      ALA  82  87.825  -5.339   8.117
  623    H    GLN  83           HN       GLN  83  85.386  -7.336   6.710
  624    HA   GLN  83           HA       GLN  83  83.309  -8.079   5.930
  625    HB2  GLN  83           HB2      GLN  83  83.004  -5.141   5.231
  626    HB3  GLN  83           HB1      GLN  83  81.694  -6.319   5.269
  627    HG2  GLN  83           HG2      GLN  83  83.469  -5.838   7.665
  628    HG3  GLN  83           HG1      GLN  83  82.013  -4.884   7.378
  629   HE21  GLN  83          HE21      GLN  83  80.003  -6.425   6.799
  630   HE22  GLN  83          HE22      GLN  83  79.831  -7.776   7.812
  631    H    TYR  84           HN       TYR  84  82.525  -8.988   4.036
  632    HA   TYR  84           HA       TYR  84  82.655  -9.687   1.795
  633    HD1  TYR  84           HD2      TYR  84  80.297  -9.207   0.655
  634    HD2  TYR  84           HD1      TYR  84  81.470  -5.706   2.850
  635    HE1  TYR  84           HE2      TYR  84  77.972  -8.943   1.477
  636    HE2  TYR  84           HE1      TYR  84  79.145  -5.442   3.672
  637    HH   TYR  84           HH       TYR  84  77.054  -6.183   3.536
  638    HB2  TYR  84           HB2      TYR  84  82.987  -6.707   1.332
  639    HB3  TYR  84           HB1      TYR  84  82.433  -7.894   0.151
  640    H    GLY  85           HN       GLY  85  84.640  -6.918   1.033
  641    HA2  GLY  85           HA2      GLY  85  87.230  -7.724   1.499
  642    HA3  GLY  85           HA1      GLY  85  86.772  -8.658   0.072
  643    H    ILE  86           HN       ILE  86  88.732  -6.437   0.315
  644    HA   ILE  86           HA       ILE  86  87.962  -3.955  -0.609
  645    HB   ILE  86           HB       ILE  86  90.104  -3.882  -1.883
  646   HG12  ILE  86          HG12      ILE  86  91.317  -6.299  -1.245
  647   HG13  ILE  86          HG11      ILE  86  89.700  -6.782  -1.759
  648   HG21  ILE  86          HG21      ILE  86  91.535  -4.184   0.029
  649   HG22  ILE  86          HG22      ILE  86  90.425  -5.351   0.747
  650   HG23  ILE  86          HG23      ILE  86  89.969  -3.650   0.639
  651   HD11  ILE  86          HD11      ILE  86  89.980  -5.422  -3.825
  652   HD12  ILE  86          HD12      ILE  86  91.190  -6.700  -3.700
  653   HD13  ILE  86          HD13      ILE  86  91.625  -5.033  -3.321
  654    H1U  RCY  87           H1U      RCY  87  81.480  -0.989  -2.261
  655    H1S  RCY  87           H1S      RCY  87  85.860  -0.519  -2.423
  656    HB1  RCY  87           HB1      RCY  87  84.788  -2.730  -3.817
  657    HB2  RCY  87           HB2      RCY  87  85.187  -2.824  -5.532
  658    HA   RCY  87           HA       RCY  87  85.733  -4.927  -4.302
  659    HN1  RCY  87           HN1      RCY  87  86.946  -3.175  -2.395
  Start of MODEL    3
    1    HA   MET   1           HA       MET   1  72.919   4.758  20.776
    2    HB2  MET   1           HB2      MET   1  73.146   7.179  21.229
    3    HB3  MET   1           HB1      MET   1  71.559   6.586  21.717
    4    HG2  MET   1           HG2      MET   1  72.619   6.248  24.052
    5    HG3  MET   1           HG1      MET   1  73.914   7.291  23.466
    6    HE1  MET   1           HE1      MET   1  73.486   9.563  25.068
    7    HE2  MET   1           HE2      MET   1  72.918   8.060  25.790
    8    HE3  MET   1           HE3      MET   1  71.905   9.501  25.858
    9    H    ASN   2           HN       ASN   2  74.338   5.273  24.012
   10    HA   ASN   2           HA       ASN   2  77.022   5.588  22.850
   11    HB2  ASN   2           HB2      ASN   2  75.988   5.506  25.695
   12    HB3  ASN   2           HB1      ASN   2  77.700   5.659  25.298
   13   HD21  ASN   2          HD21      ASN   2  78.045   7.505  23.485
   14   HD22  ASN   2          HD22      ASN   2  77.219   8.955  23.795
   15    H    LEU   3           HN       LEU   3  75.383   3.236  24.986
   16    HA   LEU   3           HA       LEU   3  77.453   1.402  25.319
   17    HG   LEU   3           HG       LEU   3  73.300   0.482  25.273
   18    HB2  LEU   3           HB2      LEU   3  75.541  -0.376  25.233
   19    HB3  LEU   3           HB1      LEU   3  75.513   0.842  26.501
   20   HD11  LEU   3          HD11      LEU   3  73.856   3.290  24.716
   21   HD12  LEU   3          HD12      LEU   3  74.512   2.790  26.274
   22   HD13  LEU   3          HD13      LEU   3  72.795   2.582  25.933
   23   HD21  LEU   3          HD21      LEU   3  74.677   2.065  23.090
   24   HD22  LEU   3          HD22      LEU   3  73.063   1.355  23.054
   25   HD23  LEU   3          HD23      LEU   3  74.486   0.314  23.016
   26    H    GLU   4           HN       GLU   4  77.289  -0.935  24.183
   27    HA   GLU   4           HA       GLU   4  78.061  -0.455  21.417
   28    HB2  GLU   4           HB2      GLU   4  77.804  -2.973  23.081
   29    HB3  GLU   4           HB1      GLU   4  78.352  -2.978  21.405
   30    HG2  GLU   4           HG2      GLU   4  80.319  -2.911  22.796
   31    HG3  GLU   4           HG1      GLU   4  80.132  -1.311  22.077
   32    HA   PRO   5           HA       PRO   5  74.337  -0.975  19.100
   33    HB2  PRO   5           HB2      PRO   5  75.713  -3.385  17.954
   34    HB3  PRO   5           HB1      PRO   5  74.836  -2.088  17.118
   35    HG2  PRO   5           HG2      PRO   5  77.516  -2.164  17.236
   36    HG3  PRO   5           HG1      PRO   5  76.607  -0.645  17.213
   37    HD2  PRO   5           HD2      PRO   5  78.145  -1.845  19.420
   38    HD3  PRO   5           HD1      PRO   5  77.568  -0.176  19.231
   39    HA   PRO   6           HA       PRO   6  72.763  -4.369  21.750
   40    HB2  PRO   6           HB2      PRO   6  70.420  -3.197  22.442
   41    HB3  PRO   6           HB1      PRO   6  71.959  -2.755  23.206
   42    HG2  PRO   6           HG2      PRO   6  70.399  -1.317  21.134
   43    HG3  PRO   6           HG1      PRO   6  71.381  -0.676  22.460
   44    HD2  PRO   6           HD2      PRO   6  72.196  -0.860  19.784
   45    HD3  PRO   6           HD1      PRO   6  73.275  -0.633  21.177
   46    H    LYS   7           HN       LYS   7  71.200  -5.993  21.316
   47    HA   LYS   7           HA       LYS   7  70.297  -6.244  18.615
   48    HB2  LYS   7           HB2      LYS   7  69.227  -7.696  21.053
   49    HB3  LYS   7           HB1      LYS   7  69.128  -8.235  19.376
   50    HG2  LYS   7           HG2      LYS   7  71.670  -8.169  19.327
   51    HG3  LYS   7           HG1      LYS   7  71.614  -7.945  21.076
   52    HD2  LYS   7           HD2      LYS   7  70.165 -10.043  21.167
   53    HD3  LYS   7           HD1      LYS   7  70.606 -10.308  19.479
   54    HE2  LYS   7           HE2      LYS   7  73.024 -10.188  20.168
   55    HE3  LYS   7           HE1      LYS   7  72.489 -10.138  21.847
   56    HZ1  LYS   7           HZ1      LYS   7  72.130 -12.319  19.879
   57    HZ2  LYS   7           HZ2      LYS   7  71.228 -12.239  21.317
   58    HZ3  LYS   7           HZ3      LYS   7  72.920 -12.380  21.380
   59    H    ALA   8           HN       ALA   8  69.237  -4.025  18.550
   60    HA   ALA   8           HA       ALA   8  66.616  -3.844  19.893
   61    HB1  ALA   8           HB1      ALA   8  66.488  -1.627  18.811
   62    HB2  ALA   8           HB2      ALA   8  67.966  -1.979  17.916
   63    HB3  ALA   8           HB3      ALA   8  68.015  -1.819  19.671
   64    H    GLU   9           HN       GLU   9  67.889  -4.045  16.570
   65    HA   GLU   9           HA       GLU   9  66.850  -4.693  14.576
   66    HB2  GLU   9           HB2      GLU   9  65.050  -6.209  16.492
   67    HB3  GLU   9           HB1      GLU   9  65.199  -6.509  14.760
   68    HG2  GLU   9           HG2      GLU   9  67.724  -6.808  15.223
   69    HG3  GLU   9           HG1      GLU   9  67.261  -6.944  16.920
   70    H1U  RCY  10           H1U      RCY  10  58.354  -3.798  10.497
   71    H1S  RCY  10           H1S      RCY  10  59.713  -2.885  14.641
   72    HB1  RCY  10           HB1      RCY  10  61.514  -1.914  16.444
   73    HB2  RCY  10           HB2      RCY  10  62.457  -3.192  17.205
   74    HA   RCY  10           HA       RCY  10  63.509  -1.710  14.796
   75    HN1  RCY  10           HN1      RCY  10  65.304  -2.774  16.839
   76    H    ARG  11           HN       ARG  11  65.743  -0.739  16.425
   77    HA   ARG  11           HA       ARG  11  65.059   0.778  18.666
   78    HE   ARG  11           HE       ARG  11  67.965   2.410  13.705
   79    HB2  ARG  11           HB2      ARG  11  66.850   2.350  17.977
   80    HB3  ARG  11           HB1      ARG  11  67.352   0.670  17.789
   81    HG2  ARG  11           HG2      ARG  11  66.521   0.871  15.361
   82    HG3  ARG  11           HG1      ARG  11  66.498   2.612  15.640
   83    HD2  ARG  11           HD2      ARG  11  68.902   2.458  16.365
   84    HD3  ARG  11           HD1      ARG  11  68.890   0.766  15.867
   85   HH11  ARG  11          HH21      ARG  11  70.757   1.553  15.538
   86   HH12  ARG  11          HH22      ARG  11  71.864   1.846  14.238
   87   HH21  ARG  11          HH11      ARG  11  69.395   2.797  11.997
   88   HH22  ARG  11          HH12      ARG  11  71.093   2.550  12.234
   89    H    SER  12           HN       SER  12  63.841   1.095  15.486
   90    HA   SER  12           HA       SER  12  62.513   2.743  14.454
   91    HG   SER  12           HG       SER  12  60.029   1.620  16.623
   92    HB2  SER  12           HB2      SER  12  61.647   3.242  17.314
   93    HB3  SER  12           HB1      SER  12  60.719   3.574  15.854
   94    H    ALA  13           HN       ALA  13  61.612   5.227  15.678
   95    HA   ALA  13           HA       ALA  13  62.350   7.425  16.057
   96    HB1  ALA  13           HB1      ALA  13  63.956   6.039  17.673
   97    HB2  ALA  13           HB2      ALA  13  64.239   7.750  17.357
   98    HB3  ALA  13           HB3      ALA  13  65.172   6.528  16.492
   99    H    THR  14           HN       THR  14  64.574   5.350  14.215
  100    HA   THR  14           HA       THR  14  65.625   5.707  12.155
  101    HB   THR  14           HB       THR  14  64.406   6.860  10.524
  102    HG1  THR  14           HG1      THR  14  62.877   8.489  12.050
  103   HG21  THR  14          HG21      THR  14  63.022   5.212  12.051
  104   HG22  THR  14          HG22      THR  14  62.204   6.178  10.822
  105   HG23  THR  14          HG23      THR  14  62.168   6.685  12.510
  106    H    ARG  15           HN       ARG  15  65.997   7.520  14.725
  107    HA   ARG  15           HA       ARG  15  67.487   9.732  13.410
  108    HE   ARG  15           HE       ARG  15  65.941  12.546  14.642
  109    HB2  ARG  15           HB2      ARG  15  65.894  10.287  15.252
  110    HB3  ARG  15           HB1      ARG  15  66.868   9.311  16.349
  111    HG2  ARG  15           HG2      ARG  15  68.678  10.794  16.276
  112    HG3  ARG  15           HG1      ARG  15  68.166  11.494  14.739
  113    HD2  ARG  15           HD2      ARG  15  66.472  11.779  17.218
  114    HD3  ARG  15           HD1      ARG  15  67.792  12.900  16.882
  115   HH11  ARG  15          HH21      ARG  15  66.735  14.219  17.550
  116   HH12  ARG  15          HH22      ARG  15  65.834  15.639  17.136
  117   HH21  ARG  15          HH11      ARG  15  64.760  14.391  14.085
  118   HH22  ARG  15          HH12      ARG  15  64.716  15.737  15.174
  119    H    VAL  16           HN       VAL  16  68.573   8.931  16.538
  120    HA   VAL  16           HA       VAL  16  70.646   8.125  17.286
  121    HB   VAL  16           HB       VAL  16  70.539   6.236  14.930
  122   HG11  VAL  16          HG11      VAL  16  71.491   4.690  16.680
  123   HG12  VAL  16          HG12      VAL  16  71.567   6.069  17.776
  124   HG13  VAL  16          HG13      VAL  16  72.528   6.064  16.297
  125   HG21  VAL  16          HG21      VAL  16  68.899   6.228  17.475
  126   HG22  VAL  16          HG22      VAL  16  69.172   4.772  16.518
  127   HG23  VAL  16          HG23      VAL  16  68.314   6.142  15.813
  128    H    MET  17           HN       MET  17  72.991   7.792  16.536
  129    HA   MET  17           HA       MET  17  74.864   8.676  15.441
  130    HB2  MET  17           HB2      MET  17  73.089   8.920  13.004
  131    HB3  MET  17           HB1      MET  17  74.833   8.661  13.058
  132    HG2  MET  17           HG2      MET  17  74.395   6.457  14.197
  133    HG3  MET  17           HG1      MET  17  72.674   6.709  13.902
  134    HE1  MET  17           HE1      MET  17  73.284   4.201  12.902
  135    HE2  MET  17           HE2      MET  17  72.913   4.191  11.180
  136    HE3  MET  17           HE3      MET  17  71.856   5.049  12.297
  137    H    GLY  18           HN       GLY  18  72.359  10.442  13.616
  138    HA2  GLY  18           HA2      GLY  18  72.848  12.894  15.150
  139    HA3  GLY  18           HA1      GLY  18  73.488  12.929  13.506
  140    H    GLY  19           HN       GLY  19  71.092  14.265  14.968
  141    HA2  GLY  19           HA2      GLY  19  68.810  13.293  13.388
  142    HA3  GLY  19           HA1      GLY  19  68.779  14.630  14.538
  143    HA   PRO  20           HA       PRO  20  69.256  17.923  11.660
  144    HB2  PRO  20           HB2      PRO  20  72.205  18.059  12.201
  145    HB3  PRO  20           HB1      PRO  20  71.003  19.364  12.181
  146    HG2  PRO  20           HG2      PRO  20  71.926  18.345  14.465
  147    HG3  PRO  20           HG1      PRO  20  70.247  18.882  14.293
  148    HD2  PRO  20           HD2      PRO  20  71.318  16.117  14.485
  149    HD3  PRO  20           HD1      PRO  20  69.702  16.733  14.895
  150    H1U  RCY  21           H1U      RCY  21  66.033  11.062   5.100
  151    H1S  RCY  21           H1S      RCY  21  70.711  11.539   6.032
  152    HB1  RCY  21           HB1      RCY  21  69.282  13.927   8.510
  153    HB2  RCY  21           HB2      RCY  21  70.867  13.952   9.283
  154    HA   RCY  21           HA       RCY  21  71.314  16.146   8.136
  155    HN1  RCY  21           HN1      RCY  21  68.901  16.369   9.874
  156    H    THR  22           HN       THR  22  70.860  17.084   6.207
  157    HA   THR  22           HA       THR  22  68.119  16.815   5.082
  158    HB   THR  22           HB       THR  22  68.199  19.263   4.457
  159    HG1  THR  22           HG1      THR  22  70.102  20.083   4.795
  160   HG21  THR  22          HG21      THR  22  68.224  18.608   7.418
  161   HG22  THR  22          HG22      THR  22  66.838  18.432   6.342
  162   HG23  THR  22          HG23      THR  22  67.490  20.034   6.686
  163    HA   PRO  23           HA       PRO  23  71.242  15.687   1.893
  164    HB2  PRO  23           HB2      PRO  23  68.667  15.073   0.499
  165    HB3  PRO  23           HB1      PRO  23  70.138  14.090   0.635
  166    HG2  PRO  23           HG2      PRO  23  67.959  13.539   2.063
  167    HG3  PRO  23           HG1      PRO  23  69.585  13.319   2.731
  168    HD2  PRO  23           HD2      PRO  23  67.577  15.452   3.328
  169    HD3  PRO  23           HD1      PRO  23  68.811  14.734   4.388
  170    H    ARG  24           HN       ARG  24  72.026  17.070   0.344
  171    HA   ARG  24           HA       ARG  24  70.274  18.625  -1.376
  172    HE   ARG  24           HE       ARG  24  69.128  21.560   1.233
  173    HB2  ARG  24           HB2      ARG  24  70.339  19.875   0.883
  174    HB3  ARG  24           HB1      ARG  24  72.019  20.236   0.492
  175    HG2  ARG  24           HG2      ARG  24  70.960  22.088  -0.434
  176    HG3  ARG  24           HG1      ARG  24  70.988  21.000  -1.822
  177    HD2  ARG  24           HD2      ARG  24  68.746  21.993  -1.522
  178    HD3  ARG  24           HD1      ARG  24  68.703  20.246  -1.287
  179   HH11  ARG  24          HH21      ARG  24  66.791  20.936  -1.223
  180   HH12  ARG  24          HH22      ARG  24  65.439  21.016  -0.144
  181   HH21  ARG  24          HH11      ARG  24  67.376  21.669   2.657
  182   HH22  ARG  24          HH12      ARG  24  65.770  21.431   2.053
  183    H    LYS  25           HN       LYS  25  72.381  16.751  -1.798
  184    HA   LYS  25           HA       LYS  25  74.938  17.818  -2.264
  185    HB2  LYS  25           HB2      LYS  25  73.553  15.896  -4.148
  186    HB3  LYS  25           HB1      LYS  25  75.278  16.007  -3.793
  187    HG2  LYS  25           HG2      LYS  25  74.753  15.401  -1.407
  188    HG3  LYS  25           HG1      LYS  25  73.085  15.110  -1.904
  189    HD2  LYS  25           HD2      LYS  25  75.534  13.702  -3.009
  190    HD3  LYS  25           HD1      LYS  25  74.355  13.003  -1.898
  191    HE2  LYS  25           HE2      LYS  25  74.020  13.731  -4.797
  192    HE3  LYS  25           HE1      LYS  25  73.588  12.233  -3.971
  193    HZ1  LYS  25           HZ1      LYS  25  72.039  13.884  -2.654
  194    HZ2  LYS  25           HZ2      LYS  25  71.550  13.184  -4.123
  195    HZ3  LYS  25           HZ3      LYS  25  72.148  14.774  -4.094
  196    H    GLY  26           HN       GLY  26  72.541  17.362  -4.887
  197    HA2  GLY  26           HA2      GLY  26  72.257  19.922  -5.847
  198    HA3  GLY  26           HA1      GLY  26  73.838  19.448  -6.471
  199    HA   PRO  27           HA       PRO  27  70.060  18.140  -9.209
  200    HB2  PRO  27           HB2      PRO  27  71.995  19.383 -11.132
  201    HB3  PRO  27           HB1      PRO  27  70.221  19.436 -11.129
  202    HG2  PRO  27           HG2      PRO  27  71.696  21.507 -10.310
  203    HG3  PRO  27           HG1      PRO  27  70.138  21.110  -9.568
  204    HD2  PRO  27           HD2      PRO  27  72.873  20.791  -8.460
  205    HD3  PRO  27           HD1      PRO  27  71.322  20.955  -7.608
  206    HA   PRO  28           HA       PRO  28  71.792  14.251 -10.428
  207    HB2  PRO  28           HB2      PRO  28  71.090  15.051 -13.237
  208    HB3  PRO  28           HB1      PRO  28  70.770  13.524 -12.390
  209    HG2  PRO  28           HG2      PRO  28  68.870  15.372 -12.727
  210    HG3  PRO  28           HG1      PRO  28  68.956  14.372 -11.268
  211    HD2  PRO  28           HD2      PRO  28  69.543  17.258 -11.588
  212    HD3  PRO  28           HD1      PRO  28  69.115  16.351 -10.121
  213    H    LYS  29           HN       LYS  29  73.832  13.525 -11.051
  214    HA   LYS  29           HA       LYS  29  75.405  14.845 -13.101
  215    HB2  LYS  29           HB2      LYS  29  75.647  16.490 -11.262
  216    HB3  LYS  29           HB1      LYS  29  76.242  15.210 -10.206
  217    HG2  LYS  29           HG2      LYS  29  78.132  16.457 -11.150
  218    HG3  LYS  29           HG1      LYS  29  78.122  14.810 -11.782
  219    HD2  LYS  29           HD2      LYS  29  77.465  15.477 -13.900
  220    HD3  LYS  29           HD1      LYS  29  76.644  16.921 -13.305
  221    HE2  LYS  29           HE2      LYS  29  79.643  16.623 -13.127
  222    HE3  LYS  29           HE1      LYS  29  78.863  17.278 -14.566
  223    HZ1  LYS  29           HZ1      LYS  29  77.969  18.396 -12.047
  224    HZ2  LYS  29           HZ2      LYS  29  78.319  19.169 -13.520
  225    HZ3  LYS  29           HZ3      LYS  29  79.577  18.748 -12.458
  226    H1U  RCY  30           H1U      RCY  30  74.718   9.117  -4.465
  227    H1S  RCY  30           H1S      RCY  30  76.658   7.087  -8.252
  228    HB1  RCY  30           HB1      RCY  30  74.764  10.274 -10.041
  229    HB2  RCY  30           HB2      RCY  30  76.040  10.565  -8.860
  230    HA   RCY  30           HA       RCY  30  77.590  11.213 -10.546
  231    HN1  RCY  30           HN1      RCY  30  75.221  12.653 -10.353
  232    H    LYS  31           HN       LYS  31  74.665   9.891 -12.075
  233    HA   LYS  31           HA       LYS  31  74.447   8.619 -14.040
  234    HB2  LYS  31           HB2      LYS  31  76.486  10.673 -14.942
  235    HB3  LYS  31           HB1      LYS  31  75.588   9.607 -16.024
  236    HG2  LYS  31           HG2      LYS  31  73.525  10.633 -15.521
  237    HG3  LYS  31           HG1      LYS  31  74.151  11.373 -14.047
  238    HD2  LYS  31           HD2      LYS  31  75.428  12.968 -15.262
  239    HD3  LYS  31           HD1      LYS  31  75.239  12.081 -16.775
  240    HE2  LYS  31           HE2      LYS  31  72.903  13.274 -15.265
  241    HE3  LYS  31           HE1      LYS  31  73.761  14.134 -16.544
  242    HZ1  LYS  31           HZ1      LYS  31  72.494  11.468 -16.862
  243    HZ2  LYS  31           HZ2      LYS  31  73.218  12.399 -18.085
  244    HZ3  LYS  31           HZ3      LYS  31  71.786  12.932 -17.342
  245    H    GLN  32           HN       GLN  32  77.579   9.217 -15.249
  246    HA   GLN  32           HA       GLN  32  79.500   7.876 -15.410
  247    HB2  GLN  32           HB2      GLN  32  79.032   7.790 -12.808
  248    HB3  GLN  32           HB1      GLN  32  78.539   6.134 -13.157
  249    HG2  GLN  32           HG2      GLN  32  80.765   5.906 -14.417
  250    HG3  GLN  32           HG1      GLN  32  81.236   7.412 -13.627
  251   HE21  GLN  32          HE21      GLN  32  82.763   6.585 -12.116
  252   HE22  GLN  32          HE22      GLN  32  82.365   5.460 -10.909
  253    H    ARG  33           HN       ARG  33  79.423   6.617 -17.204
  254    HA   ARG  33           HA       ARG  33  78.096   3.987 -17.045
  255    HE   ARG  33           HE       ARG  33  75.431   8.947 -19.734
  256    HB2  ARG  33           HB2      ARG  33  77.028   4.487 -19.355
  257    HB3  ARG  33           HB1      ARG  33  76.240   5.155 -17.926
  258    HG2  ARG  33           HG2      ARG  33  77.330   7.309 -18.282
  259    HG3  ARG  33           HG1      ARG  33  78.231   6.656 -19.651
  260    HD2  ARG  33           HD2      ARG  33  76.284   6.441 -20.979
  261    HD3  ARG  33           HD1      ARG  33  75.215   6.593 -19.584
  262   HH11  ARG  33          HH21      ARG  33  77.776   7.272 -21.627
  263   HH12  ARG  33          HH22      ARG  33  78.347   8.700 -22.424
  264   HH21  ARG  33          HH11      ARG  33  76.164  10.821 -20.764
  265   HH22  ARG  33          HH12      ARG  33  77.435  10.709 -21.935
  266    H    GLN  34           HN       GLN  34  80.839   4.677 -17.160
  267    HA   GLN  34           HA       GLN  34  81.716   4.372 -19.952
  268    HB2  GLN  34           HB2      GLN  34  82.913   5.707 -18.067
  269    HB3  GLN  34           HB1      GLN  34  83.495   4.133 -17.525
  270    HG2  GLN  34           HG2      GLN  34  84.395   3.721 -19.819
  271    HG3  GLN  34           HG1      GLN  34  83.907   5.355 -20.270
  272   HE21  GLN  34          HE21      GLN  34  84.623   6.792 -17.944
  273   HE22  GLN  34          HE22      GLN  34  86.305   6.713 -17.733
  274    H    THR  35           HN       THR  35  80.569   2.300 -17.601
  275    HA   THR  35           HA       THR  35  80.519  -0.045 -17.510
  276    HB   THR  35           HB       THR  35  82.316  -0.278 -19.897
  277    HG1  THR  35           HG1      THR  35  79.631   0.632 -19.969
  278   HG21  THR  35          HG21      THR  35  80.971  -2.157 -20.379
  279   HG22  THR  35          HG22      THR  35  79.635  -1.562 -19.393
  280   HG23  THR  35          HG23      THR  35  81.098  -2.172 -18.620
  281    H    ARG  36           HN       ARG  36  81.780  -1.457 -16.325
  282    HA   ARG  36           HA       ARG  36  83.633  -2.153 -15.060
  283    HE   ARG  36           HE       ARG  36  86.321  -4.370 -16.934
  284    HB2  ARG  36           HB2      ARG  36  85.189  -1.282 -17.512
  285    HB3  ARG  36           HB1      ARG  36  85.694  -2.460 -16.301
  286    HG2  ARG  36           HG2      ARG  36  83.800  -3.915 -16.921
  287    HG3  ARG  36           HG1      ARG  36  83.294  -2.740 -18.134
  288    HD2  ARG  36           HD2      ARG  36  84.574  -4.432 -19.276
  289    HD3  ARG  36           HD1      ARG  36  85.579  -2.986 -19.191
  290   HH11  ARG  36          HH21      ARG  36  85.945  -5.154 -20.271
  291   HH12  ARG  36          HH22      ARG  36  87.185  -6.362 -20.264
  292   HH21  ARG  36          HH11      ARG  36  87.944  -5.943 -16.906
  293   HH22  ARG  36          HH12      ARG  36  88.317  -6.809 -18.359
  294    H    GLN  37           HN       GLN  37  82.881   0.229 -14.148
  295    HA   GLN  37           HA       GLN  37  84.982   2.245 -14.386
  296    HB2  GLN  37           HB2      GLN  37  82.494   1.970 -12.700
  297    HB3  GLN  37           HB1      GLN  37  83.652   3.268 -12.409
  298    HG2  GLN  37           HG2      GLN  37  82.532   2.736 -15.162
  299    HG3  GLN  37           HG1      GLN  37  81.702   3.785 -14.012
  300   HE21  GLN  37          HE21      GLN  37  85.042   3.938 -13.448
  301   HE22  GLN  37          HE22      GLN  37  85.379   5.346 -14.333
  302    H1U  RCY  38           H1U      RCY  38  82.352   1.047  -4.927
  303    H1S  RCY  38           H1S      RCY  38  83.411   0.560  -8.829
  304    HB1  RCY  38           HB1      RCY  38  85.247   0.548  -9.530
  305    HB2  RCY  38           HB2      RCY  38  85.952  -0.997  -9.054
  306    HA   RCY  38           HA       RCY  38  87.072   0.116 -11.038
  307    HN1  RCY  38           HN1      RCY  38  84.846  -0.664 -12.800
  308    H    LYS  39           HN       LYS  39  88.565  -1.463 -11.287
  309    HA   LYS  39           HA       LYS  39  88.150  -3.857 -12.723
  310    HB2  LYS  39           HB2      LYS  39  90.212  -3.585 -10.530
  311    HB3  LYS  39           HB1      LYS  39  90.332  -4.504 -12.030
  312    HG2  LYS  39           HG2      LYS  39  90.286  -1.488 -11.737
  313    HG3  LYS  39           HG1      LYS  39  91.629  -2.482 -12.304
  314    HD2  LYS  39           HD2      LYS  39  90.039  -3.279 -14.160
  315    HD3  LYS  39           HD1      LYS  39  89.002  -1.932 -13.690
  316    HE2  LYS  39           HE2      LYS  39  91.912  -1.682 -14.506
  317    HE3  LYS  39           HE1      LYS  39  90.535  -1.314 -15.544
  318    HZ1  LYS  39           HZ1      LYS  39  89.936   0.114 -13.377
  319    HZ2  LYS  39           HZ2      LYS  39  90.805   0.732 -14.699
  320    HZ3  LYS  39           HZ3      LYS  39  91.630   0.186 -13.317
  321    H    SER  40           HN       SER  40  86.438  -5.123 -12.044
  322    HA   SER  40           HA       SER  40  86.806  -6.989  -9.949
  323    HG   SER  40           HG       SER  40  84.272  -4.203  -9.428
  324    HB2  SER  40           HB2      SER  40  84.846  -6.014  -8.482
  325    HB3  SER  40           HB1      SER  40  86.487  -5.420  -8.247
  326    H    LYS  41           HN       LYS  41  85.951  -8.367 -11.561
  327    HA   LYS  41           HA       LYS  41  83.516  -7.897 -12.971
  328    HB2  LYS  41           HB2      LYS  41  83.566 -10.342 -13.433
  329    HB3  LYS  41           HB1      LYS  41  85.134  -9.583 -13.714
  330    HG2  LYS  41           HG2      LYS  41  85.713 -10.238 -11.305
  331    HG3  LYS  41           HG1      LYS  41  84.279 -11.264 -11.352
  332    HD2  LYS  41           HD2      LYS  41  86.645 -11.415 -13.243
  333    HD3  LYS  41           HD1      LYS  41  86.254 -12.574 -11.972
  334    HE2  LYS  41           HE2      LYS  41  84.759 -12.024 -14.534
  335    HE3  LYS  41           HE1      LYS  41  85.369 -13.564 -13.927
  336    HZ1  LYS  41           HZ1      LYS  41  83.761 -13.022 -11.963
  337    HZ2  LYS  41           HZ2      LYS  41  83.172 -13.729 -13.392
  338    HZ3  LYS  41           HZ3      LYS  41  82.981 -12.062 -13.125
  339    HA   PRO  42           HA       PRO  42  80.574  -8.692  -9.740
  340    HB2  PRO  42           HB2      PRO  42  78.372  -9.295 -11.242
  341    HB3  PRO  42           HB1      PRO  42  79.014  -7.648 -11.089
  342    HG2  PRO  42           HG2      PRO  42  79.361  -9.606 -13.304
  343    HG3  PRO  42           HG1      PRO  42  79.094  -7.856 -13.374
  344    HD2  PRO  42           HD2      PRO  42  81.565  -9.003 -13.699
  345    HD3  PRO  42           HD1      PRO  42  81.332  -7.365 -13.050
  346    HA   PRO  43           HA       PRO  43  80.467 -13.111  -9.198
  347    HB2  PRO  43           HB2      PRO  43  78.536 -13.362  -7.307
  348    HB3  PRO  43           HB1      PRO  43  80.111 -12.619  -6.958
  349    HG2  PRO  43           HG2      PRO  43  77.491 -11.309  -7.501
  350    HG3  PRO  43           HG1      PRO  43  78.738 -10.892  -6.314
  351    HD2  PRO  43           HD2      PRO  43  78.437  -9.589  -8.724
  352    HD3  PRO  43           HD1      PRO  43  79.978  -9.688  -7.845
  353    H    LYS  44           HN       LYS  44  79.596 -14.619 -10.562
  354    HA   LYS  44           HA       LYS  44  78.063 -15.626 -12.040
  355    HB2  LYS  44           HB2      LYS  44  76.640 -15.155  -9.453
  356    HB3  LYS  44           HB1      LYS  44  75.675 -15.687 -10.828
  357    HG2  LYS  44           HG2      LYS  44  78.243 -17.115 -10.227
  358    HG3  LYS  44           HG1      LYS  44  76.820 -17.469  -9.246
  359    HD2  LYS  44           HD2      LYS  44  75.535 -17.945 -11.317
  360    HD3  LYS  44           HD1      LYS  44  76.992 -17.655 -12.268
  361    HE2  LYS  44           HE2      LYS  44  76.852 -20.028 -11.959
  362    HE3  LYS  44           HE1      LYS  44  78.119 -19.460 -10.872
  363    HZ1  LYS  44           HZ1      LYS  44  75.381 -19.552  -9.850
  364    HZ2  LYS  44           HZ2      LYS  44  76.851 -19.824  -9.043
  365    HZ3  LYS  44           HZ3      LYS  44  76.195 -21.028 -10.047
  366    H    LYS  45           HN       LYS  45  78.381 -12.642 -12.179
  367    HA   LYS  45           HA       LYS  45  77.410 -10.862 -13.355
  368    HB2  LYS  45           HB2      LYS  45  76.392 -13.325 -14.589
  369    HB3  LYS  45           HB1      LYS  45  75.291 -11.965 -14.789
  370    HG2  LYS  45           HG2      LYS  45  77.168 -10.592 -15.656
  371    HG3  LYS  45           HG1      LYS  45  78.239 -11.985 -15.503
  372    HD2  LYS  45           HD2      LYS  45  77.622 -12.307 -17.689
  373    HD3  LYS  45           HD1      LYS  45  76.253 -13.122 -16.930
  374    HE2  LYS  45           HE2      LYS  45  76.298 -10.201 -17.747
  375    HE3  LYS  45           HE1      LYS  45  75.522 -11.494 -18.661
  376    HZ1  LYS  45           HZ1      LYS  45  73.810 -10.643 -17.390
  377    HZ2  LYS  45           HZ2      LYS  45  74.792 -10.395 -16.026
  378    HZ3  LYS  45           HZ3      LYS  45  74.320 -11.968 -16.461
  379    H    GLY  46           HN       GLY  46  75.380  -9.562 -13.482
  380    HA2  GLY  46           HA2      GLY  46  73.933  -9.708 -10.970
  381    HA3  GLY  46           HA1      GLY  46  73.636  -8.547 -12.265
  382    H    VAL  47           HN       VAL  47  73.392 -12.110 -11.958
  383    HA   VAL  47           HA       VAL  47  70.518 -11.932 -12.660
  384    HB   VAL  47           HB       VAL  47  72.477 -13.625 -14.243
  385   HG11  VAL  47          HG11      VAL  47  69.482 -13.201 -14.376
  386   HG12  VAL  47          HG12      VAL  47  70.345 -14.719 -14.129
  387   HG13  VAL  47          HG13      VAL  47  70.407 -13.915 -15.697
  388   HG21  VAL  47          HG21      VAL  47  71.026 -11.044 -14.891
  389   HG22  VAL  47          HG22      VAL  47  71.750 -12.080 -16.123
  390   HG23  VAL  47          HG23      VAL  47  72.768 -11.325 -14.896
  391    H    GLN  48           HN       GLN  48  73.277 -13.703 -11.450
  392    HA   GLN  48           HA       GLN  48  71.417 -15.463  -9.939
  393    HB2  GLN  48           HB2      GLN  48  73.633 -16.377 -11.781
  394    HB3  GLN  48           HB1      GLN  48  73.067 -17.384 -10.447
  395    HG2  GLN  48           HG2      GLN  48  71.209 -16.216 -12.533
  396    HG3  GLN  48           HG1      GLN  48  71.930 -17.820 -12.678
  397   HE21  GLN  48          HE21      GLN  48  71.517 -19.309 -10.703
  398   HE22  GLN  48          HE22      GLN  48  70.005 -19.181  -9.942
  399    H    GLY  49           HN       GLY  49  72.640 -13.346  -8.777
  400    HA2  GLY  49           HA2      GLY  49  74.522 -14.662  -6.932
  401    HA3  GLY  49           HA1      GLY  49  75.176 -13.286  -7.821
  402    H1U  RCY  50           H1U      RCY  50  79.230  -7.239  -2.253
  403    H1S  RCY  50           H1S      RCY  50  75.466 -10.145  -1.521
  404    HB1  RCY  50           HB1      RCY  50  72.865 -10.238  -5.051
  405    HB2  RCY  50           HB2      RCY  50  74.551 -10.716  -4.854
  406    HA   RCY  50           HA       RCY  50  73.469 -12.469  -3.152
  407    HN1  RCY  50           HN1      RCY  50  74.229 -13.863  -4.882
  408    H    GLY  51           HN       GLY  51  71.638 -12.505  -6.176
  409    HA2  GLY  51           HA2      GLY  51  69.187 -13.063  -4.658
  410    HA3  GLY  51           HA1      GLY  51  69.163 -11.551  -5.566
  411    H    ASP  52           HN       ASP  52  67.607 -12.222  -7.092
  412    HA   ASP  52           HA       ASP  52  68.656 -13.889  -9.261
  413    HB2  ASP  52           HB2      ASP  52  66.560 -15.356  -9.212
  414    HB3  ASP  52           HB1      ASP  52  67.762 -15.686  -7.964
  415    H    ASP  53           HN       ASP  53  66.056 -11.952  -7.878
  416    HA   ASP  53           HA       ASP  53  64.618 -11.639 -10.379
  417    HB2  ASP  53           HB2      ASP  53  64.508  -9.693  -8.073
  418    HB3  ASP  53           HB1      ASP  53  63.227 -10.134  -9.202
  419    H    ILE  54           HN       ILE  54  66.084  -8.976  -8.510
  420    HA   ILE  54           HA       ILE  54  67.557  -8.114 -10.948
  421    HB   ILE  54           HB       ILE  54  65.657  -6.344  -9.375
  422   HG12  ILE  54          HG12      ILE  54  64.830  -6.162 -11.921
  423   HG13  ILE  54          HG11      ILE  54  65.517  -7.786 -11.986
  424   HG21  ILE  54          HG21      ILE  54  66.312  -4.761 -11.341
  425   HG22  ILE  54          HG22      ILE  54  67.726  -5.803 -11.496
  426   HG23  ILE  54          HG23      ILE  54  67.434  -4.932  -9.991
  427   HD11  ILE  54          HD11      ILE  54  63.383  -8.307 -11.269
  428   HD12  ILE  54          HD12      ILE  54  63.181  -6.776 -10.418
  429   HD13  ILE  54          HD13      ILE  54  64.161  -8.057  -9.706
  430    HA   PRO  55           HA       PRO  55  69.983  -7.550  -7.056
  431    HB2  PRO  55           HB2      PRO  55  72.185  -8.948  -7.800
  432    HB3  PRO  55           HB1      PRO  55  70.736  -9.740  -7.150
  433    HG2  PRO  55           HG2      PRO  55  71.679  -9.539  -9.955
  434    HG3  PRO  55           HG1      PRO  55  70.847 -10.868  -9.134
  435    HD2  PRO  55           HD2      PRO  55  69.624  -9.017 -10.834
  436    HD3  PRO  55           HD1      PRO  55  68.776 -10.040  -9.654
  437    H    GLY  56           HN       GLY  56  70.040  -6.297 -10.064
  438    HA2  GLY  56           HA2      GLY  56  71.460  -4.022  -9.712
  439    HA3  GLY  56           HA1      GLY  56  72.764  -5.170 -10.017
  440    H    MET  57           HN       MET  57  69.699  -5.721 -11.554
  441    HA   MET  57           HA       MET  57  70.969  -5.357 -14.182
  442    HB2  MET  57           HB2      MET  57  69.289  -7.231 -13.446
  443    HB3  MET  57           HB1      MET  57  68.056  -6.015 -13.780
  444    HG2  MET  57           HG2      MET  57  70.203  -6.859 -15.749
  445    HG3  MET  57           HG1      MET  57  68.548  -7.469 -15.756
  446    HE1  MET  57           HE1      MET  57  67.768  -5.338 -18.669
  447    HE2  MET  57           HE2      MET  57  67.441  -6.797 -17.736
  448    HE3  MET  57           HE3      MET  57  69.055  -6.518 -18.386
  449    H    GLU  58           HN       GLU  58  68.096  -4.030 -12.497
  450    HA   GLU  58           HA       GLU  58  68.583  -1.405 -13.676
  451    HB2  GLU  58           HB2      GLU  58  67.459  -2.652 -15.540
  452    HB3  GLU  58           HB1      GLU  58  66.067  -2.894 -14.484
  453    HG2  GLU  58           HG2      GLU  58  67.172  -0.134 -14.999
  454    HG3  GLU  58           HG1      GLU  58  66.003  -0.870 -16.096
  455    H    GLY  59           HN       GLY  59  65.437  -2.810 -12.825
  456    HA2  GLY  59           HA2      GLY  59  65.250  -0.843 -10.612
  457    HA3  GLY  59           HA1      GLY  59  63.899  -1.740 -11.304
  458    H1U  RCY  60           H1U      RCY  60  70.757  -1.360  -2.620
  459    H1S  RCY  60           H1S      RCY  60  67.058  -0.015  -4.558
  460    HB1  RCY  60           HB1      RCY  60  67.888  -3.154  -7.077
  461    HB2  RCY  60           HB2      RCY  60  66.777  -3.491  -5.749
  462    HA   RCY  60           HA       RCY  60  66.188  -4.446  -8.088
  463    HN1  RCY  60           HN1      RCY  60  66.096  -1.621  -8.725
  464    H    GLY  61           HN       GLY  61  64.247  -5.472  -7.793
  465    HA2  GLY  61           HA2      GLY  61  61.803  -4.389  -7.001
  466    HA3  GLY  61           HA1      GLY  61  62.263  -6.060  -6.670
  467    H    THR  62           HN       THR  62  63.078  -6.594  -4.602
  468    HA   THR  62           HA       THR  62  62.314  -4.708  -2.481
  469    HB   THR  62           HB       THR  62  61.713  -6.892  -1.903
  470    HG1  THR  62           HG1      THR  62  62.779  -7.051  -0.101
  471   HG21  THR  62          HG21      THR  62  63.398  -8.802  -2.182
  472   HG22  THR  62          HG22      THR  62  64.345  -7.680  -3.160
  473   HG23  THR  62          HG23      THR  62  62.717  -8.135  -3.666
  474    H    ASP  63           HN       ASP  63  63.829  -3.062  -2.313
  475    HA   ASP  63           HA       ASP  63  66.671  -3.491  -2.616
  476    HB2  ASP  63           HB2      ASP  63  66.852  -1.187  -1.651
  477    HB3  ASP  63           HB1      ASP  63  65.724  -1.281  -3.004
  478    H    ILE  64           HN       ILE  64  65.495  -5.332  -0.719
  479    HA   ILE  64           HA       ILE  64  67.143  -4.630   1.662
  480    HB   ILE  64           HB       ILE  64  64.237  -5.464   1.641
  481   HG12  ILE  64          HG12      ILE  64  65.210  -3.009   1.767
  482   HG13  ILE  64          HG11      ILE  64  63.874  -3.482   2.817
  483   HG21  ILE  64          HG21      ILE  64  66.339  -5.858   3.768
  484   HG22  ILE  64          HG22      ILE  64  65.133  -7.006   3.187
  485   HG23  ILE  64          HG23      ILE  64  64.641  -5.647   4.198
  486   HD11  ILE  64          HD11      ILE  64  66.723  -3.847   3.721
  487   HD12  ILE  64          HD12      ILE  64  65.263  -3.700   4.699
  488   HD13  ILE  64          HD13      ILE  64  65.927  -2.282   3.886
  489    H    THR  65           HN       THR  65  65.973  -6.906  -0.607
  490    HA   THR  65           HA       THR  65  66.169  -9.259  -0.741
  491    HB   THR  65           HB       THR  65  68.340  -8.436  -1.547
  492    HG1  THR  65           HG1      THR  65  68.351 -10.588  -1.542
  493   HG21  THR  65          HG21      THR  65  69.082  -7.127   0.327
  494   HG22  THR  65          HG22      THR  65  70.257  -8.424   0.110
  495   HG23  THR  65          HG23      THR  65  69.053  -8.531   1.393
  496    H    VAL  66           HN       VAL  66  65.177  -8.394   1.842
  497    HA   VAL  66           HA       VAL  66  64.704  -9.370   3.917
  498    HB   VAL  66           HB       VAL  66  66.435 -11.711   3.112
  499   HG11  VAL  66          HG11      VAL  66  64.761 -12.947   4.450
  500   HG12  VAL  66          HG12      VAL  66  63.900 -11.438   4.757
  501   HG13  VAL  66          HG13      VAL  66  65.524 -11.673   5.401
  502   HG21  VAL  66          HG21      VAL  66  64.161 -12.594   2.199
  503   HG22  VAL  66          HG22      VAL  66  65.090 -11.487   1.188
  504   HG23  VAL  66          HG23      VAL  66  63.711 -10.891   2.111
  505    H    ILE  67           HN       ILE  67  68.069  -9.718   2.837
  506    HA   ILE  67           HA       ILE  67  68.930  -8.696   5.505
  507    HB   ILE  67           HB       ILE  67  70.141 -11.025   3.982
  508   HG12  ILE  67          HG12      ILE  67  69.081 -10.909   6.817
  509   HG13  ILE  67          HG11      ILE  67  68.086 -11.404   5.447
  510   HG21  ILE  67          HG21      ILE  67  71.692 -11.065   6.015
  511   HG22  ILE  67          HG22      ILE  67  71.113  -9.437   6.367
  512   HG23  ILE  67          HG23      ILE  67  71.969  -9.761   4.860
  513   HD11  ILE  67          HD11      ILE  67  70.678 -12.711   6.328
  514   HD12  ILE  67          HD12      ILE  67  69.731 -13.185   4.917
  515   HD13  ILE  67          HD13      ILE  67  69.058 -13.377   6.536
  516    H1U  RCY  68           H1U      RCY  68  74.148  -0.190   0.570
  517    H1S  RCY  68           H1S      RCY  68  70.645  -2.183   0.347
  518    HB1  RCY  68           HB1      RCY  68  70.307  -3.969   3.499
  519    HB2  RCY  68           HB2      RCY  68  68.955  -4.974   2.983
  520    HA   RCY  68           HA       RCY  68  71.129  -6.499   2.235
  521    HN1  RCY  68           HN1      RCY  68  69.286  -6.639   4.545
  522    HA   PRO  69           HA       PRO  69  74.924  -6.109   4.481
  523    HB2  PRO  69           HB2      PRO  69  75.158  -3.582   2.872
  524    HB3  PRO  69           HB1      PRO  69  76.375  -4.840   3.170
  525    HG2  PRO  69           HG2      PRO  69  74.984  -4.708   0.879
  526    HG3  PRO  69           HG1      PRO  69  75.503  -6.246   1.587
  527    HD2  PRO  69           HD2      PRO  69  72.779  -5.146   1.352
  528    HD3  PRO  69           HD1      PRO  69  73.291  -6.814   1.683
  529    H    TRP  70           HN       TRP  70  72.577  -3.506   4.372
  530    HA   TRP  70           HA       TRP  70  73.867  -1.862   6.387
  531    HD1  TRP  70           HD1      TRP  70  73.820   0.632   6.215
  532    HE1  TRP  70           HE1      TRP  70  73.065   2.393   7.938
  533    HE3  TRP  70           HE3      TRP  70  69.171  -1.161   7.328
  534    HZ2  TRP  70           HZ2      TRP  70  70.786   2.967   9.576
  535    HZ3  TRP  70           HZ3      TRP  70  67.732   0.008   8.968
  536    HH2  TRP  70           HH2      TRP  70  68.530   2.067  10.093
  537    HB2  TRP  70           HB2      TRP  70  72.108  -1.093   4.698
  538    HB3  TRP  70           HB1      TRP  70  70.915  -1.889   5.726
  539    H    GLU  71           HN       GLU  71  73.237  -4.830   6.900
  540    HA   GLU  71           HA       GLU  71  72.193  -4.388   9.643
  541    HB2  GLU  71           HB2      GLU  71  70.993  -6.265   7.596
  542    HB3  GLU  71           HB1      GLU  71  70.767  -6.501   9.330
  543    HG2  GLU  71           HG2      GLU  71  69.849  -4.194   9.496
  544    HG3  GLU  71           HG1      GLU  71  70.002  -4.030   7.747
  545    H    ALA  72           HN       ALA  72  73.311  -6.917   7.367
  546    HA   ALA  72           HA       ALA  72  74.538  -8.454   9.522
  547    HB1  ALA  72           HB1      ALA  72  75.460  -9.817   7.625
  548    HB2  ALA  72           HB2      ALA  72  74.722  -8.672   6.504
  549    HB3  ALA  72           HB3      ALA  72  73.706  -9.639   7.574
  550    H1U  RCY  73           H1U      RCY  73  75.143  -7.305   0.366
  551    H1S  RCY  73           H1S      RCY  73  78.360  -6.119   3.386
  552    HB1  RCY  73           HB1      RCY  73  79.229  -5.672   5.743
  553    HB2  RCY  73           HB2      RCY  73  77.506  -5.744   5.376
  554    HA   RCY  73           HA       RCY  73  78.769  -7.338   7.616
  555    HN1  RCY  73           HN1      RCY  73  76.188  -7.453   6.550
  556    H    ASN  74           HN       ASN  74  77.330  -4.253   6.653
  557    HA   ASN  74           HA       ASN  74  77.206  -2.198   7.781
  558    HB2  ASN  74           HB2      ASN  74  77.884  -3.553  10.383
  559    HB3  ASN  74           HB1      ASN  74  76.822  -2.176  10.088
  560   HD21  ASN  74          HD21      ASN  74  75.058  -3.038   8.182
  561   HD22  ASN  74          HD22      ASN  74  74.222  -4.422   8.698
  562    H    HIS  75           HN       HIS  75  79.673  -4.078   9.587
  563    HA   HIS  75           HA       HIS  75  81.548  -1.808   9.252
  564    HD1  HIS  75           HD1      HIS  75  82.764  -0.833  11.689
  565    HD2  HIS  75           HD2      HIS  75  79.580  -3.374  12.588
  566    HE1  HIS  75           HE1      HIS  75  81.431   0.308  13.516
  567    HE2  HIS  75           HE2      HIS  75  79.490  -1.229  14.072
  568    HB2  HIS  75           HB2      HIS  75  81.611  -4.347  10.895
  569    HB3  HIS  75           HB1      HIS  75  83.015  -3.290  10.744
  570    H1U  RCY  76           H1U      RCY  76  80.189  -0.921  -0.487
  571    H1S  RCY  76           H1S      RCY  76  82.041  -4.172   1.055
  572    HB1  RCY  76           HB1      RCY  76  81.073  -3.459   4.641
  573    HB2  RCY  76           HB2      RCY  76  81.309  -5.190   4.865
  574    HA   RCY  76           HA       RCY  76  83.170  -4.895   6.245
  575    HN1  RCY  76           HN1      RCY  76  81.182  -2.775   6.798
  576    H    GLU  77           HN       GLU  77  82.795  -1.416   6.007
  577    HA   GLU  77           HA       GLU  77  84.873  -0.835   4.165
  578    HB2  GLU  77           HB2      GLU  77  83.194   0.782   5.257
  579    HB3  GLU  77           HB1      GLU  77  84.312   0.835   6.621
  580    HG2  GLU  77           HG2      GLU  77  84.900   2.668   5.191
  581    HG3  GLU  77           HG1      GLU  77  86.136   1.432   4.953
  582    H    LEU  78           HN       LEU  78  87.093  -0.805   4.351
  583    HA   LEU  78           HA       LEU  78  88.322  -2.214   6.552
  584    HG   LEU  78           HG       LEU  78  90.134  -2.831   3.451
  585    HB2  LEU  78           HB2      LEU  78  89.400  -0.646   4.205
  586    HB3  LEU  78           HB1      LEU  78  90.475  -1.314   5.431
  587   HD11  LEU  78          HD11      LEU  78  90.459  -3.479   6.033
  588   HD12  LEU  78          HD12      LEU  78  90.265  -4.707   4.783
  589   HD13  LEU  78          HD13      LEU  78  88.885  -4.230   5.772
  590   HD21  LEU  78          HD21      LEU  78  87.364  -3.265   4.582
  591   HD22  LEU  78          HD22      LEU  78  88.018  -3.838   3.047
  592   HD23  LEU  78          HD23      LEU  78  87.661  -2.125   3.269
  593    H    HIS  79           HN       HIS  79  89.612   0.896   5.505
  594    HA   HIS  79           HA       HIS  79  88.818   2.365   7.852
  595    HD1  HIS  79           HD1      HIS  79  88.761   1.868  10.297
  596    HD2  HIS  79           HD2      HIS  79  92.487   3.655   9.726
  597    HE1  HIS  79           HE1      HIS  79  89.078   3.491  12.215
  598    HE2  HIS  79           HE2      HIS  79  91.342   4.585  11.880
  599    HB2  HIS  79           HB2      HIS  79  90.606   0.568   8.616
  600    HB3  HIS  79           HB1      HIS  79  91.751   1.711   7.914
  601    H    GLU  80           HN       GLU  80  88.505   4.136   6.519
  602    HA   GLU  80           HA       GLU  80  90.950   5.449   5.494
  603    HB2  GLU  80           HB2      GLU  80  89.974   4.012   3.639
  604    HB3  GLU  80           HB1      GLU  80  88.545   5.042   3.696
  605    HG2  GLU  80           HG2      GLU  80  89.848   7.000   3.132
  606    HG3  GLU  80           HG1      GLU  80  91.355   6.096   3.279
  607    H    LEU  81           HN       LEU  81  88.178   6.684   4.041
  608    HA   LEU  81           HA       LEU  81  88.233   9.044   5.724
  609    HG   LEU  81           HG       LEU  81  85.015   8.036   4.328
  610    HB2  LEU  81           HB2      LEU  81  86.588   9.946   4.239
  611    HB3  LEU  81           HB1      LEU  81  87.681   8.994   3.238
  612   HD11  LEU  81          HD11      LEU  81  84.713   9.672   2.543
  613   HD12  LEU  81          HD12      LEU  81  84.363   8.061   1.915
  614   HD13  LEU  81          HD13      LEU  81  85.901   8.839   1.540
  615   HD21  LEU  81          HD21      LEU  81  85.535   6.177   2.593
  616   HD22  LEU  81          HD22      LEU  81  86.389   6.122   4.135
  617   HD23  LEU  81          HD23      LEU  81  87.201   6.743   2.698
  618    H    ALA  82           HN       ALA  82  86.577   6.047   5.876
  619    HA   ALA  82           HA       ALA  82  84.142   6.841   7.135
  620    HB1  ALA  82           HB1      ALA  82  85.799   4.316   7.334
  621    HB2  ALA  82           HB2      ALA  82  84.334   4.575   6.387
  622    HB3  ALA  82           HB3      ALA  82  84.245   4.500   8.147
  623    H    GLN  83           HN       GLN  83  85.789   4.816   9.298
  624    HA   GLN  83           HA       GLN  83  86.498   5.129  11.509
  625    HB2  GLN  83           HB2      GLN  83  88.113   6.682  10.132
  626    HB3  GLN  83           HB1      GLN  83  87.173   7.988  10.854
  627    HG2  GLN  83           HG2      GLN  83  87.587   6.838  13.108
  628    HG3  GLN  83           HG1      GLN  83  88.794   5.863  12.268
  629   HE21  GLN  83          HE21      GLN  83  90.785   6.751  12.892
  630   HE22  GLN  83          HE22      GLN  83  91.170   8.402  12.807
  631    H    TYR  84           HN       TYR  84  83.786   6.243  10.358
  632    HA   TYR  84           HA       TYR  84  82.737   7.063  12.917
  633    HD1  TYR  84           HD2      TYR  84  82.673   9.295  14.507
  634    HD2  TYR  84           HD1      TYR  84  80.753  10.014  10.732
  635    HE1  TYR  84           HE2      TYR  84  80.794  10.416  15.676
  636    HE2  TYR  84           HE1      TYR  84  78.874  11.134  11.901
  637    HH   TYR  84           HH       TYR  84  78.873  12.406  14.577
  638    HB2  TYR  84           HB2      TYR  84  83.908   9.159  12.315
  639    HB3  TYR  84           HB1      TYR  84  83.004   9.223  10.803
  640    H    GLY  85           HN       GLY  85  82.085   7.785   9.458
  641    HA2  GLY  85           HA2      GLY  85  79.249   7.277   9.779
  642    HA3  GLY  85           HA1      GLY  85  80.085   7.526   8.246
  643    H    ILE  86           HN       ILE  86  80.055   5.076  10.852
  644    HA   ILE  86           HA       ILE  86  80.601   2.746  10.565
  645    HB   ILE  86           HB       ILE  86  78.290   2.051   9.116
  646   HG12  ILE  86          HG12      ILE  86  77.794   4.534   9.129
  647   HG13  ILE  86          HG11      ILE  86  76.565   3.544   9.917
  648   HG21  ILE  86          HG21      ILE  86  78.899   0.957  11.157
  649   HG22  ILE  86          HG22      ILE  86  77.354   1.749  11.470
  650   HG23  ILE  86          HG23      ILE  86  78.851   2.472  12.060
  651   HD11  ILE  86          HD11      ILE  86  76.924   4.538  11.910
  652   HD12  ILE  86          HD12      ILE  86  77.900   5.726  11.045
  653   HD13  ILE  86          HD13      ILE  86  78.669   4.317  11.777
  654    H1U  RCY  87           H1U      RCY  87  78.998   2.165  -1.072
  655    H1S  RCY  87           H1S      RCY  87  76.710   1.099   3.088
  656    HB1  RCY  87           HB1      RCY  87  79.685   3.036   4.021
  657    HB2  RCY  87           HB2      RCY  87  78.805   3.930   5.260
  658    HA   RCY  87           HA       RCY  87  80.368   1.462   5.992
  659    HN1  RCY  87           HN1      RCY  87  78.860   3.294   7.504
  Start of MODEL    4
    1    HA   MET   1           HA       MET   1  60.870   7.979  21.747
    2    HB2  MET   1           HB2      MET   1  62.748   9.017  20.478
    3    HB3  MET   1           HB1      MET   1  63.578   9.323  22.003
    4    HG2  MET   1           HG2      MET   1  62.647   6.543  21.331
    5    HG3  MET   1           HG1      MET   1  64.161   7.152  20.663
    6    HE1  MET   1           HE1      MET   1  66.522   7.660  23.448
    7    HE2  MET   1           HE2      MET   1  65.837   8.415  22.012
    8    HE3  MET   1           HE3      MET   1  66.403   6.748  21.938
    9    H    ASN   2           HN       ASN   2  60.144   7.108  23.668
   10    HA   ASN   2           HA       ASN   2  62.083   6.818  25.832
   11    HB2  ASN   2           HB2      ASN   2  61.033   9.043  26.318
   12    HB3  ASN   2           HB1      ASN   2  59.468   8.236  26.422
   13   HD21  ASN   2          HD21      ASN   2  58.932   7.923  28.583
   14   HD22  ASN   2          HD22      ASN   2  60.019   7.459  29.801
   15    H    LEU   3           HN       LEU   3  60.533   5.117  23.992
   16    HA   LEU   3           HA       LEU   3  59.566   3.206  25.973
   17    HG   LEU   3           HG       LEU   3  58.405   5.045  23.184
   18    HB2  LEU   3           HB2      LEU   3  57.278   3.030  25.037
   19    HB3  LEU   3           HB1      LEU   3  57.569   4.613  25.753
   20   HD11  LEU   3          HD11      LEU   3  56.087   3.090  23.099
   21   HD12  LEU   3          HD12      LEU   3  57.692   2.847  22.410
   22   HD13  LEU   3          HD13      LEU   3  56.616   4.068  21.731
   23   HD21  LEU   3          HD21      LEU   3  56.186   6.151  22.880
   24   HD22  LEU   3          HD22      LEU   3  56.901   6.497  24.454
   25   HD23  LEU   3          HD23      LEU   3  55.601   5.313  24.317
   26    H    GLU   4           HN       GLU   4  61.183   3.845  23.260
   27    HA   GLU   4           HA       GLU   4  60.285   1.885  21.385
   28    HB2  GLU   4           HB2      GLU   4  61.961   3.761  20.974
   29    HB3  GLU   4           HB1      GLU   4  63.158   2.743  21.777
   30    HG2  GLU   4           HG2      GLU   4  62.736   0.947  20.139
   31    HG3  GLU   4           HG1      GLU   4  61.539   1.962  19.333
   32    HA   PRO   5           HA       PRO   5  61.089  -1.927  23.600
   33    HB2  PRO   5           HB2      PRO   5  61.968  -2.775  20.860
   34    HB3  PRO   5           HB1      PRO   5  60.907  -3.611  22.011
   35    HG2  PRO   5           HG2      PRO   5  59.937  -2.272  19.908
   36    HG3  PRO   5           HG1      PRO   5  59.080  -2.341  21.456
   37    HD2  PRO   5           HD2      PRO   5  60.478  -0.052  20.200
   38    HD3  PRO   5           HD1      PRO   5  59.213  -0.053  21.448
   39    HA   PRO   6           HA       PRO   6  65.519  -0.803  24.166
   40    HB2  PRO   6           HB2      PRO   6  65.145  -2.962  26.207
   41    HB3  PRO   6           HB1      PRO   6  65.926  -1.376  26.373
   42    HG2  PRO   6           HG2      PRO   6  63.492  -1.836  27.349
   43    HG3  PRO   6           HG1      PRO   6  63.923  -0.273  26.635
   44    HD2  PRO   6           HD2      PRO   6  62.198  -2.436  25.518
   45    HD3  PRO   6           HD1      PRO   6  62.123  -0.681  25.251
   46    H    LYS   7           HN       LYS   7  67.543  -2.111  24.044
   47    HA   LYS   7           HA       LYS   7  68.834  -3.699  22.890
   48    HB2  LYS   7           HB2      LYS   7  66.651  -5.387  24.133
   49    HB3  LYS   7           HB1      LYS   7  67.980  -6.100  23.223
   50    HG2  LYS   7           HG2      LYS   7  68.890  -6.144  25.356
   51    HG3  LYS   7           HG1      LYS   7  69.448  -4.559  24.819
   52    HD2  LYS   7           HD2      LYS   7  68.490  -4.256  27.004
   53    HD3  LYS   7           HD1      LYS   7  67.343  -3.585  25.844
   54    HE2  LYS   7           HE2      LYS   7  65.792  -5.229  26.218
   55    HE3  LYS   7           HE1      LYS   7  67.018  -6.466  26.494
   56    HZ1  LYS   7           HZ1      LYS   7  65.869  -4.534  28.371
   57    HZ2  LYS   7           HZ2      LYS   7  67.483  -5.011  28.600
   58    HZ3  LYS   7           HZ3      LYS   7  66.243  -6.173  28.601
   59    H    ALA   8           HN       ALA   8  68.539  -5.623  21.189
   60    HA   ALA   8           HA       ALA   8  66.876  -4.487  19.044
   61    HB1  ALA   8           HB1      ALA   8  67.919  -6.410  17.719
   62    HB2  ALA   8           HB2      ALA   8  68.862  -6.767  19.166
   63    HB3  ALA   8           HB3      ALA   8  69.046  -5.212  18.355
   64    H    GLU   9           HN       GLU   9  67.322  -7.956  19.527
   65    HA   GLU   9           HA       GLU   9  65.734  -9.685  19.565
   66    HB2  GLU   9           HB2      GLU   9  63.963  -7.736  21.049
   67    HB3  GLU   9           HB1      GLU   9  64.039  -9.490  21.221
   68    HG2  GLU   9           HG2      GLU   9  66.190  -7.504  22.011
   69    HG3  GLU   9           HG1      GLU   9  65.196  -8.469  23.104
   70    H1U  RCY  10           H1U      RCY  10  62.196  -2.335  12.430
   71    H1S  RCY  10           H1S      RCY  10  63.578  -6.147  13.479
   72    HB1  RCY  10           HB1      RCY  10  63.791  -8.574  14.071
   73    HB2  RCY  10           HB2      RCY  10  65.198  -9.246  14.894
   74    HA   RCY  10           HA       RCY  10  63.241  -7.447  16.328
   75    HN1  RCY  10           HN1      RCY  10  65.602  -8.888  17.150
   76    H    ARG  11           HN       ARG  11  63.371 -10.294  14.529
   77    HA   ARG  11           HA       ARG  11  61.770 -11.984  14.230
   78    HE   ARG  11           HE       ARG  11  63.809 -15.256  16.437
   79    HB2  ARG  11           HB2      ARG  11  63.014 -12.727  16.319
   80    HB3  ARG  11           HB1      ARG  11  61.706 -12.011  17.260
   81    HG2  ARG  11           HG2      ARG  11  60.116 -13.549  16.459
   82    HG3  ARG  11           HG1      ARG  11  61.103 -13.981  15.062
   83    HD2  ARG  11           HD2      ARG  11  62.076 -14.528  17.861
   84    HD3  ARG  11           HD1      ARG  11  60.996 -15.657  17.044
   85   HH11  ARG  11          HH21      ARG  11  60.692 -16.063  15.206
   86   HH12  ARG  11          HH22      ARG  11  61.308 -17.005  13.890
   87   HH21  ARG  11          HH11      ARG  11  64.633 -16.482  14.726
   88   HH22  ARG  11          HH12      ARG  11  63.540 -17.243  13.618
   89    H    SER  12           HN       SER  12  60.624  -9.518  13.938
   90    HA   SER  12           HA       SER  12  58.164  -9.512  15.618
   91    HG   SER  12           HG       SER  12  59.766  -7.081  13.038
   92    HB2  SER  12           HB2      SER  12  57.852  -7.274  14.953
   93    HB3  SER  12           HB1      SER  12  59.602  -7.406  15.104
   94    H    ALA  13           HN       ALA  13  59.312 -10.294  12.442
   95    HA   ALA  13           HA       ALA  13  58.198 -11.155  10.568
   96    HB1  ALA  13           HB1      ALA  13  56.331 -12.545  10.975
   97    HB2  ALA  13           HB2      ALA  13  55.789 -11.568  12.339
   98    HB3  ALA  13           HB3      ALA  13  57.221 -12.586  12.497
   99    H    THR  14           HN       THR  14  57.773  -9.511   9.154
  100    HA   THR  14           HA       THR  14  55.158  -8.124   9.417
  101    HB   THR  14           HB       THR  14  56.040  -5.957   9.291
  102    HG1  THR  14           HG1      THR  14  57.457  -6.381   7.567
  103   HG21  THR  14          HG21      THR  14  56.585  -7.113  11.462
  104   HG22  THR  14          HG22      THR  14  57.662  -5.772  11.072
  105   HG23  THR  14          HG23      THR  14  58.196  -7.434  10.822
  106    H    ARG  15           HN       ARG  15  55.050  -6.604   7.266
  107    HA   ARG  15           HA       ARG  15  55.386  -8.515   5.043
  108    HE   ARG  15           HE       ARG  15  51.707  -4.915   4.009
  109    HB2  ARG  15           HB2      ARG  15  54.256  -5.727   4.805
  110    HB3  ARG  15           HB1      ARG  15  53.876  -7.156   3.842
  111    HG2  ARG  15           HG2      ARG  15  52.970  -8.196   5.993
  112    HG3  ARG  15           HG1      ARG  15  53.084  -6.586   6.705
  113    HD2  ARG  15           HD2      ARG  15  51.536  -7.260   4.185
  114    HD3  ARG  15           HD1      ARG  15  50.819  -7.040   5.781
  115   HH11  ARG  15          HH21      ARG  15  51.291  -5.945   7.273
  116   HH12  ARG  15          HH22      ARG  15  51.127  -4.338   7.899
  117   HH21  ARG  15          HH11      ARG  15  51.495  -2.811   4.807
  118   HH22  ARG  15          HH12      ARG  15  51.242  -2.564   6.503
  119    H    VAL  16           HN       VAL  16  56.595  -8.023   3.138
  120    HA   VAL  16           HA       VAL  16  58.849  -6.156   3.625
  121    HB   VAL  16           HB       VAL  16  59.935  -7.283   1.762
  122   HG11  VAL  16          HG11      VAL  16  60.101  -9.500   2.687
  123   HG12  VAL  16          HG12      VAL  16  58.499  -9.377   3.414
  124   HG13  VAL  16          HG13      VAL  16  59.827  -8.397   4.035
  125   HG21  VAL  16          HG21      VAL  16  58.650  -9.210   0.668
  126   HG22  VAL  16          HG22      VAL  16  58.139  -7.584   0.213
  127   HG23  VAL  16          HG23      VAL  16  57.195  -8.511   1.379
  128    H    MET  17           HN       MET  17  59.483  -4.635   1.927
  129    HA   MET  17           HA       MET  17  57.110  -3.560   0.480
  130    HB2  MET  17           HB2      MET  17  58.624  -1.533   0.194
  131    HB3  MET  17           HB1      MET  17  58.167  -1.904   1.857
  132    HG2  MET  17           HG2      MET  17  60.694  -3.046   0.681
  133    HG3  MET  17           HG1      MET  17  60.675  -1.411   1.342
  134    HE1  MET  17           HE1      MET  17  62.687  -2.742   2.698
  135    HE2  MET  17           HE2      MET  17  62.162  -4.340   2.174
  136    HE3  MET  17           HE3      MET  17  62.370  -4.007   3.892
  137    H    GLY  18           HN       GLY  18  57.625  -2.607  -1.735
  138    HA2  GLY  18           HA2      GLY  18  58.216  -3.103  -3.958
  139    HA3  GLY  18           HA1      GLY  18  59.851  -3.213  -3.303
  140    H    GLY  19           HN       GLY  19  56.879  -5.126  -3.763
  141    HA2  GLY  19           HA2      GLY  19  58.042  -7.657  -3.113
  142    HA3  GLY  19           HA1      GLY  19  56.603  -7.431  -4.107
  143    HA   PRO  20           HA       PRO  20  58.461  -8.155  -8.032
  144    HB2  PRO  20           HB2      PRO  20  58.850  -5.225  -8.526
  145    HB3  PRO  20           HB1      PRO  20  58.108  -6.454  -9.568
  146    HG2  PRO  20           HG2      PRO  20  56.631  -4.713  -8.195
  147    HG3  PRO  20           HG1      PRO  20  56.102  -6.384  -8.450
  148    HD2  PRO  20           HD2      PRO  20  57.102  -5.092  -5.963
  149    HD3  PRO  20           HD1      PRO  20  56.009  -6.480  -6.154
  150    H1U  RCY  21           H1U      RCY  21  62.501  -2.225  -6.554
  151    H1S  RCY  21           H1S      RCY  21  62.569  -6.516  -6.849
  152    HB1  RCY  21           HB1      RCY  21  63.815  -9.524  -7.370
  153    HB2  RCY  21           HB2      RCY  21  62.164  -9.696  -6.775
  154    HA   RCY  21           HA       RCY  21  62.793  -6.995  -7.772
  155    HN1  RCY  21           HN1      RCY  21  60.526  -8.746  -8.594
  156    H    THR  22           HN       THR  22  63.570  -6.476  -9.776
  157    HA   THR  22           HA       THR  22  64.407  -8.721 -11.537
  158    HB   THR  22           HB       THR  22  62.971  -6.285 -12.616
  159    HG1  THR  22           HG1      THR  22  61.205  -7.258 -12.100
  160   HG21  THR  22          HG21      THR  22  64.489  -7.412 -14.177
  161   HG22  THR  22          HG22      THR  22  62.813  -7.703 -14.644
  162   HG23  THR  22          HG23      THR  22  63.730  -8.963 -13.818
  163    HA   PRO  23           HA       PRO  23  67.969  -5.895 -10.828
  164    HB2  PRO  23           HB2      PRO  23  69.132  -8.017 -12.597
  165    HB3  PRO  23           HB1      PRO  23  69.799  -7.289 -11.122
  166    HG2  PRO  23           HG2      PRO  23  68.715  -9.719 -11.101
  167    HG3  PRO  23           HG1      PRO  23  68.517  -8.607  -9.736
  168    HD2  PRO  23           HD2      PRO  23  66.522  -9.427 -11.797
  169    HD3  PRO  23           HD1      PRO  23  66.263  -8.923 -10.112
  170    H    ARG  24           HN       ARG  24  67.466  -4.095 -12.106
  171    HA   ARG  24           HA       ARG  24  68.417  -4.171 -14.891
  172    HE   ARG  24           HE       ARG  24  63.579  -2.396 -15.884
  173    HB2  ARG  24           HB2      ARG  24  65.899  -4.820 -14.795
  174    HB3  ARG  24           HB1      ARG  24  65.629  -3.122 -14.404
  175    HG2  ARG  24           HG2      ARG  24  66.844  -2.465 -16.460
  176    HG3  ARG  24           HG1      ARG  24  67.072  -4.168 -16.860
  177    HD2  ARG  24           HD2      ARG  24  65.154  -3.471 -18.099
  178    HD3  ARG  24           HD1      ARG  24  64.527  -4.392 -16.732
  179   HH11  ARG  24          HH21      ARG  24  65.897  -1.812 -18.368
  180   HH12  ARG  24          HH22      ARG  24  65.531  -0.123 -18.496
  181   HH21  ARG  24          HH11      ARG  24  63.088  -0.195 -16.037
  182   HH22  ARG  24          HH12      ARG  24  63.941   0.792 -17.177
  183    H    LYS  25           HN       LYS  25  68.403  -1.907 -15.821
  184    HA   LYS  25           HA       LYS  25  68.316   0.230 -13.747
  185    HB2  LYS  25           HB2      LYS  25  70.517   1.056 -14.405
  186    HB3  LYS  25           HB1      LYS  25  70.663  -0.628 -13.901
  187    HG2  LYS  25           HG2      LYS  25  70.339  -1.206 -16.398
  188    HG3  LYS  25           HG1      LYS  25  70.688   0.496 -16.701
  189    HD2  LYS  25           HD2      LYS  25  72.823   0.253 -15.442
  190    HD3  LYS  25           HD1      LYS  25  72.484  -1.467 -15.245
  191    HE2  LYS  25           HE2      LYS  25  72.875   0.009 -17.864
  192    HE3  LYS  25           HE1      LYS  25  73.965  -1.181 -17.153
  193    HZ1  LYS  25           HZ1      LYS  25  72.823  -2.599 -18.438
  194    HZ2  LYS  25           HZ2      LYS  25  71.480  -1.569 -18.585
  195    HZ3  LYS  25           HZ3      LYS  25  71.665  -2.536 -17.200
  196    H    GLY  26           HN       GLY  26  68.963   2.408 -15.090
  197    HA2  GLY  26           HA2      GLY  26  68.231   2.505 -17.860
  198    HA3  GLY  26           HA1      GLY  26  66.827   2.905 -16.870
  199    HA   PRO  27           HA       PRO  27  67.850   7.154 -16.416
  200    HB2  PRO  27           HB2      PRO  27  68.151   6.625 -13.482
  201    HB3  PRO  27           HB1      PRO  27  67.228   7.896 -14.308
  202    HG2  PRO  27           HG2      PRO  27  66.047   5.731 -13.274
  203    HG3  PRO  27           HG1      PRO  27  65.459   6.512 -14.750
  204    HD2  PRO  27           HD2      PRO  27  66.836   3.907 -14.438
  205    HD3  PRO  27           HD1      PRO  27  65.790   4.479 -15.755
  206    HA   PRO  28           HA       PRO  28  72.379   6.754 -16.580
  207    HB2  PRO  28           HB2      PRO  28  72.131   9.736 -16.620
  208    HB3  PRO  28           HB1      PRO  28  73.061   8.667 -17.689
  209    HG2  PRO  28           HG2      PRO  28  70.773   9.789 -18.476
  210    HG3  PRO  28           HG1      PRO  28  71.236   8.157 -18.986
  211    HD2  PRO  28           HD2      PRO  28  69.158   8.992 -17.015
  212    HD3  PRO  28           HD1      PRO  28  69.217   7.549 -18.051
  213    H    LYS  29           HN       LYS  29  73.924   6.813 -14.945
  214    HA   LYS  29           HA       LYS  29  73.075   7.889 -12.335
  215    HB2  LYS  29           HB2      LYS  29  75.127   6.790 -11.490
  216    HB3  LYS  29           HB1      LYS  29  74.135   5.670 -12.425
  217    HG2  LYS  29           HG2      LYS  29  75.558   6.238 -14.439
  218    HG3  LYS  29           HG1      LYS  29  76.630   7.118 -13.349
  219    HD2  LYS  29           HD2      LYS  29  77.100   5.109 -12.085
  220    HD3  LYS  29           HD1      LYS  29  75.886   4.203 -12.989
  221    HE2  LYS  29           HE2      LYS  29  78.348   3.909 -13.706
  222    HE3  LYS  29           HE1      LYS  29  77.172   4.242 -14.977
  223    HZ1  LYS  29           HZ1      LYS  29  78.989   5.683 -15.330
  224    HZ2  LYS  29           HZ2      LYS  29  79.046   6.147 -13.697
  225    HZ3  LYS  29           HZ3      LYS  29  77.752   6.644 -14.679
  226    H1U  RCY  30           H1U      RCY  30  80.681  12.875  -7.747
  227    H1S  RCY  30           H1S      RCY  30  76.198  11.887  -7.707
  228    HB1  RCY  30           HB1      RCY  30  74.439  12.289 -10.841
  229    HB2  RCY  30           HB2      RCY  30  76.151  12.438 -10.442
  230    HA   RCY  30           HA       RCY  30  75.511  11.506 -12.787
  231    HN1  RCY  30           HN1      RCY  30  74.433   9.377 -11.115
  232    H    LYS  31           HN       LYS  31  76.816   8.789 -11.036
  233    HA   LYS  31           HA       LYS  31  79.494   9.686 -10.691
  234    HB2  LYS  31           HB2      LYS  31  78.328   7.523  -9.842
  235    HB3  LYS  31           HB1      LYS  31  78.789   6.840 -11.399
  236    HG2  LYS  31           HG2      LYS  31  80.783   6.362 -10.434
  237    HG3  LYS  31           HG1      LYS  31  81.119   8.090 -10.545
  238    HD2  LYS  31           HD2      LYS  31  79.647   6.857  -8.206
  239    HD3  LYS  31           HD1      LYS  31  81.397   7.072  -8.226
  240    HE2  LYS  31           HE2      LYS  31  80.644   9.037  -7.180
  241    HE3  LYS  31           HE1      LYS  31  80.853   9.541  -8.857
  242    HZ1  LYS  31           HZ1      LYS  31  78.599   9.872  -7.443
  243    HZ2  LYS  31           HZ2      LYS  31  78.265   8.413  -8.248
  244    HZ3  LYS  31           HZ3      LYS  31  78.663   9.805  -9.137
  245    H    GLN  32           HN       GLN  32  80.763   7.453 -12.226
  246    HA   GLN  32           HA       GLN  32  80.310   7.969 -15.042
  247    HB2  GLN  32           HB2      GLN  32  81.531  10.065 -14.133
  248    HB3  GLN  32           HB1      GLN  32  82.939   9.014 -13.982
  249    HG2  GLN  32           HG2      GLN  32  81.364   9.343 -16.549
  250    HG3  GLN  32           HG1      GLN  32  82.819  10.266 -16.171
  251   HE21  GLN  32          HE21      GLN  32  81.840   7.560 -17.834
  252   HE22  GLN  32          HE22      GLN  32  83.269   6.648 -17.755
  253    H    ARG  33           HN       ARG  33  80.249   5.576 -14.541
  254    HA   ARG  33           HA       ARG  33  81.235   3.455 -14.678
  255    HE   ARG  33           HE       ARG  33  85.743   3.222 -16.132
  256    HB2  ARG  33           HB2      ARG  33  82.283   4.699 -16.692
  257    HB3  ARG  33           HB1      ARG  33  83.726   4.833 -15.686
  258    HG2  ARG  33           HG2      ARG  33  83.748   2.378 -15.397
  259    HG3  ARG  33           HG1      ARG  33  82.319   2.248 -16.422
  260    HD2  ARG  33           HD2      ARG  33  84.080   1.841 -17.925
  261    HD3  ARG  33           HD1      ARG  33  83.739   3.553 -18.172
  262   HH11  ARG  33          HH21      ARG  33  85.143   3.038 -19.522
  263   HH12  ARG  33          HH22      ARG  33  86.774   3.417 -19.966
  264   HH21  ARG  33          HH11      ARG  33  87.876   3.718 -16.692
  265   HH22  ARG  33          HH12      ARG  33  88.321   3.802 -18.364
  266    H    GLN  34           HN       GLN  34  81.675   2.603 -12.705
  267    HA   GLN  34           HA       GLN  34  83.571   3.859 -10.876
  268    HB2  GLN  34           HB2      GLN  34  81.470   2.607 -10.184
  269    HB3  GLN  34           HB1      GLN  34  82.310   1.118 -10.622
  270    HG2  GLN  34           HG2      GLN  34  84.169   1.804  -9.058
  271    HG3  GLN  34           HG1      GLN  34  83.143   3.133  -8.518
  272   HE21  GLN  34          HE21      GLN  34  82.849   2.263  -6.358
  273   HE22  GLN  34          HE22      GLN  34  81.938   0.860  -6.074
  274    H    THR  35           HN       THR  35  85.732   3.585 -11.109
  275    HA   THR  35           HA       THR  35  86.858   0.914 -11.446
  276    HB   THR  35           HB       THR  35  87.517   2.934 -13.598
  277    HG1  THR  35           HG1      THR  35  85.943   0.715 -14.151
  278   HG21  THR  35          HG21      THR  35  87.770  -0.060 -13.730
  279   HG22  THR  35          HG22      THR  35  89.003   0.902 -12.916
  280   HG23  THR  35          HG23      THR  35  88.664   1.167 -14.626
  281    H    ARG  36           HN       ARG  36  87.230   2.511  -9.311
  282    HA   ARG  36           HA       ARG  36  90.085   3.253  -9.561
  283    HE   ARG  36           HE       ARG  36  90.547   7.960 -11.661
  284    HB2  ARG  36           HB2      ARG  36  87.897   5.155  -8.686
  285    HB3  ARG  36           HB1      ARG  36  89.597   5.409  -8.292
  286    HG2  ARG  36           HG2      ARG  36  90.104   5.240 -10.763
  287    HG3  ARG  36           HG1      ARG  36  88.364   5.249 -11.053
  288    HD2  ARG  36           HD2      ARG  36  88.130   7.435 -10.081
  289    HD3  ARG  36           HD1      ARG  36  89.788   7.408  -9.479
  290   HH11  ARG  36          HH21      ARG  36  87.219   7.065 -11.575
  291   HH12  ARG  36          HH22      ARG  36  86.904   7.570 -13.201
  292   HH21  ARG  36          HH11      ARG  36  90.155   8.625 -13.785
  293   HH22  ARG  36          HH12      ARG  36  88.566   8.453 -14.453
  294    H    GLN  37           HN       GLN  37  87.646   1.723  -7.934
  295    HA   GLN  37           HA       GLN  37  87.546   0.682  -5.838
  296    HB2  GLN  37           HB2      GLN  37  90.426   1.493  -5.425
  297    HB3  GLN  37           HB1      GLN  37  89.588   0.068  -4.811
  298    HG2  GLN  37           HG2      GLN  37  89.263  -0.587  -7.282
  299    HG3  GLN  37           HG1      GLN  37  90.486   0.634  -7.638
  300   HE21  GLN  37          HE21      GLN  37  90.310  -1.620  -4.839
  301   HE22  GLN  37          HE22      GLN  37  91.799  -2.370  -5.157
  302    H1U  RCY  38           H1U      RCY  38  83.143   0.573  -2.768
  303    H1S  RCY  38           H1S      RCY  38  86.921   2.779  -4.879
  304    HB1  RCY  38           HB1      RCY  38  88.655   6.117  -5.142
  305    HB2  RCY  38           HB2      RCY  38  87.853   6.396  -3.597
  306    HA   RCY  38           HA       RCY  38  89.862   4.884  -3.447
  307    HN1  RCY  38           HN1      RCY  38  89.859   3.352  -5.256
  308    H    LYS  39           HN       LYS  39  88.938   2.185  -2.699
  309    HA   LYS  39           HA       LYS  39  86.890   2.834  -0.621
  310    HB2  LYS  39           HB2      LYS  39  86.451   0.907  -2.167
  311    HB3  LYS  39           HB1      LYS  39  87.890   0.117  -1.524
  312    HG2  LYS  39           HG2      LYS  39  86.943   0.022   0.691
  313    HG3  LYS  39           HG1      LYS  39  85.585   1.041   0.210
  314    HD2  LYS  39           HD2      LYS  39  84.623  -1.075   0.077
  315    HD3  LYS  39           HD1      LYS  39  85.185  -0.854  -1.580
  316    HE2  LYS  39           HE2      LYS  39  85.986  -2.998  -1.026
  317    HE3  LYS  39           HE1      LYS  39  87.385  -1.960  -0.747
  318    HZ1  LYS  39           HZ1      LYS  39  85.741  -3.404   1.155
  319    HZ2  LYS  39           HZ2      LYS  39  86.175  -1.828   1.621
  320    HZ3  LYS  39           HZ3      LYS  39  87.378  -2.968   1.244
  321    H    SER  40           HN       SER  40  89.389   0.312  -0.589
  322    HA   SER  40           HA       SER  40  90.879  -0.263   1.141
  323    HG   SER  40           HG       SER  40  92.415   0.701   2.463
  324    HB2  SER  40           HB2      SER  40  92.087   1.584   0.011
  325    HB3  SER  40           HB1      SER  40  91.296   2.741   1.076
  326    H    LYS  41           HN       LYS  41  91.502   1.938   3.223
  327    HA   LYS  41           HA       LYS  41  88.982   1.922   4.784
  328    HB2  LYS  41           HB2      LYS  41  90.295   1.059   6.788
  329    HB3  LYS  41           HB1      LYS  41  89.943  -0.133   5.538
  330    HG2  LYS  41           HG2      LYS  41  92.427   1.273   4.976
  331    HG3  LYS  41           HG1      LYS  41  92.475   0.502   6.562
  332    HD2  LYS  41           HD2      LYS  41  91.846  -1.641   5.589
  333    HD3  LYS  41           HD1      LYS  41  91.647  -0.896   4.002
  334    HE2  LYS  41           HE2      LYS  41  93.966  -0.512   3.761
  335    HE3  LYS  41           HE1      LYS  41  94.269  -0.729   5.485
  336    HZ1  LYS  41           HZ1      LYS  41  93.759  -3.050   5.288
  337    HZ2  LYS  41           HZ2      LYS  41  94.943  -2.653   4.136
  338    HZ3  LYS  41           HZ3      LYS  41  93.328  -2.871   3.657
  339    HA   PRO  42           HA       PRO  42  91.373   5.803   5.351
  340    HB2  PRO  42           HB2      PRO  42  89.243   7.499   5.323
  341    HB3  PRO  42           HB1      PRO  42  89.988   6.873   3.840
  342    HG2  PRO  42           HG2      PRO  42  87.482   6.038   5.191
  343    HG3  PRO  42           HG1      PRO  42  87.858   6.133   3.464
  344    HD2  PRO  42           HD2      PRO  42  87.856   3.782   4.954
  345    HD3  PRO  42           HD1      PRO  42  88.711   4.003   3.413
  346    HA   PRO  43           HA       PRO  43  90.777   6.224   9.716
  347    HB2  PRO  43           HB2      PRO  43  91.432   8.858  10.125
  348    HB3  PRO  43           HB1      PRO  43  92.629   7.597   9.769
  349    HG2  PRO  43           HG2      PRO  43  91.421   9.618   7.949
  350    HG3  PRO  43           HG1      PRO  43  93.089   9.027   8.034
  351    HD2  PRO  43           HD2      PRO  43  91.310   8.159   6.146
  352    HD3  PRO  43           HD1      PRO  43  92.632   7.144   6.764
  353    H    LYS  44           HN       LYS  44  89.481   7.381  11.399
  354    HA   LYS  44           HA       LYS  44  87.393   8.158  12.142
  355    HB2  LYS  44           HB2      LYS  44  87.632  10.031   9.769
  356    HB3  LYS  44           HB1      LYS  44  86.700  10.293  11.244
  357    HG2  LYS  44           HG2      LYS  44  88.904  10.102  12.516
  358    HG3  LYS  44           HG1      LYS  44  89.709  10.200  10.950
  359    HD2  LYS  44           HD2      LYS  44  89.618  12.438  11.816
  360    HD3  LYS  44           HD1      LYS  44  88.407  12.341  10.537
  361    HE2  LYS  44           HE2      LYS  44  86.636  12.433  12.014
  362    HE3  LYS  44           HE1      LYS  44  87.544  11.661  13.314
  363    HZ1  LYS  44           HZ1      LYS  44  88.856  14.023  12.786
  364    HZ2  LYS  44           HZ2      LYS  44  87.879  13.676  14.132
  365    HZ3  LYS  44           HZ3      LYS  44  87.208  14.424  12.762
  366    H    LYS  45           HN       LYS  45  86.278   6.198  11.555
  367    HA   LYS  45           HA       LYS  45  84.473   6.550   9.198
  368    HB2  LYS  45           HB2      LYS  45  84.640   4.108   8.776
  369    HB3  LYS  45           HB1      LYS  45  86.198   4.912   8.580
  370    HG2  LYS  45           HG2      LYS  45  86.644   4.307  11.032
  371    HG3  LYS  45           HG1      LYS  45  85.252   3.230  10.906
  372    HD2  LYS  45           HD2      LYS  45  86.335   2.123   8.948
  373    HD3  LYS  45           HD1      LYS  45  87.755   3.140   9.196
  374    HE2  LYS  45           HE2      LYS  45  86.615   1.101  11.126
  375    HE3  LYS  45           HE1      LYS  45  88.164   1.018  10.286
  376    HZ1  LYS  45           HZ1      LYS  45  87.348   2.920  12.407
  377    HZ2  LYS  45           HZ2      LYS  45  88.733   3.146  11.449
  378    HZ3  LYS  45           HZ3      LYS  45  88.607   1.784  12.457
  379    H    GLY  46           HN       GLY  46  84.737   6.220  12.481
  380    HA2  GLY  46           HA2      GLY  46  82.374   4.504  12.869
  381    HA3  GLY  46           HA1      GLY  46  83.311   5.281  14.147
  382    H    VAL  47           HN       VAL  47  80.974   5.766  14.862
  383    HA   VAL  47           HA       VAL  47  79.635   7.913  13.358
  384    HB   VAL  47           HB       VAL  47  78.029   7.838  15.310
  385   HG11  VAL  47          HG11      VAL  47  78.632   5.165  14.007
  386   HG12  VAL  47          HG12      VAL  47  77.735   6.475  13.239
  387   HG13  VAL  47          HG13      VAL  47  77.081   5.678  14.670
  388   HG21  VAL  47          HG21      VAL  47  78.281   6.093  16.962
  389   HG22  VAL  47          HG22      VAL  47  79.790   7.005  16.926
  390   HG23  VAL  47          HG23      VAL  47  79.689   5.436  16.127
  391    H    GLN  48           HN       GLN  48  82.365   8.089  14.901
  392    HA   GLN  48           HA       GLN  48  81.974   9.980  17.023
  393    HB2  GLN  48           HB2      GLN  48  84.106   8.592  16.257
  394    HB3  GLN  48           HB1      GLN  48  84.452  10.051  15.330
  395    HG2  GLN  48           HG2      GLN  48  83.979   9.897  18.322
  396    HG3  GLN  48           HG1      GLN  48  85.519  10.215  17.522
  397   HE21  GLN  48          HE21      GLN  48  85.768  12.310  16.409
  398   HE22  GLN  48          HE22      GLN  48  84.739  13.610  16.773
  399    H    GLY  49           HN       GLY  49  82.515  10.360  13.533
  400    HA2  GLY  49           HA2      GLY  49  81.064  12.765  13.298
  401    HA3  GLY  49           HA1      GLY  49  82.747  13.220  13.566
  402    H1U  RCY  50           H1U      RCY  50  81.018   5.376   4.901
  403    H1S  RCY  50           H1S      RCY  50  79.060   8.517   8.063
  404    HB1  RCY  50           HB1      RCY  50  82.792   9.973   9.969
  405    HB2  RCY  50           HB2      RCY  50  82.327  10.077   8.271
  406    HA   RCY  50           HA       RCY  50  82.439  12.332   9.123
  407    HN1  RCY  50           HN1      RCY  50  80.477  12.010  11.272
  408    H    GLY  51           HN       GLY  51  79.205  11.693  10.267
  409    HA2  GLY  51           HA2      GLY  51  78.053  13.157   8.045
  410    HA3  GLY  51           HA1      GLY  51  77.715  11.428   7.934
  411    H    ASP  52           HN       ASP  52  76.496  10.432   9.673
  412    HA   ASP  52           HA       ASP  52  74.588  10.437  11.054
  413    HB2  ASP  52           HB2      ASP  52  76.012  12.730  12.424
  414    HB3  ASP  52           HB1      ASP  52  74.920  11.551  13.150
  415    H    ASP  53           HN       ASP  53  73.337  11.355   9.178
  416    HA   ASP  53           HA       ASP  53  71.972  13.810  10.031
  417    HB2  ASP  53           HB2      ASP  53  72.310  14.958   7.857
  418    HB3  ASP  53           HB1      ASP  53  73.833  14.733   8.718
  419    H    ILE  54           HN       ILE  54  72.325  11.141   7.755
  420    HA   ILE  54           HA       ILE  54  69.881  11.461   6.349
  421    HB   ILE  54           HB       ILE  54  71.801   9.828   5.864
  422   HG12  ILE  54          HG12      ILE  54  68.989   8.689   5.846
  423   HG13  ILE  54          HG11      ILE  54  69.589   9.863   4.675
  424   HG21  ILE  54          HG21      ILE  54  71.804   7.713   6.947
  425   HG22  ILE  54          HG22      ILE  54  70.228   8.000   7.684
  426   HG23  ILE  54          HG23      ILE  54  71.642   8.887   8.254
  427   HD11  ILE  54          HD11      ILE  54  69.924   7.780   3.608
  428   HD12  ILE  54          HD12      ILE  54  70.480   7.012   5.095
  429   HD13  ILE  54          HD13      ILE  54  71.511   8.179   4.267
  430    HA   PRO  55           HA       PRO  55  67.114  10.593   9.769
  431    HB2  PRO  55           HB2      PRO  55  64.767  10.536   8.371
  432    HB3  PRO  55           HB1      PRO  55  65.620  12.039   8.773
  433    HG2  PRO  55           HG2      PRO  55  65.554  10.536   6.209
  434    HG3  PRO  55           HG1      PRO  55  65.553  12.283   6.495
  435    HD2  PRO  55           HD2      PRO  55  67.794  10.864   5.745
  436    HD3  PRO  55           HD1      PRO  55  67.853  12.391   6.653
  437    H    GLY  56           HN       GLY  56  65.645   8.922   6.979
  438    HA2  GLY  56           HA2      GLY  56  66.173   6.316   8.336
  439    HA3  GLY  56           HA1      GLY  56  64.530   6.725   7.842
  440    H    MET  57           HN       MET  57  67.823   6.582   6.441
  441    HA   MET  57           HA       MET  57  68.482   6.067   4.237
  442    HB2  MET  57           HB2      MET  57  66.311   3.976   4.369
  443    HB3  MET  57           HB1      MET  57  67.897   3.866   3.605
  444    HG2  MET  57           HG2      MET  57  68.905   4.122   5.926
  445    HG3  MET  57           HG1      MET  57  67.277   3.906   6.567
  446    HE1  MET  57           HE1      MET  57  68.254   0.513   7.536
  447    HE2  MET  57           HE2      MET  57  66.743   1.419   7.493
  448    HE3  MET  57           HE3      MET  57  68.239   2.233   7.946
  449    H    GLU  58           HN       GLU  58  66.026   7.889   4.622
  450    HA   GLU  58           HA       GLU  58  65.177   7.765   1.770
  451    HB2  GLU  58           HB2      GLU  58  63.362   7.823   4.188
  452    HB3  GLU  58           HB1      GLU  58  62.825   8.382   2.603
  453    HG2  GLU  58           HG2      GLU  58  63.487   6.162   1.653
  454    HG3  GLU  58           HG1      GLU  58  63.855   5.615   3.289
  455    H    GLY  59           HN       GLY  59  67.034   9.524   2.385
  456    HA2  GLY  59           HA2      GLY  59  65.586  12.105   2.380
  457    HA3  GLY  59           HA1      GLY  59  66.820  11.889   3.623
  458    H1U  RCY  60           H1U      RCY  60  76.223   8.516   0.469
  459    H1S  RCY  60           H1S      RCY  60  71.892  10.591  -0.272
  460    HB1  RCY  60           HB1      RCY  60  69.956  11.575  -0.050
  461    HB2  RCY  60           HB2      RCY  60  70.504  11.622   1.625
  462    HA   RCY  60           HA       RCY  60  70.028  14.193   1.432
  463    HN1  RCY  60           HN1      RCY  60  68.262  13.446   2.783
  464    H    GLY  61           HN       GLY  61  68.393  12.013  -0.864
  465    HA2  GLY  61           HA2      GLY  61  67.145  14.257  -2.270
  466    HA3  GLY  61           HA1      GLY  61  68.493  13.529  -3.146
  467    H    THR  62           HN       THR  62  66.338  11.721  -1.038
  468    HA   THR  62           HA       THR  62  65.242   9.683  -1.561
  469    HB   THR  62           HB       THR  62  63.467  11.349  -1.713
  470    HG1  THR  62           HG1      THR  62  62.816  10.042  -3.997
  471   HG21  THR  62          HG21      THR  62  64.469  11.673  -4.552
  472   HG22  THR  62          HG22      THR  62  64.420  12.903  -3.288
  473   HG23  THR  62          HG23      THR  62  62.919  12.299  -3.989
  474    H    ASP  63           HN       ASP  63  67.689  10.102  -3.171
  475    HA   ASP  63           HA       ASP  63  67.199   9.419  -5.913
  476    HB2  ASP  63           HB2      ASP  63  69.586   9.052  -4.092
  477    HB3  ASP  63           HB1      ASP  63  69.608   8.539  -5.779
  478    H    ILE  64           HN       ILE  64  66.724   7.647  -3.076
  479    HA   ILE  64           HA       ILE  64  67.355   5.015  -4.160
  480    HB   ILE  64           HB       ILE  64  67.480   5.247  -1.775
  481   HG12  ILE  64          HG12      ILE  64  64.817   3.883  -2.088
  482   HG13  ILE  64          HG11      ILE  64  66.245   3.196  -2.864
  483   HG21  ILE  64          HG21      ILE  64  65.179   6.926  -2.195
  484   HG22  ILE  64          HG22      ILE  64  66.184   6.777  -0.754
  485   HG23  ILE  64          HG23      ILE  64  64.797   5.710  -0.976
  486   HD11  ILE  64          HD11      ILE  64  65.789   2.306  -0.541
  487   HD12  ILE  64          HD12      ILE  64  66.135   3.922   0.074
  488   HD13  ILE  64          HD13      ILE  64  67.394   3.006  -0.754
  489    H    THR  65           HN       THR  65  64.192   5.654  -2.747
  490    HA   THR  65           HA       THR  65  62.065   5.065  -3.546
  491    HB   THR  65           HB       THR  65  63.053   6.079  -6.214
  492    HG1  THR  65           HG1      THR  65  63.745   7.558  -4.698
  493   HG21  THR  65          HG21      THR  65  60.748   5.187  -6.054
  494   HG22  THR  65          HG22      THR  65  60.753   6.921  -6.373
  495   HG23  THR  65          HG23      THR  65  60.410   6.325  -4.749
  496    H    VAL  66           HN       VAL  66  63.107   2.763  -3.345
  497    HA   VAL  66           HA       VAL  66  63.218   0.589  -4.210
  498    HB   VAL  66           HB       VAL  66  61.794   1.596  -6.669
  499   HG11  VAL  66          HG11      VAL  66  62.495  -0.820  -6.370
  500   HG12  VAL  66          HG12      VAL  66  60.764  -0.581  -6.608
  501   HG13  VAL  66          HG13      VAL  66  61.397  -0.896  -4.992
  502   HG21  VAL  66          HG21      VAL  66  59.683   1.161  -5.215
  503   HG22  VAL  66          HG22      VAL  66  60.530   2.693  -5.002
  504   HG23  VAL  66          HG23      VAL  66  60.764   1.387  -3.840
  505    H    ILE  67           HN       ILE  67  64.692   3.209  -5.664
  506    HA   ILE  67           HA       ILE  67  66.377   1.390  -7.333
  507    HB   ILE  67           HB       ILE  67  65.493   4.183  -8.124
  508   HG12  ILE  67          HG12      ILE  67  64.764   1.524  -9.384
  509   HG13  ILE  67          HG11      ILE  67  63.719   2.379  -8.250
  510   HG21  ILE  67          HG21      ILE  67  67.693   3.723  -8.984
  511   HG22  ILE  67          HG22      ILE  67  66.560   3.473 -10.313
  512   HG23  ILE  67          HG23      ILE  67  67.230   2.087  -9.452
  513   HD11  ILE  67          HD11      ILE  67  64.708   3.422 -10.919
  514   HD12  ILE  67          HD12      ILE  67  63.770   4.366  -9.762
  515   HD13  ILE  67          HD13      ILE  67  63.056   2.947 -10.527
  516    H1U  RCY  68           H1U      RCY  68  70.303   2.409   2.260
  517    H1S  RCY  68           H1S      RCY  68  70.176  -0.312  -1.714
  518    HB1  RCY  68           HB1      RCY  68  68.438   2.448  -3.230
  519    HB2  RCY  68           HB2      RCY  68  70.068   3.104  -3.102
  520    HA   RCY  68           HA       RCY  68  69.199   4.056  -5.094
  521    HN1  RCY  68           HN1      RCY  68  68.015   1.392  -5.746
  522    HA   PRO  69           HA       PRO  69  72.758   3.632  -7.631
  523    HB2  PRO  69           HB2      PRO  69  74.251   3.630  -5.021
  524    HB3  PRO  69           HB1      PRO  69  74.608   4.517  -6.518
  525    HG2  PRO  69           HG2      PRO  69  73.394   5.682  -4.439
  526    HG3  PRO  69           HG1      PRO  69  73.000   6.105  -6.113
  527    HD2  PRO  69           HD2      PRO  69  71.360   4.653  -4.133
  528    HD3  PRO  69           HD1      PRO  69  70.857   5.461  -5.633
  529    H    TRP  70           HN       TRP  70  72.654   1.495  -4.761
  530    HA   TRP  70           HA       TRP  70  74.603  -0.372  -5.687
  531    HD1  TRP  70           HD1      TRP  70  75.282  -2.421  -5.468
  532    HE1  TRP  70           HE1      TRP  70  75.211  -4.958  -5.023
  533    HE3  TRP  70           HE3      TRP  70  71.224  -2.660  -2.378
  534    HZ2  TRP  70           HZ2      TRP  70  73.638  -6.844  -3.548
  535    HZ3  TRP  70           HZ3      TRP  70  70.463  -4.833  -1.469
  536    HH2  TRP  70           HH2      TRP  70  71.661  -6.923  -2.047
  537    HB2  TRP  70           HB2      TRP  70  73.805  -0.454  -3.382
  538    HB3  TRP  70           HB1      TRP  70  72.171  -0.815  -3.932
  539    H    GLU  71           HN       GLU  71  71.742   0.498  -7.112
  540    HA   GLU  71           HA       GLU  71  71.162  -2.198  -8.221
  541    HB2  GLU  71           HB2      GLU  71  69.716   0.455  -8.276
  542    HB3  GLU  71           HB1      GLU  71  69.252  -0.868  -9.347
  543    HG2  GLU  71           HG2      GLU  71  69.531  -1.257  -6.363
  544    HG3  GLU  71           HG1      GLU  71  68.018  -0.722  -7.096
  545    H    ALA  72           HN       ALA  72  72.222   1.043  -9.212
  546    HA   ALA  72           HA       ALA  72  72.359   0.331 -12.034
  547    HB1  ALA  72           HB1      ALA  72  72.031   2.675 -11.202
  548    HB2  ALA  72           HB2      ALA  72  73.376   2.515 -12.332
  549    HB3  ALA  72           HB3      ALA  72  73.689   2.647 -10.601
  550    H1U  RCY  73           H1U      RCY  73  75.421   2.714  -3.210
  551    H1S  RCY  73           H1S      RCY  73  76.096   1.337  -6.937
  552    HB1  RCY  73           HB1      RCY  73  77.038   1.162  -8.768
  553    HB2  RCY  73           HB2      RCY  73  78.249  -0.095  -9.021
  554    HA   RCY  73           HA       RCY  73  76.995   0.024 -11.053
  555    HN1  RCY  73           HN1      RCY  73  74.709   0.603  -9.371
  556    H    ASN  74           HN       ASN  74  75.108  -1.866 -11.730
  557    HA   ASN  74           HA       ASN  74  75.310  -4.322 -10.248
  558    HB2  ASN  74           HB2      ASN  74  73.525  -3.839 -11.928
  559    HB3  ASN  74           HB1      ASN  74  74.737  -3.954 -13.205
  560   HD21  ASN  74          HD21      ASN  74  75.759  -6.133 -10.933
  561   HD22  ASN  74          HD22      ASN  74  74.982  -7.531 -11.503
  562    H    HIS  75           HN       HIS  75  77.776  -4.007  -9.971
  563    HA   HIS  75           HA       HIS  75  79.115  -5.866 -11.782
  564    HD1  HIS  75           HD1      HIS  75  78.708  -1.976 -13.791
  565    HD2  HIS  75           HD2      HIS  75  79.525  -6.038 -14.271
  566    HE1  HIS  75           HE1      HIS  75  77.837  -2.615 -16.082
  567    HE2  HIS  75           HE2      HIS  75  78.328  -5.086 -16.387
  568    HB2  HIS  75           HB2      HIS  75  79.803  -2.922 -11.771
  569    HB3  HIS  75           HB1      HIS  75  80.987  -4.147 -12.229
  570    H1U  RCY  76           H1U      RCY  76  76.013  -3.704  -1.122
  571    H1S  RCY  76           H1S      RCY  76  77.825  -4.484  -5.114
  572    HB1  RCY  76           HB1      RCY  76  78.814  -3.924  -6.725
  573    HB2  RCY  76           HB2      RCY  76  80.467  -3.315  -6.678
  574    HA   RCY  76           HA       RCY  76  81.326  -5.155  -7.788
  575    HN1  RCY  76           HN1      RCY  76  78.544  -4.829  -8.806
  576    H    GLU  77           HN       GLU  77  78.459  -6.908  -8.283
  577    HA   GLU  77           HA       GLU  77  78.506  -8.642  -6.000
  578    HB2  GLU  77           HB2      GLU  77  77.511  -9.147  -8.821
  579    HB3  GLU  77           HB1      GLU  77  77.170 -10.180  -7.432
  580    HG2  GLU  77           HG2      GLU  77  76.282  -8.013  -6.310
  581    HG3  GLU  77           HG1      GLU  77  76.242  -7.359  -7.948
  582    H    LEU  78           HN       LEU  78  80.675  -9.290  -5.633
  583    HA   LEU  78           HA       LEU  78  82.508 -10.733  -5.845
  584    HG   LEU  78           HG       LEU  78  82.061 -14.129  -6.979
  585    HB2  LEU  78           HB2      LEU  78  80.445 -12.275  -6.439
  586    HB3  LEU  78           HB1      LEU  78  81.102 -12.187  -8.071
  587   HD11  LEU  78          HD11      LEU  78  83.524 -12.544  -8.376
  588   HD12  LEU  78          HD12      LEU  78  84.371 -13.670  -7.316
  589   HD13  LEU  78          HD13      LEU  78  84.185 -11.983  -6.839
  590   HD21  LEU  78          HD21      LEU  78  83.404 -12.484  -4.883
  591   HD22  LEU  78          HD22      LEU  78  82.856 -14.159  -4.814
  592   HD23  LEU  78          HD23      LEU  78  81.693 -12.843  -4.650
  593    H    HIS  79           HN       HIS  79  84.072  -9.387  -6.727
  594    HA   HIS  79           HA       HIS  79  84.865  -9.839  -9.456
  595    HD1  HIS  79           HD1      HIS  79  86.490  -8.306 -10.529
  596    HD2  HIS  79           HD2      HIS  79  82.877  -7.106 -12.234
  597    HE1  HIS  79           HE1      HIS  79  86.960  -7.892 -12.983
  598    HE2  HIS  79           HE2      HIS  79  84.769  -7.161 -14.033
  599    HB2  HIS  79           HB2      HIS  79  82.853  -8.181  -9.594
  600    HB3  HIS  79           HB1      HIS  79  83.997  -6.990  -8.977
  601    H    GLU  80           HN       GLU  80  86.025  -7.027  -9.565
  602    HA   GLU  80           HA       GLU  80  88.477  -7.632  -8.146
  603    HB2  GLU  80           HB2      GLU  80  87.477  -5.206  -9.646
  604    HB3  GLU  80           HB1      GLU  80  89.043  -5.218  -8.834
  605    HG2  GLU  80           HG2      GLU  80  89.625  -7.292 -10.132
  606    HG3  GLU  80           HG1      GLU  80  88.124  -7.089 -11.035
  607    H    LEU  81           HN       LEU  81  85.794  -5.350  -7.601
  608    HA   LEU  81           HA       LEU  81  86.897  -4.015  -5.348
  609    HG   LEU  81           HG       LEU  81  84.878  -3.758  -7.816
  610    HB2  LEU  81           HB2      LEU  81  83.971  -4.701  -5.738
  611    HB3  LEU  81           HB1      LEU  81  84.637  -3.350  -4.820
  612   HD11  LEU  81          HD11      LEU  81  82.663  -3.011  -7.289
  613   HD12  LEU  81          HD12      LEU  81  83.556  -1.578  -7.800
  614   HD13  LEU  81          HD13      LEU  81  83.264  -1.871  -6.085
  615   HD21  LEU  81          HD21      LEU  81  86.863  -2.655  -7.181
  616   HD22  LEU  81          HD22      LEU  81  86.060  -1.762  -5.889
  617   HD23  LEU  81          HD23      LEU  81  85.773  -1.325  -7.574
  618    H    ALA  82           HN       ALA  82  84.952  -6.997  -5.546
  619    HA   ALA  82           HA       ALA  82  84.708  -7.513  -2.768
  620    HB1  ALA  82           HB1      ALA  82  84.997  -9.398  -5.127
  621    HB2  ALA  82           HB2      ALA  82  83.505  -8.898  -4.332
  622    HB3  ALA  82           HB3      ALA  82  84.642  -9.949  -3.490
  623    H    GLN  83           HN       GLN  83  86.577 -10.051  -4.080
  624    HA   GLN  83           HA       GLN  83  88.598 -10.950  -3.252
  625    HB2  GLN  83           HB2      GLN  83  89.259  -9.175  -4.986
  626    HB3  GLN  83           HB1      GLN  83  89.619  -8.123  -3.618
  627    HG2  GLN  83           HG2      GLN  83  91.687  -9.170  -4.116
  628    HG3  GLN  83           HG1      GLN  83  91.062 -10.063  -2.729
  629   HE21  GLN  83          HE21      GLN  83  91.764 -10.271  -6.177
  630   HE22  GLN  83          HE22      GLN  83  91.443 -11.931  -6.330
  631    H    TYR  84           HN       TYR  84  89.313  -7.711  -2.011
  632    HA   TYR  84           HA       TYR  84  89.975  -8.636   0.599
  633    HD1  TYR  84           HD1      TYR  84  90.077  -6.135  -2.427
  634    HD2  TYR  84           HD2      TYR  84  92.202  -6.500   1.288
  635    HE1  TYR  84           HE1      TYR  84  92.225  -5.818  -3.625
  636    HE2  TYR  84           HE2      TYR  84  94.350  -6.183   0.090
  637    HH   TYR  84           HH       TYR  84  94.745  -4.862  -2.655
  638    HB2  TYR  84           HB2      TYR  84  88.939  -5.893  -0.198
  639    HB3  TYR  84           HB1      TYR  84  89.821  -6.278   1.279
  640    H    GLY  85           HN       GLY  85  86.956  -7.847  -0.947
  641    HA2  GLY  85           HA2      GLY  85  85.282  -7.424   1.293
  642    HA3  GLY  85           HA1      GLY  85  84.743  -8.142  -0.228
  643    H    ILE  86           HN       ILE  86  85.003  -8.744   2.995
  644    HA   ILE  86           HA       ILE  86  84.986 -11.700   2.537
  645    HB   ILE  86           HB       ILE  86  86.455 -10.131   4.673
  646   HG12  ILE  86          HG12      ILE  86  87.450 -12.366   2.896
  647   HG13  ILE  86          HG11      ILE  86  87.482 -10.680   2.376
  648   HG21  ILE  86          HG21      ILE  86  85.543 -11.846   5.969
  649   HG22  ILE  86          HG22      ILE  86  87.039 -12.590   5.405
  650   HG23  ILE  86          HG23      ILE  86  85.509 -12.982   4.621
  651   HD11  ILE  86          HD11      ILE  86  88.761 -10.133   4.474
  652   HD12  ILE  86          HD12      ILE  86  89.631 -11.195   3.366
  653   HD13  ILE  86          HD13      ILE  86  88.858 -11.863   4.804
  654    H1U  RCY  87           H1U      RCY  87  75.806  -4.745   2.458
  655    H1S  RCY  87           H1S      RCY  87  77.530  -7.315   5.158
  656    HB1  RCY  87           HB1      RCY  87  80.829  -8.611   3.279
  657    HB2  RCY  87           HB2      RCY  87  81.256  -7.757   4.760
  658    HA   RCY  87           HA       RCY  87  81.951  -9.753   5.840
  659    HN1  RCY  87           HN1      RCY  87  83.137  -9.180   3.346
  Start of MODEL    5
    1    HA   MET   1           HA       MET   1  61.372  10.009  17.443
    2    HB2  MET   1           HB2      MET   1  62.157   9.823  19.828
    3    HB3  MET   1           HB1      MET   1  63.486   8.814  19.261
    4    HG2  MET   1           HG2      MET   1  63.058  11.447  17.911
    5    HG3  MET   1           HG1      MET   1  63.775  11.452  19.522
    6    HE1  MET   1           HE1      MET   1  66.972  11.951  17.559
    7    HE2  MET   1           HE2      MET   1  66.120  12.276  19.066
    8    HE3  MET   1           HE3      MET   1  65.387  12.733  17.531
    9    H    ASN   2           HN       ASN   2  63.324  10.557  16.131
   10    HA   ASN   2           HA       ASN   2  64.944  10.069  14.498
   11    HB2  ASN   2           HB2      ASN   2  65.523   8.238  16.368
   12    HB3  ASN   2           HB1      ASN   2  64.915   7.143  15.128
   13   HD21  ASN   2          HD21      ASN   2  67.553   9.297  15.979
   14   HD22  ASN   2          HD22      ASN   2  68.514   8.968  14.619
   15    H    LEU   3           HN       LEU   3  62.462   7.522  14.857
   16    HA   LEU   3           HA       LEU   3  62.385   7.000  11.994
   17    HG   LEU   3           HG       LEU   3  61.538   3.973  13.826
   18    HB2  LEU   3           HB2      LEU   3  60.682   6.172  14.344
   19    HB3  LEU   3           HB1      LEU   3  60.194   5.791  12.694
   20   HD11  LEU   3          HD11      LEU   3  63.185   4.978  11.544
   21   HD12  LEU   3          HD12      LEU   3  61.474   4.668  11.248
   22   HD13  LEU   3          HD13      LEU   3  62.519   3.369  11.823
   23   HD21  LEU   3          HD21      LEU   3  63.859   4.304  14.265
   24   HD22  LEU   3          HD22      LEU   3  63.051   5.704  14.969
   25   HD23  LEU   3          HD23      LEU   3  63.875   5.850  13.416
   26    H    GLU   4           HN       GLU   4  61.067   7.955  10.484
   27    HA   GLU   4           HA       GLU   4  59.472  10.283  11.374
   28    HB2  GLU   4           HB2      GLU   4  60.485   9.286   8.714
   29    HB3  GLU   4           HB1      GLU   4  59.221  10.513   8.783
   30    HG2  GLU   4           HG2      GLU   4  61.521  11.489   8.643
   31    HG3  GLU   4           HG1      GLU   4  60.650  11.982  10.096
   32    HA   PRO   5           HA       PRO   5  55.398   8.597  11.306
   33    HB2  PRO   5           HB2      PRO   5  54.950  10.405   8.947
   34    HB3  PRO   5           HB1      PRO   5  53.932  10.158  10.379
   35    HG2  PRO   5           HG2      PRO   5  55.551  12.283  10.115
   36    HG3  PRO   5           HG1      PRO   5  55.196  11.544  11.684
   37    HD2  PRO   5           HD2      PRO   5  57.722  11.543  10.171
   38    HD3  PRO   5           HD1      PRO   5  57.439  11.159  11.883
   39    HA   PRO   6           HA       PRO   6  55.453   5.468   8.156
   40    HB2  PRO   6           HB2      PRO   6  52.804   4.763   8.054
   41    HB3  PRO   6           HB1      PRO   6  53.883   4.311   9.388
   42    HG2  PRO   6           HG2      PRO   6  51.875   6.502   9.247
   43    HG3  PRO   6           HG1      PRO   6  52.275   5.420  10.592
   44    HD2  PRO   6           HD2      PRO   6  53.185   7.998  10.442
   45    HD3  PRO   6           HD1      PRO   6  54.082   6.703  11.265
   46    H    LYS   7           HN       LYS   7  54.733   4.989   5.942
   47    HA   LYS   7           HA       LYS   7  52.991   6.917   4.584
   48    HB2  LYS   7           HB2      LYS   7  54.843   7.492   2.920
   49    HB3  LYS   7           HB1      LYS   7  54.979   8.240   4.510
   50    HG2  LYS   7           HG2      LYS   7  56.608   6.598   5.217
   51    HG3  LYS   7           HG1      LYS   7  56.371   5.660   3.742
   52    HD2  LYS   7           HD2      LYS   7  58.315   6.878   3.255
   53    HD3  LYS   7           HD1      LYS   7  57.053   7.871   2.525
   54    HE2  LYS   7           HE2      LYS   7  58.636   9.234   3.868
   55    HE3  LYS   7           HE1      LYS   7  56.996   9.304   4.515
   56    HZ1  LYS   7           HZ1      LYS   7  59.340   8.426   5.787
   57    HZ2  LYS   7           HZ2      LYS   7  58.270   7.111   5.669
   58    HZ3  LYS   7           HZ3      LYS   7  57.773   8.548   6.427
   59    H    ALA   8           HN       ALA   8  55.052   5.918   2.255
   60    HA   ALA   8           HA       ALA   8  53.394   3.505   1.681
   61    HB1  ALA   8           HB1      ALA   8  53.368   5.197  -0.073
   62    HB2  ALA   8           HB2      ALA   8  54.260   3.789  -0.649
   63    HB3  ALA   8           HB3      ALA   8  55.131   5.227  -0.114
   64    H    GLU   9           HN       GLU   9  54.379   1.666   2.392
   65    HA   GLU   9           HA       GLU   9  57.299   1.500   2.600
   66    HB2  GLU   9           HB2      GLU   9  55.040  -0.427   3.172
   67    HB3  GLU   9           HB1      GLU   9  56.734  -0.910   3.280
   68    HG2  GLU   9           HG2      GLU   9  55.827  -0.171   5.477
   69    HG3  GLU   9           HG1      GLU   9  57.161   0.845   4.930
   70    H1U  RCY  10           H1U      RCY  10  63.826  -0.860  -2.917
   71    H1S  RCY  10           H1S      RCY  10  60.446   1.866  -2.935
   72    HB1  RCY  10           HB1      RCY  10  58.123  -0.126  -2.787
   73    HB2  RCY  10           HB2      RCY  10  58.494  -0.391  -1.083
   74    HA   RCY  10           HA       RCY  10  55.930   0.766  -2.217
   75    HN1  RCY  10           HN1      RCY  10  55.752   1.694  -0.067
   76    H    ARG  11           HN       ARG  11  54.285  -0.716  -0.532
   77    HA   ARG  11           HA       ARG  11  53.337  -2.847  -0.287
   78    HE   ARG  11           HE       ARG  11  51.921  -3.415  -3.892
   79    HB2  ARG  11           HB2      ARG  11  53.365  -2.670  -2.779
   80    HB3  ARG  11           HB1      ARG  11  54.950  -3.444  -2.785
   81    HG2  ARG  11           HG2      ARG  11  54.004  -5.433  -1.699
   82    HG3  ARG  11           HG1      ARG  11  52.419  -4.661  -1.640
   83    HD2  ARG  11           HD2      ARG  11  53.964  -5.247  -4.183
   84    HD3  ARG  11           HD1      ARG  11  52.631  -6.223  -3.567
   85   HH11  ARG  11          HH21      ARG  11  52.284  -6.502  -5.384
   86   HH12  ARG  11          HH22      ARG  11  51.133  -6.180  -6.638
   87   HH21  ARG  11          HH11      ARG  11  50.416  -2.976  -5.521
   88   HH22  ARG  11          HH12      ARG  11  50.075  -4.184  -6.715
   89    H    SER  12           HN       SER  12  56.339  -3.996  -1.792
   90    HA   SER  12           HA       SER  12  56.843  -6.123  -0.097
   91    HG   SER  12           HG       SER  12  59.800  -3.799  -1.364
   92    HB2  SER  12           HB2      SER  12  59.320  -5.663  -0.576
   93    HB3  SER  12           HB1      SER  12  58.274  -5.846  -1.980
   94    H    ALA  13           HN       ALA  13  58.434  -6.334   1.711
   95    HA   ALA  13           HA       ALA  13  59.118  -5.750   3.877
   96    HB1  ALA  13           HB1      ALA  13  60.252  -3.681   4.105
   97    HB2  ALA  13           HB2      ALA  13  59.243  -2.898   2.890
   98    HB3  ALA  13           HB3      ALA  13  60.442  -4.095   2.401
   99    H    THR  14           HN       THR  14  57.270  -6.064   5.114
  100    HA   THR  14           HA       THR  14  54.907  -4.502   5.034
  101    HB   THR  14           HB       THR  14  56.000  -5.793   7.544
  102    HG1  THR  14           HG1      THR  14  54.451  -7.126   5.614
  103   HG21  THR  14          HG21      THR  14  53.846  -4.408   7.518
  104   HG22  THR  14          HG22      THR  14  53.709  -6.055   8.135
  105   HG23  THR  14          HG23      THR  14  53.167  -5.678   6.499
  106    H    ARG  15           HN       ARG  15  57.852  -4.120   6.995
  107    HA   ARG  15           HA       ARG  15  57.322  -1.255   7.248
  108    HE   ARG  15           HE       ARG  15  57.165  -2.601  11.595
  109    HB2  ARG  15           HB2      ARG  15  55.954  -2.395   9.087
  110    HB3  ARG  15           HB1      ARG  15  57.495  -2.868   9.803
  111    HG2  ARG  15           HG2      ARG  15  58.170  -0.566  10.055
  112    HG3  ARG  15           HG1      ARG  15  56.782  -0.004   9.123
  113    HD2  ARG  15           HD2      ARG  15  56.527   0.208  11.637
  114    HD3  ARG  15           HD1      ARG  15  55.245  -0.701  10.837
  115   HH11  ARG  15          HH21      ARG  15  55.168  -0.199  13.052
  116   HH12  ARG  15          HH22      ARG  15  55.009  -1.051  14.552
  117   HH21  ARG  15          HH11      ARG  15  56.969  -3.728  13.544
  118   HH22  ARG  15          HH12      ARG  15  56.028  -3.049  14.830
  119    H    VAL  16           HN       VAL  16  59.351  -3.912   7.139
  120    HA   VAL  16           HA       VAL  16  61.708  -2.180   7.633
  121    HB   VAL  16           HB       VAL  16  61.502  -4.937   8.869
  122   HG11  VAL  16          HG11      VAL  16  63.768  -3.995   8.340
  123   HG12  VAL  16          HG12      VAL  16  63.504  -4.252  10.065
  124   HG13  VAL  16          HG13      VAL  16  63.396  -2.627   9.389
  125   HG21  VAL  16          HG21      VAL  16  61.277  -3.669  11.037
  126   HG22  VAL  16          HG22      VAL  16  59.865  -3.541   9.988
  127   HG23  VAL  16          HG23      VAL  16  61.011  -2.205  10.091
  128    H    MET  17           HN       MET  17  61.424  -5.712   7.266
  129    HA   MET  17           HA       MET  17  61.975  -5.721   4.437
  130    HB2  MET  17           HB2      MET  17  64.183  -4.909   5.424
  131    HB3  MET  17           HB1      MET  17  64.328  -6.498   6.176
  132    HG2  MET  17           HG2      MET  17  65.516  -6.648   4.108
  133    HG3  MET  17           HG1      MET  17  63.986  -7.485   3.846
  134    HE1  MET  17           HE1      MET  17  66.382  -5.513   2.097
  135    HE2  MET  17           HE2      MET  17  66.098  -4.357   3.395
  136    HE3  MET  17           HE3      MET  17  65.700  -3.923   1.735
  137    H    GLY  18           HN       GLY  18  61.531  -7.761   3.648
  138    HA2  GLY  18           HA2      GLY  18  62.079 -10.261   4.579
  139    HA3  GLY  18           HA1      GLY  18  60.715  -9.802   5.599
  140    H    GLY  19           HN       GLY  19  59.898 -11.811   4.298
  141    HA2  GLY  19           HA2      GLY  19  58.091 -12.407   2.880
  142    HA3  GLY  19           HA1      GLY  19  58.117 -10.776   2.209
  143    HA   PRO  20           HA       PRO  20  59.784 -14.082  -0.825
  144    HB2  PRO  20           HB2      PRO  20  58.214 -12.181  -2.531
  145    HB3  PRO  20           HB1      PRO  20  58.353 -13.947  -2.647
  146    HG2  PRO  20           HG2      PRO  20  56.189 -12.785  -1.617
  147    HG3  PRO  20           HG1      PRO  20  56.819 -14.311  -0.975
  148    HD2  PRO  20           HD2      PRO  20  56.921 -11.588   0.223
  149    HD3  PRO  20           HD1      PRO  20  56.932 -13.175   1.022
  150    H1U  RCY  21           H1U      RCY  21  62.693  -6.361  -2.059
  151    H1S  RCY  21           H1S      RCY  21  63.487 -10.305  -0.747
  152    HB1  RCY  21           HB1      RCY  21  64.526 -13.238  -2.316
  153    HB2  RCY  21           HB2      RCY  21  64.033 -12.935  -0.650
  154    HA   RCY  21           HA       RCY  21  62.772 -10.874  -1.743
  155    HN1  RCY  21           HN1      RCY  21  61.873 -13.650  -1.393
  156    H    THR  22           HN       THR  22  62.548  -9.902  -3.693
  157    HA   THR  22           HA       THR  22  62.946 -11.558  -6.157
  158    HB   THR  22           HB       THR  22  60.981  -9.270  -5.900
  159    HG1  THR  22           HG1      THR  22  60.679 -12.062  -5.609
  160   HG21  THR  22          HG21      THR  22  60.096 -10.311  -8.008
  161   HG22  THR  22          HG22      THR  22  61.486 -11.397  -7.998
  162   HG23  THR  22          HG23      THR  22  61.726  -9.658  -8.171
  163    HA   PRO  23           HA       PRO  23  66.185  -8.288  -6.217
  164    HB2  PRO  23           HB2      PRO  23  66.777  -9.833  -8.712
  165    HB3  PRO  23           HB1      PRO  23  67.884  -9.271  -7.444
  166    HG2  PRO  23           HG2      PRO  23  67.145 -11.823  -7.612
  167    HG3  PRO  23           HG1      PRO  23  67.383 -11.029  -6.046
  168    HD2  PRO  23           HD2      PRO  23  64.832 -11.797  -7.397
  169    HD3  PRO  23           HD1      PRO  23  65.206 -11.697  -5.662
  170    H    ARG  24           HN       ARG  24  66.957  -6.948  -8.306
  171    HA   ARG  24           HA       ARG  24  64.948  -6.598 -10.380
  172    HE   ARG  24           HE       ARG  24  63.470  -2.851  -7.368
  173    HB2  ARG  24           HB2      ARG  24  63.979  -5.472  -8.278
  174    HB3  ARG  24           HB1      ARG  24  65.267  -4.282  -8.465
  175    HG2  ARG  24           HG2      ARG  24  64.487  -3.716 -10.700
  176    HG3  ARG  24           HG1      ARG  24  63.272  -4.993 -10.634
  177    HD2  ARG  24           HD2      ARG  24  62.463  -2.612 -10.110
  178    HD3  ARG  24           HD1      ARG  24  62.025  -3.867  -8.951
  179   HH11  ARG  24          HH21      ARG  24  63.900  -1.623 -10.561
  180   HH12  ARG  24          HH22      ARG  24  64.924  -0.317 -10.064
  181   HH21  ARG  24          HH11      ARG  24  64.804  -1.152  -6.701
  182   HH22  ARG  24          HH12      ARG  24  65.436  -0.051  -7.879
  183    H    LYS  25           HN       LYS  25  67.344  -7.090 -11.114
  184    HA   LYS  25           HA       LYS  25  69.435  -5.252 -11.007
  185    HB2  LYS  25           HB2      LYS  25  70.047  -6.059 -13.309
  186    HB3  LYS  25           HB1      LYS  25  69.718  -7.360 -12.165
  187    HG2  LYS  25           HG2      LYS  25  67.317  -6.428 -13.577
  188    HG3  LYS  25           HG1      LYS  25  68.541  -7.102 -14.654
  189    HD2  LYS  25           HD2      LYS  25  68.667  -9.119 -13.197
  190    HD3  LYS  25           HD1      LYS  25  67.367  -8.455 -12.207
  191    HE2  LYS  25           HE2      LYS  25  67.249  -9.369 -15.081
  192    HE3  LYS  25           HE1      LYS  25  66.263  -9.905 -13.720
  193    HZ1  LYS  25           HZ1      LYS  25  65.222  -7.756 -13.629
  194    HZ2  LYS  25           HZ2      LYS  25  65.082  -8.374 -15.206
  195    HZ3  LYS  25           HZ3      LYS  25  66.225  -7.165 -14.863
  196    H    GLY  26           HN       GLY  26  70.122  -3.768 -12.910
  197    HA2  GLY  26           HA2      GLY  26  68.572  -2.566 -14.802
  198    HA3  GLY  26           HA1      GLY  26  67.951  -1.832 -13.323
  199    HA   PRO  27           HA       PRO  27  71.861   0.306 -15.295
  200    HB2  PRO  27           HB2      PRO  27  69.893   2.528 -14.874
  201    HB3  PRO  27           HB1      PRO  27  71.091   2.315 -16.166
  202    HG2  PRO  27           HG2      PRO  27  68.499   1.806 -16.553
  203    HG3  PRO  27           HG1      PRO  27  69.769   0.853 -17.336
  204    HD2  PRO  27           HD2      PRO  27  67.939   0.076 -15.135
  205    HD3  PRO  27           HD1      PRO  27  68.805  -0.951 -16.298
  206    HA   PRO  28           HA       PRO  28  73.046   0.882 -10.957
  207    HB2  PRO  28           HB2      PRO  28  75.058   2.658 -12.296
  208    HB3  PRO  28           HB1      PRO  28  75.303   1.422 -11.046
  209    HG2  PRO  28           HG2      PRO  28  75.906   0.965 -13.604
  210    HG3  PRO  28           HG1      PRO  28  75.256  -0.307 -12.558
  211    HD2  PRO  28           HD2      PRO  28  73.928   1.147 -14.786
  212    HD3  PRO  28           HD1      PRO  28  73.586  -0.469 -14.130
  213    H    LYS  29           HN       LYS  29  73.309   2.781  -9.469
  214    HA   LYS  29           HA       LYS  29  71.858   5.195 -10.500
  215    HB2  LYS  29           HB2      LYS  29  71.704   3.737  -7.863
  216    HB3  LYS  29           HB1      LYS  29  71.217   5.426  -7.993
  217    HG2  LYS  29           HG2      LYS  29  70.117   3.737 -10.131
  218    HG3  LYS  29           HG1      LYS  29  69.581   3.260  -8.519
  219    HD2  LYS  29           HD2      LYS  29  68.027   4.914  -9.361
  220    HD3  LYS  29           HD1      LYS  29  68.984   5.667  -8.085
  221    HE2  LYS  29           HE2      LYS  29  70.368   6.809  -9.672
  222    HE3  LYS  29           HE1      LYS  29  69.720   5.864 -11.013
  223    HZ1  LYS  29           HZ1      LYS  29  68.088   7.319 -11.244
  224    HZ2  LYS  29           HZ2      LYS  29  68.772   8.279 -10.020
  225    HZ3  LYS  29           HZ3      LYS  29  67.605   7.106  -9.632
  226    H1U  RCY  30           H1U      RCY  30  78.786   4.207  -9.225
  227    H1S  RCY  30           H1S      RCY  30  77.810   7.820  -7.746
  228    HB1  RCY  30           HB1      RCY  30  75.195   6.258  -7.085
  229    HB2  RCY  30           HB2      RCY  30  73.946   7.276  -6.371
  230    HA   RCY  30           HA       RCY  30  73.999   8.721  -8.393
  231    HN1  RCY  30           HN1      RCY  30  72.360   7.170  -9.044
  232    H    LYS  31           HN       LYS  31  74.529   6.497 -10.677
  233    HA   LYS  31           HA       LYS  31  76.253   6.076 -12.215
  234    HB2  LYS  31           HB2      LYS  31  75.818   8.737 -12.138
  235    HB3  LYS  31           HB1      LYS  31  77.497   8.722 -11.602
  236    HG2  LYS  31           HG2      LYS  31  77.796   8.801 -13.904
  237    HG3  LYS  31           HG1      LYS  31  77.794   7.056 -13.644
  238    HD2  LYS  31           HD2      LYS  31  75.385   6.976 -14.178
  239    HD3  LYS  31           HD1      LYS  31  75.387   8.720 -14.445
  240    HE2  LYS  31           HE2      LYS  31  76.923   6.637 -16.023
  241    HE3  LYS  31           HE1      LYS  31  75.587   7.634 -16.601
  242    HZ1  LYS  31           HZ1      LYS  31  77.610   8.609 -17.339
  243    HZ2  LYS  31           HZ2      LYS  31  78.287   8.551 -15.782
  244    HZ3  LYS  31           HZ3      LYS  31  76.992   9.602 -16.110
  245    H    GLN  32           HN       GLN  32  78.844   6.397 -12.408
  246    HA   GLN  32           HA       GLN  32  79.920   5.031 -10.066
  247    HB2  GLN  32           HB2      GLN  32  80.612   5.308 -12.827
  248    HB3  GLN  32           HB1      GLN  32  81.995   5.857 -11.886
  249    HG2  GLN  32           HG2      GLN  32  80.548   3.239 -11.395
  250    HG3  GLN  32           HG1      GLN  32  82.020   3.389 -12.356
  251   HE21  GLN  32          HE21      GLN  32  83.992   3.391 -11.224
  252   HE22  GLN  32          HE22      GLN  32  84.125   3.501  -9.536
  253    H    ARG  33           HN       ARG  33  82.596   6.290 -10.277
  254    HA   ARG  33           HA       ARG  33  83.774   8.179  -9.496
  255    HE   ARG  33           HE       ARG  33  82.516  10.876 -12.227
  256    HB2  ARG  33           HB2      ARG  33  81.631   9.369 -10.657
  257    HB3  ARG  33           HB1      ARG  33  81.315   9.785  -8.974
  258    HG2  ARG  33           HG2      ARG  33  83.527  10.783  -8.757
  259    HG3  ARG  33           HG1      ARG  33  83.953  10.268 -10.390
  260    HD2  ARG  33           HD2      ARG  33  81.553  12.025  -9.884
  261    HD3  ARG  33           HD1      ARG  33  83.165  12.713 -10.078
  262   HH11  ARG  33          HH21      ARG  33  82.083  14.050 -10.953
  263   HH12  ARG  33          HH22      ARG  33  81.800  14.776 -12.500
  264   HH21  ARG  33          HH11      ARG  33  82.149  11.806 -14.254
  265   HH22  ARG  33          HH12      ARG  33  81.837  13.505 -14.369
  266    H    GLN  34           HN       GLN  34  83.191   9.860  -7.372
  267    HA   GLN  34           HA       GLN  34  83.186   9.800  -5.025
  268    HB2  GLN  34           HB2      GLN  34  80.793   8.126  -5.786
  269    HB3  GLN  34           HB1      GLN  34  81.217   8.383  -4.094
  270    HG2  GLN  34           HG2      GLN  34  81.174  10.845  -4.494
  271    HG3  GLN  34           HG1      GLN  34  80.639  10.540  -6.147
  272   HE21  GLN  34          HE21      GLN  34  79.448  11.300  -3.126
  273   HE22  GLN  34          HE22      GLN  34  77.883  10.662  -3.277
  274    H    THR  35           HN       THR  35  84.664   7.651  -6.632
  275    HA   THR  35           HA       THR  35  84.602   5.317  -4.854
  276    HB   THR  35           HB       THR  35  86.701   5.916  -6.945
  277    HG1  THR  35           HG1      THR  35  85.271   5.597  -8.437
  278   HG21  THR  35          HG21      THR  35  85.455   3.281  -6.158
  279   HG22  THR  35          HG22      THR  35  86.845   3.949  -5.302
  280   HG23  THR  35          HG23      THR  35  86.970   3.557  -7.017
  281    H    ARG  36           HN       ARG  36  85.685   5.295  -2.948
  282    HA   ARG  36           HA       ARG  36  87.847   7.278  -2.501
  283    HE   ARG  36           HE       ARG  36  87.725   9.903   1.625
  284    HB2  ARG  36           HB2      ARG  36  85.845   6.715  -0.876
  285    HB3  ARG  36           HB1      ARG  36  86.865   5.358  -0.404
  286    HG2  ARG  36           HG2      ARG  36  87.624   6.970   1.081
  287    HG3  ARG  36           HG1      ARG  36  88.733   7.241  -0.264
  288    HD2  ARG  36           HD2      ARG  36  87.237   9.018  -1.126
  289    HD3  ARG  36           HD1      ARG  36  86.162   8.766   0.249
  290   HH11  ARG  36          HH21      ARG  36  89.005   9.086  -1.470
  291   HH12  ARG  36          HH22      ARG  36  90.443  10.031  -1.273
  292   HH21  ARG  36          HH11      ARG  36  89.596  11.141   1.901
  293   HH22  ARG  36          HH12      ARG  36  90.778  11.195   0.635
  294    H    GLN  37           HN       GLN  37  88.000   4.613  -4.075
  295    HA   GLN  37           HA       GLN  37  89.581   2.907  -4.370
  296    HB2  GLN  37           HB2      GLN  37  91.277   4.683  -2.587
  297    HB3  GLN  37           HB1      GLN  37  91.865   3.425  -3.674
  298    HG2  GLN  37           HG2      GLN  37  90.237   5.792  -4.626
  299    HG3  GLN  37           HG1      GLN  37  92.000   5.791  -4.593
  300   HE21  GLN  37          HE21      GLN  37  89.184   4.121  -6.038
  301   HE22  GLN  37          HE22      GLN  37  90.038   3.490  -7.363
  302    H1U  RCY  38           H1U      RCY  38  83.400  -0.404  -1.068
  303    H1S  RCY  38           H1S      RCY  38  87.485  -0.704   0.403
  304    HB1  RCY  38           HB1      RCY  38  88.097   1.733  -0.252
  305    HB2  RCY  38           HB2      RCY  38  88.456   2.890   1.029
  306    HA   RCY  38           HA       RCY  38  90.814   2.512   0.832
  307    HN1  RCY  38           HN1      RCY  38  90.645   3.832  -1.105
  308    H    LYS  39           HN       LYS  39  92.596   1.225   0.088
  309    HA   LYS  39           HA       LYS  39  92.323  -1.086  -1.564
  310    HB2  LYS  39           HB2      LYS  39  94.434   0.279  -0.518
  311    HB3  LYS  39           HB1      LYS  39  94.436  -1.140   0.524
  312    HG2  LYS  39           HG2      LYS  39  94.463  -2.608  -1.455
  313    HG3  LYS  39           HG1      LYS  39  94.446  -1.193  -2.508
  314    HD2  LYS  39           HD2      LYS  39  96.560  -0.509  -1.053
  315    HD3  LYS  39           HD1      LYS  39  96.656  -2.250  -0.788
  316    HE2  LYS  39           HE2      LYS  39  96.665  -2.639  -3.212
  317    HE3  LYS  39           HE1      LYS  39  96.514  -0.906  -3.504
  318    HZ1  LYS  39           HZ1      LYS  39  98.645  -1.191  -1.786
  319    HZ2  LYS  39           HZ2      LYS  39  98.713  -0.817  -3.442
  320    HZ3  LYS  39           HZ3      LYS  39  98.838  -2.431  -2.927
  321    H    SER  40           HN       SER  40  93.781  -2.866   0.446
  322    HA   SER  40           HA       SER  40  91.304  -3.943   1.713
  323    HG   SER  40           HG       SER  40  93.325  -5.956  -0.573
  324    HB2  SER  40           HB2      SER  40  93.959  -5.350   1.375
  325    HB3  SER  40           HB1      SER  40  92.395  -6.075   1.737
  326    H    LYS  41           HN       LYS  41  94.336  -2.453   2.474
  327    HA   LYS  41           HA       LYS  41  95.013  -3.480   4.960
  328    HB2  LYS  41           HB2      LYS  41  95.317  -0.812   5.469
  329    HB3  LYS  41           HB1      LYS  41  96.453  -1.762   4.514
  330    HG2  LYS  41           HG2      LYS  41  95.569  -1.002   2.470
  331    HG3  LYS  41           HG1      LYS  41  94.052  -0.490   3.212
  332    HD2  LYS  41           HD2      LYS  41  96.682   0.786   3.965
  333    HD3  LYS  41           HD1      LYS  41  95.738   1.362   2.591
  334    HE2  LYS  41           HE2      LYS  41  94.318   2.454   3.953
  335    HE3  LYS  41           HE1      LYS  41  94.023   0.989   4.888
  336    HZ1  LYS  41           HZ1      LYS  41  95.814   3.194   5.425
  337    HZ2  LYS  41           HZ2      LYS  41  96.486   1.656   5.692
  338    HZ3  LYS  41           HZ3      LYS  41  95.064   2.117   6.500
  339    HA   PRO  42           HA       PRO  42  91.245  -2.749   7.273
  340    HB2  PRO  42           HB2      PRO  42  92.096  -3.605   9.710
  341    HB3  PRO  42           HB1      PRO  42  91.760  -4.724   8.373
  342    HG2  PRO  42           HG2      PRO  42  94.374  -3.696   9.355
  343    HG3  PRO  42           HG1      PRO  42  93.935  -5.320   8.799
  344    HD2  PRO  42           HD2      PRO  42  95.269  -3.479   7.235
  345    HD3  PRO  42           HD1      PRO  42  94.265  -4.790   6.578
  346    HA   PRO  43           HA       PRO  43  91.783   1.168   9.280
  347    HB2  PRO  43           HB2      PRO  43  89.798   1.115  11.166
  348    HB3  PRO  43           HB1      PRO  43  89.482   1.306   9.430
  349    HG2  PRO  43           HG2      PRO  43  89.261  -1.127  11.130
  350    HG3  PRO  43           HG1      PRO  43  88.207  -0.561   9.823
  351    HD2  PRO  43           HD2      PRO  43  90.066  -2.545   9.481
  352    HD3  PRO  43           HD1      PRO  43  89.548  -1.466   8.167
  353    H    LYS  44           HN       LYS  44  92.378   2.204  11.363
  354    HA   LYS  44           HA       LYS  44  94.003   0.388  13.013
  355    HB2  LYS  44           HB2      LYS  44  93.665   3.385  12.864
  356    HB3  LYS  44           HB1      LYS  44  94.562   2.633  14.182
  357    HG2  LYS  44           HG2      LYS  44  95.210   1.810  11.378
  358    HG3  LYS  44           HG1      LYS  44  95.798   3.372  11.948
  359    HD2  LYS  44           HD2      LYS  44  96.962   2.344  13.792
  360    HD3  LYS  44           HD1      LYS  44  96.219   0.780  13.457
  361    HE2  LYS  44           HE2      LYS  44  98.525   0.853  12.587
  362    HE3  LYS  44           HE1      LYS  44  97.363   0.706  11.269
  363    HZ1  LYS  44           HZ1      LYS  44  98.906   3.073  12.115
  364    HZ2  LYS  44           HZ2      LYS  44  97.468   3.248  11.228
  365    HZ3  LYS  44           HZ3      LYS  44  98.775   2.385  10.570
  366    H    LYS  45           HN       LYS  45  90.832   0.988  13.039
  367    HA   LYS  45           HA       LYS  45  90.492   1.592  15.899
  368    HB2  LYS  45           HB2      LYS  45  88.525   0.874  13.706
  369    HB3  LYS  45           HB1      LYS  45  88.053   1.230  15.367
  370    HG2  LYS  45           HG2      LYS  45  89.807   3.179  13.912
  371    HG3  LYS  45           HG1      LYS  45  88.079   3.156  13.558
  372    HD2  LYS  45           HD2      LYS  45  88.941   3.164  16.424
  373    HD3  LYS  45           HD1      LYS  45  89.040   4.672  15.515
  374    HE2  LYS  45           HE2      LYS  45  86.530   3.010  15.435
  375    HE3  LYS  45           HE1      LYS  45  86.822   4.123  16.771
  376    HZ1  LYS  45           HZ1      LYS  45  87.121   5.907  15.156
  377    HZ2  LYS  45           HZ2      LYS  45  85.582   5.200  15.017
  378    HZ3  LYS  45           HZ3      LYS  45  86.795   4.830  13.887
  379    H    GLY  46           HN       GLY  46  88.563  -0.900  14.360
  380    HA2  GLY  46           HA2      GLY  46  89.953  -3.197  15.297
  381    HA3  GLY  46           HA1      GLY  46  88.820  -2.699  16.554
  382    H    VAL  47           HN       VAL  47  87.734  -4.784  16.096
  383    HA   VAL  47           HA       VAL  47  86.462  -5.175  13.502
  384    HB   VAL  47           HB       VAL  47  85.144  -6.933  14.940
  385   HG11  VAL  47          HG11      VAL  47  87.209  -8.417  14.921
  386   HG12  VAL  47          HG12      VAL  47  88.124  -7.000  14.409
  387   HG13  VAL  47          HG13      VAL  47  86.835  -7.634  13.386
  388   HG21  VAL  47          HG21      VAL  47  86.088  -7.478  17.055
  389   HG22  VAL  47          HG22      VAL  47  85.924  -5.722  17.076
  390   HG23  VAL  47          HG23      VAL  47  87.499  -6.457  16.775
  391    H    GLN  48           HN       GLN  48  84.369  -5.698  16.177
  392    HA   GLN  48           HA       GLN  48  82.152  -4.373  15.168
  393    HB2  GLN  48           HB2      GLN  48  82.983  -4.691  18.066
  394    HB3  GLN  48           HB1      GLN  48  81.376  -4.172  17.554
  395    HG2  GLN  48           HG2      GLN  48  82.631  -6.735  16.559
  396    HG3  GLN  48           HG1      GLN  48  81.656  -6.674  18.028
  397   HE21  GLN  48          HE21      GLN  48  81.188  -7.795  15.125
  398   HE22  GLN  48          HE22      GLN  48  79.641  -7.212  14.743
  399    H    GLY  49           HN       GLY  49  82.686  -2.365  14.211
  400    HA2  GLY  49           HA2      GLY  49  82.233   0.001  15.470
  401    HA3  GLY  49           HA1      GLY  49  83.936  -0.264  15.846
  402    H1U  RCY  50           H1U      RCY  50  77.548   0.603   7.194
  403    H1S  RCY  50           H1S      RCY  50  80.382   1.573  10.036
  404    HB1  RCY  50           HB1      RCY  50  82.976   2.865  10.691
  405    HB2  RCY  50           HB2      RCY  50  81.973   2.500  12.095
  406    HA   RCY  50           HA       RCY  50  84.706   1.263  11.802
  407    HN1  RCY  50           HN1      RCY  50  83.490   1.939  14.396
  408    H    GLY  51           HN       GLY  51  84.492   3.804  10.643
  409    HA2  GLY  51           HA2      GLY  51  85.238   5.829  12.623
  410    HA3  GLY  51           HA1      GLY  51  86.582   5.272  11.625
  411    H    ASP  52           HN       ASP  52  86.929   6.937  10.207
  412    HA   ASP  52           HA       ASP  52  86.500   8.489   8.499
  413    HB2  ASP  52           HB2      ASP  52  85.678   6.293   7.469
  414    HB3  ASP  52           HB1      ASP  52  84.051   6.815   7.909
  415    H    ASP  53           HN       ASP  53  85.909  10.415   9.444
  416    HA   ASP  53           HA       ASP  53  84.527  12.056  10.414
  417    HB2  ASP  53           HB2      ASP  53  82.532  10.704   8.568
  418    HB3  ASP  53           HB1      ASP  53  82.345  12.309   9.276
  419    H    ILE  54           HN       ILE  54  81.603  10.298  10.038
  420    HA   ILE  54           HA       ILE  54  80.830  10.386  12.714
  421    HB   ILE  54           HB       ILE  54  80.113   8.535  10.447
  422   HG12  ILE  54          HG12      ILE  54  78.405  10.440  12.067
  423   HG13  ILE  54          HG11      ILE  54  79.318  10.955  10.648
  424   HG21  ILE  54          HG21      ILE  54  79.255   8.354  13.337
  425   HG22  ILE  54          HG22      ILE  54  79.831   7.062  12.285
  426   HG23  ILE  54          HG23      ILE  54  78.232   7.759  12.030
  427   HD11  ILE  54          HD11      ILE  54  77.395   8.623  10.569
  428   HD12  ILE  54          HD12      ILE  54  78.092   9.502   9.208
  429   HD13  ILE  54          HD13      ILE  54  76.885  10.277  10.233
  430    HA   PRO  55           HA       PRO  55  83.748   7.424  14.425
  431    HB2  PRO  55           HB2      PRO  55  82.831   7.432  16.999
  432    HB3  PRO  55           HB1      PRO  55  83.801   8.750  16.315
  433    HG2  PRO  55           HG2      PRO  55  80.860   8.599  16.735
  434    HG3  PRO  55           HG1      PRO  55  81.965   9.964  16.963
  435    HD2  PRO  55           HD2      PRO  55  80.351   9.682  14.754
  436    HD3  PRO  55           HD1      PRO  55  81.892  10.567  14.733
  437    H    GLY  56           HN       GLY  56  81.333   6.417  13.062
  438    HA2  GLY  56           HA2      GLY  56  80.435   4.237  12.846
  439    HA3  GLY  56           HA1      GLY  56  81.217   3.801  14.366
  440    H    MET  57           HN       MET  57  78.813   6.325  13.550
  441    HA   MET  57           HA       MET  57  77.296   5.620  15.972
  442    HB2  MET  57           HB2      MET  57  77.685   8.006  15.094
  443    HB3  MET  57           HB1      MET  57  76.486   7.624  13.858
  444    HG2  MET  57           HG2      MET  57  74.965   6.894  15.801
  445    HG3  MET  57           HG1      MET  57  76.111   7.723  16.854
  446    HE1  MET  57           HE1      MET  57  75.749  10.118  17.535
  447    HE2  MET  57           HE2      MET  57  75.798  11.344  16.271
  448    HE3  MET  57           HE3      MET  57  77.017  10.073  16.304
  449    H    GLU  58           HN       GLU  58  77.235   4.919  12.589
  450    HA   GLU  58           HA       GLU  58  75.732   3.677  11.284
  451    HB2  GLU  58           HB2      GLU  58  74.670   2.645  13.923
  452    HB3  GLU  58           HB1      GLU  58  74.689   1.817  12.365
  453    HG2  GLU  58           HG2      GLU  58  77.235   1.990  12.458
  454    HG3  GLU  58           HG1      GLU  58  77.045   2.474  14.143
  455    H    GLY  59           HN       GLY  59  74.913   6.285  11.727
  456    HA2  GLY  59           HA2      GLY  59  72.012   5.999  11.468
  457    HA3  GLY  59           HA1      GLY  59  72.511   6.911  12.893
  458    H1U  RCY  60           H1U      RCY  60  76.169   6.271   2.687
  459    H1S  RCY  60           H1S      RCY  60  76.573   6.099   6.765
  460    HB1  RCY  60           HB1      RCY  60  74.238   9.335   7.011
  461    HB2  RCY  60           HB2      RCY  60  73.368   7.801   6.996
  462    HA   RCY  60           HA       RCY  60  73.770   9.649   9.366
  463    HN1  RCY  60           HN1      RCY  60  72.943   6.808   9.352
  464    H    GLY  61           HN       GLY  61  70.897   7.907   9.280
  465    HA2  GLY  61           HA2      GLY  61  68.944   9.644   9.287
  466    HA3  GLY  61           HA1      GLY  61  69.494   9.969   7.642
  467    H    THR  62           HN       THR  62  68.723   7.105   9.648
  468    HA   THR  62           HA       THR  62  67.648   5.104   9.066
  469    HB   THR  62           HB       THR  62  65.602   5.484   7.560
  470    HG1  THR  62           HG1      THR  62  65.430   7.358   6.660
  471   HG21  THR  62          HG21      THR  62  64.512   6.963   9.358
  472   HG22  THR  62          HG22      THR  62  66.097   6.988  10.131
  473   HG23  THR  62          HG23      THR  62  65.249   5.458   9.907
  474    H    ASP  63           HN       ASP  63  69.660   6.601   7.011
  475    HA   ASP  63           HA       ASP  63  69.066   5.297   4.497
  476    HB2  ASP  63           HB2      ASP  63  71.517   6.639   5.645
  477    HB3  ASP  63           HB1      ASP  63  71.565   5.835   4.076
  478    H    ILE  64           HN       ILE  64  68.774   3.323   6.365
  479    HA   ILE  64           HA       ILE  64  71.004   1.502   5.664
  480    HB   ILE  64           HB       ILE  64  71.681   2.301   7.843
  481   HG12  ILE  64          HG12      ILE  64  70.284  -0.242   8.587
  482   HG13  ILE  64          HG11      ILE  64  71.453  -0.287   7.266
  483   HG21  ILE  64          HG21      ILE  64  70.124   3.119   9.246
  484   HG22  ILE  64          HG22      ILE  64  69.564   1.473   9.540
  485   HG23  ILE  64          HG23      ILE  64  68.835   2.435   8.255
  486   HD11  ILE  64          HD11      ILE  64  72.080   0.937   9.961
  487   HD12  ILE  64          HD12      ILE  64  73.213   0.523   8.674
  488   HD13  ILE  64          HD13      ILE  64  72.404  -0.754   9.583
  489    H    THR  65           HN       THR  65  68.767   0.653   8.179
  490    HA   THR  65           HA       THR  65  67.752  -1.605   6.783
  491    HB   THR  65           HB       THR  65  66.211  -0.195   8.961
  492    HG1  THR  65           HG1      THR  65  68.515  -0.316   9.416
  493   HG21  THR  65          HG21      THR  65  65.230  -2.218   7.985
  494   HG22  THR  65          HG22      THR  65  65.758  -2.539   9.636
  495   HG23  THR  65          HG23      THR  65  66.727  -3.103   8.275
  496    H    VAL  66           HN       VAL  66  65.750   1.203   7.763
  497    HA   VAL  66           HA       VAL  66  63.589   0.753   6.070
  498    HB   VAL  66           HB       VAL  66  64.736   3.517   6.523
  499   HG11  VAL  66          HG11      VAL  66  61.860   2.578   6.495
  500   HG12  VAL  66          HG12      VAL  66  62.696   3.110   5.036
  501   HG13  VAL  66          HG13      VAL  66  62.460   4.232   6.376
  502   HG21  VAL  66          HG21      VAL  66  63.233   1.689   8.415
  503   HG22  VAL  66          HG22      VAL  66  63.327   3.435   8.644
  504   HG23  VAL  66          HG23      VAL  66  64.797   2.461   8.681
  505    H    ILE  67           HN       ILE  67  66.484   2.701   5.281
  506    HA   ILE  67           HA       ILE  67  66.035   2.017   2.407
  507    HB   ILE  67           HB       ILE  67  66.687   4.754   3.543
  508   HG12  ILE  67          HG12      ILE  67  64.395   3.883   1.763
  509   HG13  ILE  67          HG11      ILE  67  64.271   3.957   3.521
  510   HG21  ILE  67          HG21      ILE  67  68.018   4.499   1.575
  511   HG22  ILE  67          HG22      ILE  67  66.583   5.391   1.069
  512   HG23  ILE  67          HG23      ILE  67  66.718   3.668   0.720
  513   HD11  ILE  67          HD11      ILE  67  64.666   6.315   3.544
  514   HD12  ILE  67          HD12      ILE  67  63.478   6.036   2.271
  515   HD13  ILE  67          HD13      ILE  67  65.169   6.316   1.854
  516    H1U  RCY  68           H1U      RCY  68  74.016   3.792   1.623
  517    H1S  RCY  68           H1S      RCY  68  72.180   1.077   4.992
  518    HB1  RCY  68           HB1      RCY  68  70.529  -1.133   2.201
  519    HB2  RCY  68           HB2      RCY  68  69.090  -1.102   3.217
  520    HA   RCY  68           HA       RCY  68  70.390   1.429   3.479
  521    HN1  RCY  68           HN1      RCY  68  67.753   0.491   2.549
  522    HA   PRO  69           HA       PRO  69  71.928   3.011  -0.359
  523    HB2  PRO  69           HB2      PRO  69  74.196   1.116   0.160
  524    HB3  PRO  69           HB1      PRO  69  74.244   2.831  -0.295
  525    HG2  PRO  69           HG2      PRO  69  74.649   1.993   2.227
  526    HG3  PRO  69           HG1      PRO  69  73.896   3.548   1.843
  527    HD2  PRO  69           HD2      PRO  69  72.669   1.138   3.015
  528    HD3  PRO  69           HD1      PRO  69  72.066   2.809   2.995
  529    H    TRP  70           HN       TRP  70  71.749  -0.450   0.241
  530    HA   TRP  70           HA       TRP  70  72.300  -1.369  -2.405
  531    HD1  TRP  70           HD1      TRP  70  72.028  -3.245  -3.695
  532    HE1  TRP  70           HE1      TRP  70  70.699  -5.191  -4.737
  533    HE3  TRP  70           HE3      TRP  70  69.003  -4.450   0.238
  534    HZ2  TRP  70           HZ2      TRP  70  68.622  -7.021  -3.999
  535    HZ3  TRP  70           HZ3      TRP  70  67.363  -6.294   0.043
  536    HH2  TRP  70           HH2      TRP  70  67.167  -7.580  -2.066
  537    HB2  TRP  70           HB2      TRP  70  72.246  -2.960  -0.593
  538    HB3  TRP  70           HB1      TRP  70  70.584  -2.528  -0.193
  539    H    GLU  71           HN       GLU  71  69.750   0.530  -1.257
  540    HA   GLU  71           HA       GLU  71  67.621  -0.469  -2.943
  541    HB2  GLU  71           HB2      GLU  71  68.104   2.113  -1.456
  542    HB3  GLU  71           HB1      GLU  71  66.719   1.937  -2.534
  543    HG2  GLU  71           HG2      GLU  71  67.326  -0.072  -0.358
  544    HG3  GLU  71           HG1      GLU  71  66.318   1.347  -0.072
  545    H    ALA  72           HN       ALA  72  69.915   2.254  -3.248
  546    HA   ALA  72           HA       ALA  72  69.002   3.038  -5.862
  547    HB1  ALA  72           HB1      ALA  72  70.482   4.338  -4.153
  548    HB2  ALA  72           HB2      ALA  72  70.821   4.530  -5.872
  549    HB3  ALA  72           HB3      ALA  72  71.823   3.461  -4.890
  550    H1U  RCY  73           H1U      RCY  73  73.604   2.552  -0.494
  551    H1S  RCY  73           H1S      RCY  73  75.793   0.978  -4.534
  552    HB1  RCY  73           HB1      RCY  73  74.507  -0.542  -6.849
  553    HB2  RCY  73           HB2      RCY  73  73.982  -0.169  -5.207
  554    HA   RCY  73           HA       RCY  73  72.492   0.561  -7.747
  555    HN1  RCY  73           HN1      RCY  73  72.152   1.542  -5.034
  556    H    ASN  74           HN       ASN  74  70.269  -0.550  -7.635
  557    HA   ASN  74           HA       ASN  74  69.690  -2.789  -6.046
  558    HB2  ASN  74           HB2      ASN  74  68.379  -3.599  -8.081
  559    HB3  ASN  74           HB1      ASN  74  67.993  -1.971  -7.521
  560   HD21  ASN  74          HD21      ASN  74  68.785  -3.736 -10.293
  561   HD22  ASN  74          HD22      ASN  74  69.306  -2.451 -11.272
  562    H    HIS  75           HN       HIS  75  71.317  -2.802  -9.241
  563    HA   HIS  75           HA       HIS  75  71.874  -5.515  -9.483
  564    HD1  HIS  75           HD1      HIS  75  75.928  -3.436 -10.197
  565    HD2  HIS  75           HD2      HIS  75  72.385  -1.324  -9.579
  566    HE1  HIS  75           HE1      HIS  75  76.602  -1.095  -9.503
  567    HE2  HIS  75           HE2      HIS  75  74.455   0.201  -9.124
  568    HB2  HIS  75           HB2      HIS  75  73.937  -4.834 -10.716
  569    HB3  HIS  75           HB1      HIS  75  72.518  -3.909 -11.208
  570    H1U  RCY  76           H1U      RCY  76  79.718  -4.615  -3.280
  571    H1S  RCY  76           H1S      RCY  76  76.186  -7.060  -4.058
  572    HB1  RCY  76           HB1      RCY  76  73.541  -8.342  -5.338
  573    HB2  RCY  76           HB2      RCY  76  72.367  -7.031  -5.435
  574    HA   RCY  76           HA       RCY  76  74.748  -5.760  -6.061
  575    HN1  RCY  76           HN1      RCY  76  72.577  -6.795  -7.827
  576    H    GLU  77           HN       GLU  77  76.480  -6.184  -7.547
  577    HA   GLU  77           HA       GLU  77  76.864  -8.800  -8.732
  578    HB2  GLU  77           HB2      GLU  77  78.872  -6.575  -8.258
  579    HB3  GLU  77           HB1      GLU  77  79.090  -7.950  -9.341
  580    HG2  GLU  77           HG2      GLU  77  76.836  -5.942  -9.596
  581    HG3  GLU  77           HG1      GLU  77  78.341  -5.855 -10.513
  582    H    LEU  78           HN       LEU  78  79.812  -8.746  -7.890
  583    HA   LEU  78           HA       LEU  78  79.681  -9.451  -5.043
  584    HG   LEU  78           HG       LEU  78  80.978 -10.916  -8.002
  585    HB2  LEU  78           HB2      LEU  78  80.238 -11.757  -5.261
  586    HB3  LEU  78           HB1      LEU  78  78.877 -11.485  -6.345
  587   HD11  LEU  78          HD11      LEU  78  82.464 -11.725  -6.045
  588   HD12  LEU  78          HD12      LEU  78  82.783 -12.403  -7.641
  589   HD13  LEU  78          HD13      LEU  78  81.883 -13.341  -6.448
  590   HD21  LEU  78          HD21      LEU  78  80.651 -13.341  -8.785
  591   HD22  LEU  78          HD22      LEU  78  79.199 -12.344  -8.698
  592   HD23  LEU  78          HD23      LEU  78  79.542 -13.516  -7.425
  593    H    HIS  79           HN       HIS  79  81.537  -9.124  -8.026
  594    HA   HIS  79           HA       HIS  79  83.710  -7.835  -6.683
  595    HD1  HIS  79           HD1      HIS  79  86.816 -11.226  -7.403
  596    HD2  HIS  79           HD2      HIS  79  85.915  -7.292  -6.347
  597    HE1  HIS  79           HE1      HIS  79  89.028 -10.000  -7.257
  598    HE2  HIS  79           HE2      HIS  79  88.493  -7.604  -6.615
  599    HB2  HIS  79           HB2      HIS  79  84.139 -10.171  -5.890
  600    HB3  HIS  79           HB1      HIS  79  84.302 -10.675  -7.571
  601    H    GLU  80           HN       GLU  80  85.436  -9.514  -8.806
  602    HA   GLU  80           HA       GLU  80  85.325  -7.476 -10.840
  603    HB2  GLU  80           HB2      GLU  80  86.679 -10.170 -10.650
  604    HB3  GLU  80           HB1      GLU  80  86.779  -9.189 -12.113
  605    HG2  GLU  80           HG2      GLU  80  87.810  -7.370 -10.916
  606    HG3  GLU  80           HG1      GLU  80  87.512  -8.152  -9.363
  607    H    LEU  81           HN       LEU  81  83.526 -10.362 -10.297
  608    HA   LEU  81           HA       LEU  81  82.814 -10.895 -13.055
  609    HG   LEU  81           HG       LEU  81  82.391 -13.886 -10.974
  610    HB2  LEU  81           HB2      LEU  81  81.489 -11.642 -10.430
  611    HB3  LEU  81           HB1      LEU  81  80.917 -12.201 -11.999
  612   HD11  LEU  81          HD11      LEU  81  83.518 -14.365 -12.929
  613   HD12  LEU  81          HD12      LEU  81  84.118 -12.717 -13.110
  614   HD13  LEU  81          HD13      LEU  81  82.449 -13.099 -13.534
  615   HD21  LEU  81          HD21      LEU  81  84.567 -13.426 -10.243
  616   HD22  LEU  81          HD22      LEU  81  83.712 -11.958  -9.771
  617   HD23  LEU  81          HD23      LEU  81  84.697 -11.973 -11.233
  618    H    ALA  82           HN       ALA  82  82.413  -8.145 -11.577
  619    HA   ALA  82           HA       ALA  82  79.627  -7.562 -11.575
  620    HB1  ALA  82           HB1      ALA  82  80.294  -5.232 -11.600
  621    HB2  ALA  82           HB2      ALA  82  81.882  -5.650 -12.243
  622    HB3  ALA  82           HB3      ALA  82  81.444  -6.119 -10.601
  623    H    GLN  83           HN       GLN  83  79.095  -5.517 -13.277
  624    HA   GLN  83           HA       GLN  83  79.857  -6.225 -16.022
  625    HB2  GLN  83           HB2      GLN  83  77.907  -7.774 -15.205
  626    HB3  GLN  83           HB1      GLN  83  76.911  -6.332 -15.395
  627    HG2  GLN  83           HG2      GLN  83  77.845  -6.123 -17.744
  628    HG3  GLN  83           HG1      GLN  83  78.561  -7.719 -17.522
  629   HE21  GLN  83          HE21      GLN  83  76.562  -9.120 -16.187
  630   HE22  GLN  83          HE22      GLN  83  75.158  -9.187 -17.137
  631    H    TYR  84           HN       TYR  84  79.688  -3.906 -14.008
  632    HA   TYR  84           HA       TYR  84  78.778  -1.921 -15.983
  633    HD1  TYR  84           HD2      TYR  84  76.612  -1.034 -16.720
  634    HD2  TYR  84           HD1      TYR  84  75.883  -3.956 -13.657
  635    HE1  TYR  84           HE2      TYR  84  74.777  -2.001 -18.079
  636    HE2  TYR  84           HE1      TYR  84  74.047  -4.923 -15.016
  637    HH   TYR  84           HH       TYR  84  73.620  -4.824 -17.861
  638    HB2  TYR  84           HB2      TYR  84  77.460  -2.269 -13.280
  639    HB3  TYR  84           HB1      TYR  84  77.358  -0.774 -14.209
  640    H    GLY  85           HN       GLY  85  79.520  -2.066 -12.474
  641    HA2  GLY  85           HA2      GLY  85  81.884  -0.334 -12.993
  642    HA3  GLY  85           HA1      GLY  85  80.692   0.205 -11.810
  643    H    ILE  86           HN       ILE  86  82.545  -2.770 -12.565
  644    HA   ILE  86           HA       ILE  86  83.435  -4.379 -11.093
  645    HB   ILE  86           HB       ILE  86  84.132  -2.096  -9.264
  646   HG12  ILE  86          HG12      ILE  86  85.238  -2.579 -12.049
  647   HG13  ILE  86          HG11      ILE  86  84.394  -1.135 -11.489
  648   HG21  ILE  86          HG21      ILE  86  85.935  -4.224 -10.409
  649   HG22  ILE  86          HG22      ILE  86  84.865  -4.584  -9.054
  650   HG23  ILE  86          HG23      ILE  86  86.101  -3.336  -8.895
  651   HD11  ILE  86          HD11      ILE  86  86.702  -0.574 -11.381
  652   HD12  ILE  86          HD12      ILE  86  87.126  -2.131 -10.669
  653   HD13  ILE  86          HD13      ILE  86  86.243  -0.937  -9.717
  654    H1U  RCY  87           H1U      RCY  87  84.469  -4.081  -0.220
  655    H1S  RCY  87           H1S      RCY  87  85.389  -4.973  -4.308
  656    HB1  RCY  87           HB1      RCY  87  82.463  -5.742  -5.853
  657    HB2  RCY  87           HB2      RCY  87  82.347  -4.196  -5.014
  658    HA   RCY  87           HA       RCY  87  81.056  -4.837  -7.387
  659    HN1  RCY  87           HN1      RCY  87  83.656  -3.708  -8.121
  Start of MODEL    6
    1    HA   MET   1           HA       MET   1  56.704   6.532  23.911
    2    HB2  MET   1           HB2      MET   1  58.876   7.783  25.620
    3    HB3  MET   1           HB1      MET   1  57.428   8.625  25.066
    4    HG2  MET   1           HG2      MET   1  55.994   7.173  26.317
    5    HG3  MET   1           HG1      MET   1  57.312   6.050  26.651
    6    HE1  MET   1           HE1      MET   1  55.986   6.427  29.052
    7    HE2  MET   1           HE2      MET   1  57.135   7.092  30.211
    8    HE3  MET   1           HE3      MET   1  57.662   5.864  29.063
    9    H    ASN   2           HN       ASN   2  60.072   7.743  23.986
   10    HA   ASN   2           HA       ASN   2  59.676   8.961  21.340
   11    HB2  ASN   2           HB2      ASN   2  62.138   8.854  23.110
   12    HB3  ASN   2           HB1      ASN   2  61.943   9.862  21.676
   13   HD21  ASN   2          HD21      ASN   2  60.306  11.619  21.789
   14   HD22  ASN   2          HD22      ASN   2  59.805  12.219  23.296
   15    H    LEU   3           HN       LEU   3  62.535   7.160  22.460
   16    HA   LEU   3           HA       LEU   3  62.928   6.036  19.810
   17    HG   LEU   3           HG       LEU   3  64.498   3.540  20.930
   18    HB2  LEU   3           HB2      LEU   3  64.856   6.540  21.225
   19    HB3  LEU   3           HB1      LEU   3  64.268   5.436  22.466
   20   HD11  LEU   3          HD11      LEU   3  64.076   4.356  18.780
   21   HD12  LEU   3          HD12      LEU   3  65.826   4.141  18.744
   22   HD13  LEU   3          HD13      LEU   3  65.140   5.747  18.992
   23   HD21  LEU   3          HD21      LEU   3  66.464   4.145  22.262
   24   HD22  LEU   3          HD22      LEU   3  66.960   5.312  21.037
   25   HD23  LEU   3          HD23      LEU   3  66.978   3.587  20.670
   26    H    GLU   4           HN       GLU   4  61.038   4.785  19.395
   27    HA   GLU   4           HA       GLU   4  60.781   2.319  21.076
   28    HB2  GLU   4           HB2      GLU   4  58.691   3.972  19.650
   29    HB3  GLU   4           HB1      GLU   4  58.381   2.310  20.153
   30    HG2  GLU   4           HG2      GLU   4  58.708   2.840  22.456
   31    HG3  GLU   4           HG1      GLU   4  59.410   4.411  22.068
   32    HA   PRO   5           HA       PRO   5  61.873  -0.302  17.700
   33    HB2  PRO   5           HB2      PRO   5  59.129  -1.472  18.023
   34    HB3  PRO   5           HB1      PRO   5  60.693  -2.298  17.884
   35    HG2  PRO   5           HG2      PRO   5  59.454  -1.975  20.238
   36    HG3  PRO   5           HG1      PRO   5  61.218  -1.965  20.086
   37    HD2  PRO   5           HD2      PRO   5  59.392   0.279  20.688
   38    HD3  PRO   5           HD1      PRO   5  61.139   0.140  20.980
   39    HA   PRO   6           HA       PRO   6  59.872   1.711  14.234
   40    HB2  PRO   6           HB2      PRO   6  61.011   0.312  12.194
   41    HB3  PRO   6           HB1      PRO   6  61.913   1.498  13.158
   42    HG2  PRO   6           HG2      PRO   6  61.901  -1.472  13.360
   43    HG3  PRO   6           HG1      PRO   6  63.254  -0.336  13.493
   44    HD2  PRO   6           HD2      PRO   6  62.016  -1.469  15.672
   45    HD3  PRO   6           HD1      PRO   6  62.836   0.107  15.722
   46    H    LYS   7           HN       LYS   7  58.316   1.240  12.500
   47    HA   LYS   7           HA       LYS   7  56.456  -0.845  13.168
   48    HB2  LYS   7           HB2      LYS   7  56.640   0.590  10.507
   49    HB3  LYS   7           HB1      LYS   7  55.207  -0.117  11.252
   50    HG2  LYS   7           HG2      LYS   7  56.775   2.262  12.290
   51    HG3  LYS   7           HG1      LYS   7  55.169   2.307  11.562
   52    HD2  LYS   7           HD2      LYS   7  54.509   0.630  13.431
   53    HD3  LYS   7           HD1      LYS   7  55.993   1.160  14.225
   54    HE2  LYS   7           HE2      LYS   7  55.222   3.494  14.137
   55    HE3  LYS   7           HE1      LYS   7  53.749   2.986  13.311
   56    HZ1  LYS   7           HZ1      LYS   7  53.695   3.304  15.842
   57    HZ2  LYS   7           HZ2      LYS   7  54.497   1.807  15.907
   58    HZ3  LYS   7           HZ3      LYS   7  52.962   1.921  15.187
   59    H    ALA   8           HN       ALA   8  57.029  -2.961  12.924
   60    HA   ALA   8           HA       ALA   8  58.923  -3.858  10.927
   61    HB1  ALA   8           HB1      ALA   8  56.943  -5.571  12.448
   62    HB2  ALA   8           HB2      ALA   8  58.447  -4.984  13.157
   63    HB3  ALA   8           HB3      ALA   8  58.492  -6.067  11.766
   64    H    GLU   9           HN       GLU   9  55.607  -5.117  11.309
   65    HA   GLU   9           HA       GLU   9  54.035  -5.729   9.677
   66    HB2  GLU   9           HB2      GLU   9  54.201  -3.183   9.366
   67    HB3  GLU   9           HB1      GLU   9  55.240  -3.533   7.985
   68    HG2  GLU   9           HG2      GLU   9  53.382  -5.062   7.138
   69    HG3  GLU   9           HG1      GLU   9  52.354  -4.349   8.382
   70    H1U  RCY  10           H1U      RCY  10  63.545  -9.868   4.663
   71    H1S  RCY  10           H1S      RCY  10  59.560  -9.169   6.171
   72    HB1  RCY  10           HB1      RCY  10  56.943  -9.621   9.248
   73    HB2  RCY  10           HB2      RCY  10  58.453  -8.744   8.995
   74    HA   RCY  10           HA       RCY  10  57.540  -7.543   7.129
   75    HN1  RCY  10           HN1      RCY  10  56.107  -7.430   9.631
   76    H    ARG  11           HN       ARG  11  55.981  -7.338   5.448
   77    HA   ARG  11           HA       ARG  11  54.811  -9.808   4.549
   78    HE   ARG  11           HE       ARG  11  52.825 -12.819   4.287
   79    HB2  ARG  11           HB2      ARG  11  53.230  -8.850   6.445
   80    HB3  ARG  11           HB1      ARG  11  52.692  -7.766   5.163
   81    HG2  ARG  11           HG2      ARG  11  51.234  -9.554   4.860
   82    HG3  ARG  11           HG1      ARG  11  52.538 -10.000   3.759
   83    HD2  ARG  11           HD2      ARG  11  53.544 -11.202   5.859
   84    HD3  ARG  11           HD1      ARG  11  51.893 -11.118   6.475
   85   HH11  ARG  11          HH21      ARG  11  50.198 -11.155   5.774
   86   HH12  ARG  11          HH22      ARG  11  48.986 -12.195   5.104
   87   HH21  ARG  11          HH11      ARG  11  51.258 -14.188   3.404
   88   HH22  ARG  11          HH12      ARG  11  49.586 -13.912   3.763
   89    H    SER  12           HN       SER  12  56.384  -7.319   3.748
   90    HA   SER  12           HA       SER  12  54.864  -5.832   1.835
   91    HG   SER  12           HG       SER  12  56.932  -5.419   3.724
   92    HB2  SER  12           HB2      SER  12  57.830  -6.464   1.836
   93    HB3  SER  12           HB1      SER  12  57.053  -5.194   0.895
   94    H    ALA  13           HN       ALA  13  54.160  -6.401  -0.172
   95    HA   ALA  13           HA       ALA  13  55.003  -9.053  -1.240
   96    HB1  ALA  13           HB1      ALA  13  52.581  -8.688  -0.970
   97    HB2  ALA  13           HB2      ALA  13  52.998  -8.860  -2.675
   98    HB3  ALA  13           HB3      ALA  13  52.675  -7.262  -2.003
   99    H    THR  14           HN       THR  14  56.244  -9.161  -3.064
  100    HA   THR  14           HA       THR  14  56.227  -7.015  -5.050
  101    HB   THR  14           HB       THR  14  58.784  -7.550  -3.509
  102    HG1  THR  14           HG1      THR  14  58.183  -5.103  -3.199
  103   HG21  THR  14          HG21      THR  14  59.585  -5.577  -4.809
  104   HG22  THR  14          HG22      THR  14  58.062  -5.583  -5.699
  105   HG23  THR  14          HG23      THR  14  59.171  -6.948  -5.839
  106    H    ARG  15           HN       ARG  15  56.647  -7.932  -7.014
  107    HA   ARG  15           HA       ARG  15  57.316 -10.763  -7.147
  108    HE   ARG  15           HE       ARG  15  53.975 -11.088 -10.965
  109    HB2  ARG  15           HB2      ARG  15  57.117  -8.731  -9.391
  110    HB3  ARG  15           HB1      ARG  15  57.083 -10.486  -9.563
  111    HG2  ARG  15           HG2      ARG  15  54.995 -10.639  -8.369
  112    HG3  ARG  15           HG1      ARG  15  55.069  -8.936  -7.915
  113    HD2  ARG  15           HD2      ARG  15  53.554  -9.063  -9.765
  114    HD3  ARG  15           HD1      ARG  15  55.058  -8.399 -10.406
  115   HH11  ARG  15          HH21      ARG  15  56.568  -8.819 -11.090
  116   HH12  ARG  15          HH22      ARG  15  57.402  -9.641 -12.367
  117   HH21  ARG  15          HH11      ARG  15  55.049 -12.174 -12.632
  118   HH22  ARG  15          HH12      ARG  15  56.542 -11.540 -13.240
  119    H    VAL  16           HN       VAL  16  59.421 -11.261  -6.637
  120    HA   VAL  16           HA       VAL  16  61.665  -9.548  -7.102
  121    HB   VAL  16           HB       VAL  16  61.564 -12.562  -6.773
  122   HG11  VAL  16          HG11      VAL  16  63.693 -12.020  -7.705
  123   HG12  VAL  16          HG12      VAL  16  63.959 -12.148  -5.966
  124   HG13  VAL  16          HG13      VAL  16  63.830 -10.561  -6.724
  125   HG21  VAL  16          HG21      VAL  16  60.603 -11.168  -4.904
  126   HG22  VAL  16          HG22      VAL  16  62.177 -10.388  -4.749
  127   HG23  VAL  16          HG23      VAL  16  62.013 -12.116  -4.433
  128    H    MET  17           HN       MET  17  62.632  -9.068  -9.009
  129    HA   MET  17           HA       MET  17  61.819 -10.194 -11.501
  130    HB2  MET  17           HB2      MET  17  64.249  -8.593 -10.677
  131    HB3  MET  17           HB1      MET  17  63.981  -9.101 -12.344
  132    HG2  MET  17           HG2      MET  17  63.091  -6.839 -12.003
  133    HG3  MET  17           HG1      MET  17  61.773  -7.968 -12.318
  134    HE1  MET  17           HE1      MET  17  63.046  -5.886  -8.512
  135    HE2  MET  17           HE2      MET  17  63.986  -6.296  -9.944
  136    HE3  MET  17           HE3      MET  17  63.744  -7.501  -8.682
  137    H    GLY  18           HN       GLY  18  64.630 -10.866  -9.420
  138    HA2  GLY  18           HA2      GLY  18  65.752 -12.957  -9.222
  139    HA3  GLY  18           HA1      GLY  18  64.824 -13.557 -10.598
  140    H    GLY  19           HN       GLY  19  65.757 -13.483 -12.619
  141    HA2  GLY  19           HA2      GLY  19  68.585 -12.684 -12.746
  142    HA3  GLY  19           HA1      GLY  19  67.684 -13.510 -14.017
  143    HA   PRO  20           HA       PRO  20  66.607  -9.975 -16.404
  144    HB2  PRO  20           HB2      PRO  20  63.933  -9.740 -15.063
  145    HB3  PRO  20           HB1      PRO  20  64.329  -9.743 -16.793
  146    HG2  PRO  20           HG2      PRO  20  63.317 -11.893 -15.596
  147    HG3  PRO  20           HG1      PRO  20  64.533 -12.031 -16.877
  148    HD2  PRO  20           HD2      PRO  20  64.832 -12.484 -13.950
  149    HD3  PRO  20           HD1      PRO  20  65.750 -13.185 -15.301
  150    H1U  RCY  21           H1U      RCY  21  68.092  -7.043  -5.202
  151    H1S  RCY  21           H1S      RCY  21  66.749  -6.817  -9.806
  152    HB1  RCY  21           HB1      RCY  21  69.437  -7.707 -12.579
  153    HB2  RCY  21           HB2      RCY  21  67.865  -8.298 -12.044
  154    HA   RCY  21           HA       RCY  21  66.881  -6.503 -13.639
  155    HN1  RCY  21           HN1      RCY  21  68.214  -8.775 -15.035
  156    H    THR  22           HN       THR  22  67.348  -5.009 -15.252
  157    HA   THR  22           HA       THR  22  70.232  -4.390 -15.644
  158    HB   THR  22           HB       THR  22  70.060  -4.308 -18.020
  159    HG1  THR  22           HG1      THR  22  67.589  -5.147 -18.474
  160   HG21  THR  22          HG21      THR  22  70.192  -6.601 -16.955
  161   HG22  THR  22          HG22      THR  22  69.541  -6.584 -18.594
  162   HG23  THR  22          HG23      THR  22  68.453  -6.743 -17.215
  163    HA   PRO  23           HA       PRO  23  67.967  -0.565 -14.452
  164    HB2  PRO  23           HB2      PRO  23  70.804   0.380 -14.535
  165    HB3  PRO  23           HB1      PRO  23  69.565   0.639 -13.291
  166    HG2  PRO  23           HG2      PRO  23  71.547  -1.100 -12.935
  167    HG3  PRO  23           HG1      PRO  23  69.914  -1.424 -12.330
  168    HD2  PRO  23           HD2      PRO  23  71.322  -2.622 -14.679
  169    HD3  PRO  23           HD1      PRO  23  70.108  -3.346 -13.600
  170    H    ARG  24           HN       ARG  24  69.028   1.880 -15.337
  171    HA   ARG  24           HA       ARG  24  69.108   1.563 -18.315
  172    HE   ARG  24           HE       ARG  24  68.105   1.570 -19.755
  173    HB2  ARG  24           HB2      ARG  24  67.553   3.594 -16.685
  174    HB3  ARG  24           HB1      ARG  24  67.746   3.665 -18.435
  175    HG2  ARG  24           HG2      ARG  24  66.843   1.039 -17.473
  176    HG3  ARG  24           HG1      ARG  24  65.707   2.342 -17.122
  177    HD2  ARG  24           HD2      ARG  24  65.214   1.387 -19.323
  178    HD3  ARG  24           HD1      ARG  24  65.806   3.038 -19.507
  179   HH11  ARG  24          HH21      ARG  24  64.944   1.359 -21.116
  180   HH12  ARG  24          HH22      ARG  24  65.488   0.665 -22.607
  181   HH21  ARG  24          HH11      ARG  24  68.833   0.666 -21.695
  182   HH22  ARG  24          HH12      ARG  24  67.690   0.273 -22.935
  183    H    LYS  25           HN       LYS  25  69.024   4.692 -16.828
  184    HA   LYS  25           HA       LYS  25  71.393   5.613 -18.039
  185    HB2  LYS  25           HB2      LYS  25  70.273   6.587 -15.394
  186    HB3  LYS  25           HB1      LYS  25  71.284   7.502 -16.512
  187    HG2  LYS  25           HG2      LYS  25  68.676   6.338 -17.458
  188    HG3  LYS  25           HG1      LYS  25  68.689   7.860 -16.567
  189    HD2  LYS  25           HD2      LYS  25  70.268   8.815 -18.196
  190    HD3  LYS  25           HD1      LYS  25  70.284   7.291 -19.083
  191    HE2  LYS  25           HE2      LYS  25  67.784   7.528 -19.364
  192    HE3  LYS  25           HE1      LYS  25  67.926   9.150 -18.685
  193    HZ1  LYS  25           HZ1      LYS  25  68.312   9.773 -20.775
  194    HZ2  LYS  25           HZ2      LYS  25  68.630   8.189 -21.300
  195    HZ3  LYS  25           HZ3      LYS  25  69.860   9.107 -20.573
  196    H    GLY  26           HN       GLY  26  73.167   4.247 -17.774
  197    HA2  GLY  26           HA2      GLY  26  74.189   3.985 -14.981
  198    HA3  GLY  26           HA1      GLY  26  74.376   2.705 -16.172
  199    HA   PRO  27           HA       PRO  27  77.411   5.340 -18.636
  200    HB2  PRO  27           HB2      PRO  27  76.441   8.049 -17.774
  201    HB3  PRO  27           HB1      PRO  27  77.137   7.547 -19.329
  202    HG2  PRO  27           HG2      PRO  27  74.507   7.857 -19.012
  203    HG3  PRO  27           HG1      PRO  27  75.171   6.575 -20.038
  204    HD2  PRO  27           HD2      PRO  27  73.833   6.350 -17.397
  205    HD3  PRO  27           HD1      PRO  27  74.013   5.131 -18.678
  206    HA   PRO  28           HA       PRO  28  79.936   5.272 -14.870
  207    HB2  PRO  28           HB2      PRO  28  81.924   6.326 -16.857
  208    HB3  PRO  28           HB1      PRO  28  82.112   5.036 -15.652
  209    HG2  PRO  28           HG2      PRO  28  81.730   4.493 -18.236
  210    HG3  PRO  28           HG1      PRO  28  81.042   3.478 -16.959
  211    HD2  PRO  28           HD2      PRO  28  79.664   5.363 -18.795
  212    HD3  PRO  28           HD1      PRO  28  79.019   3.944 -17.942
  213    H    LYS  29           HN       LYS  29  81.106   6.891 -13.563
  214    HA   LYS  29           HA       LYS  29  81.152   9.673 -14.450
  215    HB2  LYS  29           HB2      LYS  29  78.729   9.171 -13.763
  216    HB3  LYS  29           HB1      LYS  29  79.343   9.024 -12.116
  217    HG2  LYS  29           HG2      LYS  29  80.418  11.330 -12.486
  218    HG3  LYS  29           HG1      LYS  29  79.384  11.454 -13.910
  219    HD2  LYS  29           HD2      LYS  29  78.284  10.782 -11.175
  220    HD3  LYS  29           HD1      LYS  29  78.442  12.445 -11.743
  221    HE2  LYS  29           HE2      LYS  29  76.833  10.234 -13.052
  222    HE3  LYS  29           HE1      LYS  29  76.193  11.664 -12.243
  223    HZ1  LYS  29           HZ1      LYS  29  77.953  12.652 -14.080
  224    HZ2  LYS  29           HZ2      LYS  29  76.260  12.629 -14.226
  225    HZ3  LYS  29           HZ3      LYS  29  77.191  11.380 -14.905
  226    H1U  RCY  30           H1U      RCY  30  87.010  11.637  -5.632
  227    H1S  RCY  30           H1S      RCY  30  86.043  11.149  -9.784
  228    HB1  RCY  30           HB1      RCY  30  83.070  11.286  -8.918
  229    HB2  RCY  30           HB2      RCY  30  81.946  11.749 -10.196
  230    HA   RCY  30           HA       RCY  30  83.445   9.179 -10.512
  231    HN1  RCY  30           HN1      RCY  30  80.619   9.852 -11.224
  232    H    LYS  31           HN       LYS  31  83.732   8.856  -8.148
  233    HA   LYS  31           HA       LYS  31  81.439   7.398  -7.031
  234    HB2  LYS  31           HB2      LYS  31  84.237   7.893  -5.967
  235    HB3  LYS  31           HB1      LYS  31  83.039   6.861  -5.186
  236    HG2  LYS  31           HG2      LYS  31  82.904   5.539  -7.334
  237    HG3  LYS  31           HG1      LYS  31  84.277   6.476  -7.924
  238    HD2  LYS  31           HD2      LYS  31  85.570   5.738  -5.902
  239    HD3  LYS  31           HD1      LYS  31  84.221   4.682  -5.482
  240    HE2  LYS  31           HE2      LYS  31  85.616   4.567  -8.165
  241    HE3  LYS  31           HE1      LYS  31  86.101   3.573  -6.792
  242    HZ1  LYS  31           HZ1      LYS  31  84.591   2.170  -7.655
  243    HZ2  LYS  31           HZ2      LYS  31  83.741   3.393  -8.471
  244    HZ3  LYS  31           HZ3      LYS  31  83.482   3.138  -6.812
  245    H    GLN  32           HN       GLN  32  82.299  10.589  -7.089
  246    HA   GLN  32           HA       GLN  32  81.696  12.438  -5.778
  247    HB2  GLN  32           HB2      GLN  32  79.770  10.624  -4.327
  248    HB3  GLN  32           HB1      GLN  32  79.586  12.332  -4.728
  249    HG2  GLN  32           HG2      GLN  32  79.712  11.541  -7.200
  250    HG3  GLN  32           HG1      GLN  32  79.362   9.940  -6.548
  251   HE21  GLN  32          HE21      GLN  32  77.867  12.713  -7.737
  252   HE22  GLN  32          HE22      GLN  32  76.337  12.507  -7.032
  253    H    ARG  33           HN       ARG  33  83.979  11.403  -4.896
  254    HA   ARG  33           HA       ARG  33  85.370  11.178  -3.028
  255    HE   ARG  33           HE       ARG  33  84.831  15.971  -3.874
  256    HB2  ARG  33           HB2      ARG  33  83.040  12.594  -1.692
  257    HB3  ARG  33           HB1      ARG  33  84.635  12.379  -0.976
  258    HG2  ARG  33           HG2      ARG  33  85.093  14.391  -1.939
  259    HG3  ARG  33           HG1      ARG  33  85.288  13.443  -3.414
  260    HD2  ARG  33           HD2      ARG  33  82.922  13.819  -3.982
  261    HD3  ARG  33           HD1      ARG  33  82.708  14.750  -2.499
  262   HH11  ARG  33          HH21      ARG  33  81.506  15.201  -4.361
  263   HH12  ARG  33          HH22      ARG  33  81.205  16.559  -5.393
  264   HH21  ARG  33          HH11      ARG  33  84.458  17.749  -5.219
  265   HH22  ARG  33          HH12      ARG  33  82.876  18.002  -5.879
  266    H    GLN  34           HN       GLN  34  85.719   9.787  -1.220
  267    HA   GLN  34           HA       GLN  34  83.409   8.127  -0.341
  268    HB2  GLN  34           HB2      GLN  34  85.934   7.142  -1.673
  269    HB3  GLN  34           HB1      GLN  34  85.012   6.105  -0.584
  270    HG2  GLN  34           HG2      GLN  34  83.722   7.548  -2.906
  271    HG3  GLN  34           HG1      GLN  34  84.422   5.937  -3.071
  272   HE21  GLN  34          HE21      GLN  34  81.723   6.035  -3.524
  273   HE22  GLN  34          HE22      GLN  34  80.855   5.410  -2.205
  274    H    THR  35           HN       THR  35  84.913  10.204   1.010
  275    HA   THR  35           HA       THR  35  86.953   9.171   2.709
  276    HB   THR  35           HB       THR  35  86.455  11.093   4.157
  277    HG1  THR  35           HG1      THR  35  84.028  10.827   2.905
  278   HG21  THR  35          HG21      THR  35  86.177  11.713   1.202
  279   HG22  THR  35          HG22      THR  35  87.691  11.524   2.086
  280   HG23  THR  35          HG23      THR  35  86.625  12.882   2.444
  281    H    ARG  36           HN       ARG  36  85.769   9.844   5.309
  282    HA   ARG  36           HA       ARG  36  84.856   8.577   7.077
  283    HE   ARG  36           HE       ARG  36  80.737  12.371   6.218
  284    HB2  ARG  36           HB2      ARG  36  82.619   8.074   5.100
  285    HB3  ARG  36           HB1      ARG  36  82.504   8.175   6.857
  286    HG2  ARG  36           HG2      ARG  36  83.138  10.549   6.778
  287    HG3  ARG  36           HG1      ARG  36  83.294  10.458   5.023
  288    HD2  ARG  36           HD2      ARG  36  80.885   9.776   4.900
  289    HD3  ARG  36           HD1      ARG  36  80.761  10.046   6.638
  290   HH11  ARG  36          HH21      ARG  36  81.862  10.561   3.508
  291   HH12  ARG  36          HH22      ARG  36  81.896  11.925   2.442
  292   HH21  ARG  36          HH11      ARG  36  80.775  14.163   4.842
  293   HH22  ARG  36          HH12      ARG  36  81.281  13.965   3.197
  294    H    GLN  37           HN       GLN  37  86.509   7.153   5.013
  295    HA   GLN  37           HA       GLN  37  85.548   4.637   4.286
  296    HB2  GLN  37           HB2      GLN  37  88.321   5.013   5.426
  297    HB3  GLN  37           HB1      GLN  37  87.807   3.923   4.139
  298    HG2  GLN  37           HG2      GLN  37  88.748   5.644   2.890
  299    HG3  GLN  37           HG1      GLN  37  87.066   6.173   2.958
  300   HE21  GLN  37          HE21      GLN  37  89.283   8.017   2.648
  301   HE22  GLN  37          HE22      GLN  37  89.338   8.993   4.035
  302    H1U  RCY  38           H1U      RCY  38  83.531   3.927   3.156
  303    H1S  RCY  38           H1S      RCY  38  84.245   3.501   6.345
  304    HB1  RCY  38           HB1      RCY  38  83.431   4.180   8.427
  305    HB2  RCY  38           HB2      RCY  38  83.946   3.140   9.754
  306    HA   RCY  38           HA       RCY  38  85.624   4.831   9.549
  307    HN1  RCY  38           HN1      RCY  38  85.680   5.834   7.423
  308    H    LYS  39           HN       LYS  39  87.286   3.882  10.589
  309    HA   LYS  39           HA       LYS  39  89.311   2.341   9.476
  310    HB2  LYS  39           HB2      LYS  39  88.194   2.361  12.286
  311    HB3  LYS  39           HB1      LYS  39  89.598   1.389  11.853
  312    HG2  LYS  39           HG2      LYS  39  90.571   3.400  12.586
  313    HG3  LYS  39           HG1      LYS  39  90.525   3.606  10.835
  314    HD2  LYS  39           HD2      LYS  39  88.552   4.969  10.962
  315    HD3  LYS  39           HD1      LYS  39  88.323   4.583  12.668
  316    HE2  LYS  39           HE2      LYS  39  90.642   5.635  13.041
  317    HE3  LYS  39           HE1      LYS  39  90.472   6.295  11.414
  318    HZ1  LYS  39           HZ1      LYS  39  88.410   7.347  12.085
  319    HZ2  LYS  39           HZ2      LYS  39  89.683   7.844  13.095
  320    HZ3  LYS  39           HZ3      LYS  39  88.555   6.699  13.646
  321    H    SER  40           HN       SER  40  87.695   0.450  11.892
  322    HA   SER  40           HA       SER  40  87.289  -1.703   9.858
  323    HG   SER  40           HG       SER  40  89.360  -1.448  11.117
  324    HB2  SER  40           HB2      SER  40  87.503  -1.926  12.874
  325    HB3  SER  40           HB1      SER  40  87.422  -3.265  11.733
  326    H    LYS  41           HN       LYS  41  85.574  -3.285  11.499
  327    HA   LYS  41           HA       LYS  41  83.152  -1.577  11.841
  328    HB2  LYS  41           HB2      LYS  41  81.941  -3.644  10.736
  329    HB3  LYS  41           HB1      LYS  41  82.666  -2.401   9.715
  330    HG2  LYS  41           HG2      LYS  41  84.525  -3.733   9.190
  331    HG3  LYS  41           HG1      LYS  41  84.293  -4.777  10.592
  332    HD2  LYS  41           HD2      LYS  41  82.443  -5.882   9.604
  333    HD3  LYS  41           HD1      LYS  41  82.247  -4.631   8.376
  334    HE2  LYS  41           HE2      LYS  41  83.399  -6.871   7.698
  335    HE3  LYS  41           HE1      LYS  41  84.118  -5.354   7.157
  336    HZ1  LYS  41           HZ1      LYS  41  84.943  -6.489   9.737
  337    HZ2  LYS  41           HZ2      LYS  41  85.819  -5.513   8.656
  338    HZ3  LYS  41           HZ3      LYS  41  85.570  -7.158   8.309
  339    HA   PRO  42           HA       PRO  42  83.793  -4.562  15.333
  340    HB2  PRO  42           HB2      PRO  42  82.985  -2.813  17.302
  341    HB3  PRO  42           HB1      PRO  42  84.654  -2.939  16.717
  342    HG2  PRO  42           HG2      PRO  42  82.568  -0.932  16.062
  343    HG3  PRO  42           HG1      PRO  42  84.315  -0.725  16.261
  344    HD2  PRO  42           HD2      PRO  42  83.074  -0.838  13.808
  345    HD3  PRO  42           HD1      PRO  42  84.767  -1.308  14.074
  346    HA   PRO  43           HA       PRO  43  79.666  -6.027  15.771
  347    HB2  PRO  43           HB2      PRO  43  79.500  -6.285  18.580
  348    HB3  PRO  43           HB1      PRO  43  80.083  -7.515  17.445
  349    HG2  PRO  43           HG2      PRO  43  81.611  -5.635  19.140
  350    HG3  PRO  43           HG1      PRO  43  82.018  -7.276  18.613
  351    HD2  PRO  43           HD2      PRO  43  83.199  -5.091  17.522
  352    HD3  PRO  43           HD1      PRO  43  82.868  -6.555  16.566
  353    H    LYS  44           HN       LYS  44  77.509  -5.500  16.731
  354    HA   LYS  44           HA       LYS  44  75.886  -4.008  17.553
  355    HB2  LYS  44           HB2      LYS  44  77.951  -3.466  19.199
  356    HB3  LYS  44           HB1      LYS  44  77.894  -1.936  18.325
  357    HG2  LYS  44           HG2      LYS  44  75.484  -1.731  18.852
  358    HG3  LYS  44           HG1      LYS  44  75.559  -3.247  19.750
  359    HD2  LYS  44           HD2      LYS  44  75.877  -1.745  21.483
  360    HD3  LYS  44           HD1      LYS  44  77.553  -2.009  20.999
  361    HE2  LYS  44           HE2      LYS  44  77.410   0.331  21.063
  362    HE3  LYS  44           HE1      LYS  44  77.134  -0.022  19.357
  363    HZ1  LYS  44           HZ1      LYS  44  74.686  -0.093  20.004
  364    HZ2  LYS  44           HZ2      LYS  44  75.432   1.431  19.927
  365    HZ3  LYS  44           HZ3      LYS  44  75.157   0.692  21.432
  366    H    LYS  45           HN       LYS  45  76.394  -1.041  17.421
  367    HA   LYS  45           HA       LYS  45  77.252  -0.197  14.871
  368    HB2  LYS  45           HB2      LYS  45  74.715  -1.620  14.830
  369    HB3  LYS  45           HB1      LYS  45  74.485   0.048  14.315
  370    HG2  LYS  45           HG2      LYS  45  76.770  -1.575  13.213
  371    HG3  LYS  45           HG1      LYS  45  75.154  -1.733  12.523
  372    HD2  LYS  45           HD2      LYS  45  76.258   1.018  12.952
  373    HD3  LYS  45           HD1      LYS  45  76.851   0.077  11.583
  374    HE2  LYS  45           HE2      LYS  45  73.913   0.542  12.162
  375    HE3  LYS  45           HE1      LYS  45  74.860   1.515  11.035
  376    HZ1  LYS  45           HZ1      LYS  45  75.462  -0.738  10.005
  377    HZ2  LYS  45           HZ2      LYS  45  73.919  -0.098   9.696
  378    HZ3  LYS  45           HZ3      LYS  45  74.114  -1.332  10.847
  379    H    GLY  46           HN       GLY  46  76.169   2.015  14.320
  380    HA2  GLY  46           HA2      GLY  46  75.392   4.124  15.031
  381    HA3  GLY  46           HA1      GLY  46  74.700   3.336  16.450
  382    H    VAL  47           HN       VAL  47  75.877   3.325  18.369
  383    HA   VAL  47           HA       VAL  47  77.746   5.324  18.913
  384    HB   VAL  47           HB       VAL  47  77.575   2.595  20.231
  385   HG11  VAL  47          HG11      VAL  47  78.787   5.231  21.102
  386   HG12  VAL  47          HG12      VAL  47  79.618   3.690  20.893
  387   HG13  VAL  47          HG13      VAL  47  78.464   3.898  22.211
  388   HG21  VAL  47          HG21      VAL  47  76.129   5.216  20.699
  389   HG22  VAL  47          HG22      VAL  47  76.162   3.913  21.886
  390   HG23  VAL  47          HG23      VAL  47  75.415   3.651  20.310
  391    H    GLN  48           HN       GLN  48  78.321   2.052  17.700
  392    HA   GLN  48           HA       GLN  48  81.053   2.897  16.909
  393    HB2  GLN  48           HB2      GLN  48  82.098   0.923  17.844
  394    HB3  GLN  48           HB1      GLN  48  81.213   1.733  19.137
  395    HG2  GLN  48           HG2      GLN  48  79.243   0.155  18.394
  396    HG3  GLN  48           HG1      GLN  48  80.539  -0.814  17.693
  397   HE21  GLN  48          HE21      GLN  48  80.446   1.103  20.748
  398   HE22  GLN  48          HE22      GLN  48  80.848  -0.205  21.752
  399    H    GLY  49           HN       GLY  49  81.110   2.500  14.761
  400    HA2  GLY  49           HA2      GLY  49  81.061   0.179  13.383
  401    HA3  GLY  49           HA1      GLY  49  79.331   0.457  13.594
  402    H1U  RCY  50           H1U      RCY  50  82.909   2.816   5.174
  403    H1S  RCY  50           H1S      RCY  50  81.337   4.531   8.796
  404    HB1  RCY  50           HB1      RCY  50  78.737   5.112  11.719
  405    HB2  RCY  50           HB2      RCY  50  78.652   3.505  10.999
  406    HA   RCY  50           HA       RCY  50  81.216   3.752  10.667
  407    HN1  RCY  50           HN1      RCY  50  80.830   3.422  13.513
  408    H    GLY  51           HN       GLY  51  83.102   4.821  11.484
  409    HA2  GLY  51           HA2      GLY  51  82.921   7.031  13.346
  410    HA3  GLY  51           HA1      GLY  51  84.334   6.620  12.373
  411    H    ASP  52           HN       ASP  52  81.036   7.444  11.304
  412    HA   ASP  52           HA       ASP  52  82.170   9.367   9.386
  413    HB2  ASP  52           HB2      ASP  52  79.331   8.471   9.960
  414    HB3  ASP  52           HB1      ASP  52  79.758   9.637   8.707
  415    H    ASP  53           HN       ASP  53  80.997   9.436  12.582
  416    HA   ASP  53           HA       ASP  53  80.646  11.227  14.053
  417    HB2  ASP  53           HB2      ASP  53  82.648  12.127  12.613
  418    HB3  ASP  53           HB1      ASP  53  81.424  13.161  11.879
  419    H    ILE  54           HN       ILE  54  79.197  11.056  10.949
  420    HA   ILE  54           HA       ILE  54  76.778  12.399  12.006
  421    HB   ILE  54           HB       ILE  54  77.871  13.114   9.277
  422   HG12  ILE  54          HG12      ILE  54  78.177  14.558  11.927
  423   HG13  ILE  54          HG11      ILE  54  79.473  13.949  10.896
  424   HG21  ILE  54          HG21      ILE  54  75.389  13.334   9.864
  425   HG22  ILE  54          HG22      ILE  54  76.184  14.804   9.297
  426   HG23  ILE  54          HG23      ILE  54  75.876  14.575  11.019
  427   HD11  ILE  54          HD11      ILE  54  79.339  16.285  10.434
  428   HD12  ILE  54          HD12      ILE  54  77.578  16.238  10.338
  429   HD13  ILE  54          HD13      ILE  54  78.551  15.488   9.072
  430    HA   PRO  55           HA       PRO  55  76.022   8.516   9.571
  431    HB2  PRO  55           HB2      PRO  55  74.215   7.436  11.330
  432    HB3  PRO  55           HB1      PRO  55  75.969   7.203  11.461
  433    HG2  PRO  55           HG2      PRO  55  74.189   9.044  12.967
  434    HG3  PRO  55           HG1      PRO  55  75.602   8.131  13.521
  435    HD2  PRO  55           HD2      PRO  55  75.666  10.821  12.929
  436    HD3  PRO  55           HD1      PRO  55  77.086   9.757  12.831
  437    H    GLY  56           HN       GLY  56  74.122   7.941   8.360
  438    HA2  GLY  56           HA2      GLY  56  71.813   8.188   7.716
  439    HA3  GLY  56           HA1      GLY  56  71.698   9.601   8.767
  440    H    MET  57           HN       MET  57  72.402  11.630   7.973
  441    HA   MET  57           HA       MET  57  72.956  13.229   6.347
  442    HB2  MET  57           HB2      MET  57  74.764  11.234   5.927
  443    HB3  MET  57           HB1      MET  57  73.932  11.230   4.373
  444    HG2  MET  57           HG2      MET  57  75.134  13.679   5.702
  445    HG3  MET  57           HG1      MET  57  75.864  12.786   4.368
  446    HE1  MET  57           HE1      MET  57  75.994  15.260   3.592
  447    HE2  MET  57           HE2      MET  57  74.785  16.064   4.591
  448    HE3  MET  57           HE3      MET  57  74.671  16.157   2.836
  449    H    GLU  58           HN       GLU  58  71.082  10.416   5.622
  450    HA   GLU  58           HA       GLU  58  69.325  10.057   4.106
  451    HB2  GLU  58           HB2      GLU  58  69.151  13.079   4.329
  452    HB3  GLU  58           HB1      GLU  58  67.879  12.019   3.721
  453    HG2  GLU  58           HG2      GLU  58  67.902  10.830   5.935
  454    HG3  GLU  58           HG1      GLU  58  69.028  12.054   6.524
  455    H    GLY  59           HN       GLY  59  70.962   9.433   2.459
  456    HA2  GLY  59           HA2      GLY  59  71.686   9.514   0.226
  457    HA3  GLY  59           HA1      GLY  59  70.556  10.847  -0.016
  458    H1U  RCY  60           H1U      RCY  60  73.851   6.162   1.198
  459    H1S  RCY  60           H1S      RCY  60  77.281   8.990   0.186
  460    HB1  RCY  60           HB1      RCY  60  76.702  11.760  -0.963
  461    HB2  RCY  60           HB2      RCY  60  75.806  10.261  -0.720
  462    HA   RCY  60           HA       RCY  60  74.872  12.523   0.935
  463    HN1  RCY  60           HN1      RCY  60  73.680  10.210  -0.404
  464    H    GLY  61           HN       GLY  61  72.718  12.465  -1.450
  465    HA2  GLY  61           HA2      GLY  61  72.790  14.993  -2.376
  466    HA3  GLY  61           HA1      GLY  61  74.095  14.283  -3.328
  467    H    THR  62           HN       THR  62  71.412  12.267  -2.434
  468    HA   THR  62           HA       THR  62  69.710  11.292  -3.718
  469    HB   THR  62           HB       THR  62  68.477  12.686  -5.112
  470    HG1  THR  62           HG1      THR  62  69.382  13.716  -6.701
  471   HG21  THR  62          HG21      THR  62  69.355  13.795  -2.834
  472   HG22  THR  62          HG22      THR  62  68.300  14.662  -3.950
  473   HG23  THR  62          HG23      THR  62  70.039  14.954  -3.974
  474    H    ASP  63           HN       ASP  63  72.631  12.397  -5.307
  475    HA   ASP  63           HA       ASP  63  72.304  10.871  -7.728
  476    HB2  ASP  63           HB2      ASP  63  73.966  12.772  -7.311
  477    HB3  ASP  63           HB1      ASP  63  74.940  11.592  -6.431
  478    H    ILE  64           HN       ILE  64  71.759   9.444  -5.169
  479    HA   ILE  64           HA       ILE  64  73.459   7.072  -5.730
  480    HB   ILE  64           HB       ILE  64  74.682   7.942  -3.908
  481   HG12  ILE  64          HG12      ILE  64  72.583   6.321  -2.458
  482   HG13  ILE  64          HG11      ILE  64  73.703   5.576  -3.600
  483   HG21  ILE  64          HG21      ILE  64  73.226   9.795  -3.329
  484   HG22  ILE  64          HG22      ILE  64  73.529   8.853  -1.869
  485   HG23  ILE  64          HG23      ILE  64  71.994   8.688  -2.721
  486   HD11  ILE  64          HD11      ILE  64  74.419   5.575  -1.135
  487   HD12  ILE  64          HD12      ILE  64  74.663   7.312  -1.320
  488   HD13  ILE  64          HD13      ILE  64  75.600   6.182  -2.297
  489    H    THR  65           HN       THR  65  70.662   8.447  -4.023
  490    HA   THR  65           HA       THR  65  69.444   5.920  -3.392
  491    HB   THR  65           HB       THR  65  68.000   8.540  -3.867
  492    HG1  THR  65           HG1      THR  65  68.503   9.028  -1.759
  493   HG21  THR  65          HG21      THR  65  66.371   7.656  -2.344
  494   HG22  THR  65          HG22      THR  65  67.419   6.305  -1.913
  495   HG23  THR  65          HG23      THR  65  66.702   6.386  -3.522
  496    H    VAL  66           HN       VAL  66  69.115   8.140  -6.157
  497    HA   VAL  66           HA       VAL  66  67.293   6.194  -7.476
  498    HB   VAL  66           HB       VAL  66  67.252   8.078  -9.254
  499   HG11  VAL  66          HG11      VAL  66  65.601   9.344  -7.940
  500   HG12  VAL  66          HG12      VAL  66  66.222   8.627  -6.453
  501   HG13  VAL  66          HG13      VAL  66  65.419   7.614  -7.653
  502   HG21  VAL  66          HG21      VAL  66  67.931  10.279  -8.462
  503   HG22  VAL  66          HG22      VAL  66  69.314   9.190  -8.353
  504   HG23  VAL  66          HG23      VAL  66  68.405   9.608  -6.901
  505    H    ILE  67           HN       ILE  67  70.459   7.752  -7.909
  506    HA   ILE  67           HA       ILE  67  71.127   5.607  -9.886
  507    HB   ILE  67           HB       ILE  67  71.775   8.566 -10.087
  508   HG12  ILE  67          HG12      ILE  67  69.515   7.891 -10.862
  509   HG13  ILE  67          HG11      ILE  67  70.534   8.404 -12.207
  510   HG21  ILE  67          HG21      ILE  67  72.862   7.790 -12.276
  511   HG22  ILE  67          HG22      ILE  67  72.806   6.161 -11.603
  512   HG23  ILE  67          HG23      ILE  67  73.741   7.418 -10.793
  513   HD11  ILE  67          HD11      ILE  67  69.768   6.430 -13.104
  514   HD12  ILE  67          HD12      ILE  67  69.525   5.685 -11.523
  515   HD13  ILE  67          HD13      ILE  67  71.146   5.789 -12.209
  516    H1U  RCY  68           H1U      RCY  68  70.488   3.968  -1.608
  517    H1S  RCY  68           H1S      RCY  68  71.361   3.689  -5.762
  518    HB1  RCY  68           HB1      RCY  68  73.516   4.727  -5.728
  519    HB2  RCY  68           HB2      RCY  68  74.974   3.769  -5.983
  520    HA   RCY  68           HA       RCY  68  74.803   5.892  -7.377
  521    HN1  RCY  68           HN1      RCY  68  72.647   4.416  -8.840
  522    HA   PRO  69           HA       PRO  69  77.927   4.243 -10.025
  523    HB2  PRO  69           HB2      PRO  69  79.012   2.987  -7.522
  524    HB3  PRO  69           HB1      PRO  69  79.862   3.915  -8.773
  525    HG2  PRO  69           HG2      PRO  69  79.161   4.993  -6.420
  526    HG3  PRO  69           HG1      PRO  69  79.199   5.930  -7.921
  527    HD2  PRO  69           HD2      PRO  69  76.867   5.067  -6.333
  528    HD3  PRO  69           HD1      PRO  69  76.978   6.341  -7.566
  529    H    TRP  70           HN       TRP  70  76.212   2.159  -7.790
  530    HA   TRP  70           HA       TRP  70  77.110  -0.368  -8.803
  531    HD1  TRP  70           HD1      TRP  70  76.730  -2.670  -8.176
  532    HE1  TRP  70           HE1      TRP  70  75.185  -4.702  -8.526
  533    HE3  TRP  70           HE3      TRP  70  72.186  -0.453  -7.463
  534    HZ2  TRP  70           HZ2      TRP  70  72.385  -5.309  -8.507
  535    HZ3  TRP  70           HZ3      TRP  70  70.101  -1.777  -7.635
  536    HH2  TRP  70           HH2      TRP  70  70.192  -4.198  -8.154
  537    HB2  TRP  70           HB2      TRP  70  75.930  -0.231  -6.677
  538    HB3  TRP  70           HB1      TRP  70  74.501   0.425  -7.475
  539    H    GLU  71           HN       GLU  71  74.423   1.771  -9.721
  540    HA   GLU  71           HA       GLU  71  73.175   0.037 -11.593
  541    HB2  GLU  71           HB2      GLU  71  73.337   3.024 -11.275
  542    HB3  GLU  71           HB1      GLU  71  72.582   2.347 -12.719
  543    HG2  GLU  71           HG2      GLU  71  71.089   0.985 -11.263
  544    HG3  GLU  71           HG1      GLU  71  71.801   1.760  -9.848
  545    H    ALA  72           HN       ALA  72  75.992   2.155 -11.903
  546    HA   ALA  72           HA       ALA  72  76.227   1.744 -14.780
  547    HB1  ALA  72           HB1      ALA  72  78.325   2.948 -14.580
  548    HB2  ALA  72           HB2      ALA  72  78.336   2.717 -12.832
  549    HB3  ALA  72           HB3      ALA  72  77.123   3.759 -13.575
  550    H1U  RCY  73           H1U      RCY  73  77.684  -2.279  -5.826
  551    H1S  RCY  73           H1S      RCY  73  80.487  -0.895  -8.361
  552    HB1  RCY  73           HB1      RCY  73  79.246  -2.818 -11.104
  553    HB2  RCY  73           HB2      RCY  73  78.095  -1.591 -10.575
  554    HA   RCY  73           HA       RCY  73  79.571  -1.310 -13.190
  555    HN1  RCY  73           HN1      RCY  73  77.515   0.219 -11.877
  556    H    ASN  74           HN       ASN  74  76.212  -2.096 -12.265
  557    HA   ASN  74           HA       ASN  74  74.735  -3.648 -13.232
  558    HB2  ASN  74           HB2      ASN  74  76.147  -2.884 -15.366
  559    HB3  ASN  74           HB1      ASN  74  76.778  -4.526 -15.243
  560   HD21  ASN  74          HD21      ASN  74  75.532  -6.094 -16.272
  561   HD22  ASN  74          HD22      ASN  74  73.885  -5.935 -16.652
  562    H    HIS  75           HN       HIS  75  74.825  -6.168 -13.848
  563    HA   HIS  75           HA       HIS  75  75.255  -8.309 -12.991
  564    HD1  HIS  75           HD1      HIS  75  76.540 -10.263 -14.391
  565    HD2  HIS  75           HD2      HIS  75  78.893  -9.500 -11.033
  566    HE1  HIS  75           HE1      HIS  75  77.270 -12.519 -13.501
  567    HE2  HIS  75           HE2      HIS  75  78.703 -12.069 -11.457
  568    HB2  HIS  75           HB2      HIS  75  77.463  -7.729 -14.147
  569    HB3  HIS  75           HB1      HIS  75  78.077  -7.310 -12.548
  570    H1U  RCY  76           H1U      RCY  76  75.858  -1.413  -3.820
  571    H1S  RCY  76           H1S      RCY  76  77.608  -3.715  -6.651
  572    HB1  RCY  76           HB1      RCY  76  75.313  -6.547  -8.336
  573    HB2  RCY  76           HB2      RCY  76  76.538  -5.665  -9.246
  574    HA   RCY  76           HA       RCY  76  78.000  -7.821  -8.607
  575    HN1  RCY  76           HN1      RCY  76  77.785  -8.058 -10.938
  576    H    GLU  77           HN       GLU  77  76.189  -9.862 -10.153
  577    HA   GLU  77           HA       GLU  77  74.138 -10.707  -8.352
  578    HB2  GLU  77           HB2      GLU  77  74.489 -11.461 -10.765
  579    HB3  GLU  77           HB1      GLU  77  75.745 -12.536 -10.150
  580    HG2  GLU  77           HG2      GLU  77  73.738 -13.839 -10.226
  581    HG3  GLU  77           HG1      GLU  77  74.000 -13.442  -8.528
  582    H    LEU  78           HN       LEU  78  77.607 -11.365  -8.469
  583    HA   LEU  78           HA       LEU  78  77.808 -13.560  -6.748
  584    HG   LEU  78           HG       LEU  78  79.245 -13.220  -8.722
  585    HB2  LEU  78           HB2      LEU  78  79.545 -11.126  -7.117
  586    HB3  LEU  78           HB1      LEU  78  79.974 -12.370  -5.942
  587   HD11  LEU  78          HD11      LEU  78  81.942 -12.105  -7.890
  588   HD12  LEU  78          HD12      LEU  78  80.846 -11.388  -9.071
  589   HD13  LEU  78          HD13      LEU  78  81.612 -12.940  -9.408
  590   HD21  LEU  78          HD21      LEU  78  80.902 -14.980  -8.192
  591   HD22  LEU  78          HD22      LEU  78  79.657 -14.885  -6.947
  592   HD23  LEU  78          HD23      LEU  78  81.250 -14.186  -6.656
  593    H    HIS  79           HN       HIS  79  78.010 -13.738  -4.433
  594    HA   HIS  79           HA       HIS  79  77.613 -11.466  -2.688
  595    HD1  HIS  79           HD1      HIS  79  73.700 -13.268  -1.094
  596    HD2  HIS  79           HD2      HIS  79  76.444 -10.128  -1.004
  597    HE1  HIS  79           HE1      HIS  79  73.344 -12.070   1.109
  598    HE2  HIS  79           HE2      HIS  79  75.009 -10.156   1.176
  599    HB2  HIS  79           HB2      HIS  79  75.322 -11.670  -3.638
  600    HB3  HIS  79           HB1      HIS  79  75.251 -13.334  -3.059
  601    H    GLU  80           HN       GLU  80  79.205 -14.008  -3.042
  602    HA   GLU  80           HA       GLU  80  78.486 -15.475  -0.554
  603    HB2  GLU  80           HB2      GLU  80  80.745 -16.158  -2.440
  604    HB3  GLU  80           HB1      GLU  80  79.891 -17.223  -1.323
  605    HG2  GLU  80           HG2      GLU  80  78.955 -17.770  -3.416
  606    HG3  GLU  80           HG1      GLU  80  77.781 -16.649  -2.725
  607    H    LEU  81           HN       LEU  81  81.118 -13.592  -2.006
  608    HA   LEU  81           HA       LEU  81  83.100 -13.919  -0.055
  609    HG   LEU  81           HG       LEU  81  83.751 -11.992  -3.254
  610    HB2  LEU  81           HB2      LEU  81  82.588 -11.154  -1.103
  611    HB3  LEU  81           HB1      LEU  81  84.114 -12.007  -0.909
  612   HD11  LEU  81          HD11      LEU  81  82.431 -14.612  -2.660
  613   HD12  LEU  81          HD12      LEU  81  84.036 -14.314  -1.993
  614   HD13  LEU  81          HD13      LEU  81  83.781 -14.258  -3.737
  615   HD21  LEU  81          HD21      LEU  81  81.239 -13.196  -3.680
  616   HD22  LEU  81          HD22      LEU  81  81.670 -11.513  -3.983
  617   HD23  LEU  81          HD23      LEU  81  80.971 -11.979  -2.432
  618    H    ALA  82           HN       ALA  82  80.008 -12.433   0.263
  619    HA   ALA  82           HA       ALA  82  80.352 -10.503   2.244
  620    HB1  ALA  82           HB1      ALA  82  78.106 -11.224   3.108
  621    HB2  ALA  82           HB2      ALA  82  78.198 -12.630   2.047
  622    HB3  ALA  82           HB3      ALA  82  78.145 -11.008   1.358
  623    H    GLN  83           HN       GLN  83  80.573 -14.012   2.574
  624    HA   GLN  83           HA       GLN  83  80.457 -14.330   5.347
  625    HB2  GLN  83           HB2      GLN  83  82.170 -15.651   3.245
  626    HB3  GLN  83           HB1      GLN  83  82.319 -16.104   4.943
  627    HG2  GLN  83           HG2      GLN  83  79.651 -16.046   3.522
  628    HG3  GLN  83           HG1      GLN  83  80.671 -17.485   3.549
  629   HE21  GLN  83          HE21      GLN  83  81.258 -15.826   6.405
  630   HE22  GLN  83          HE22      GLN  83  80.160 -16.636   7.414
  631    H    TYR  84           HN       TYR  84  82.930 -12.767   3.433
  632    HA   TYR  84           HA       TYR  84  84.148 -11.702   5.879
  633    HD1  TYR  84           HD2      TYR  84  85.362 -12.686   7.660
  634    HD2  TYR  84           HD1      TYR  84  85.163 -15.719   4.624
  635    HE1  TYR  84           HE2      TYR  84  84.936 -14.400   9.400
  636    HE2  TYR  84           HE1      TYR  84  84.736 -17.433   6.365
  637    HH   TYR  84           HH       TYR  84  84.117 -16.555   9.694
  638    HB2  TYR  84           HB2      TYR  84  85.684 -13.531   4.013
  639    HB3  TYR  84           HB1      TYR  84  86.443 -12.496   5.221
  640    H    GLY  85           HN       GLY  85  85.135  -9.727   5.465
  641    HA2  GLY  85           HA2      GLY  85  84.640  -8.496   2.892
  642    HA3  GLY  85           HA1      GLY  85  85.509  -7.755   4.236
  643    H    ILE  86           HN       ILE  86  85.841  -9.203   1.176
  644    HA   ILE  86           HA       ILE  86  88.814  -9.099   1.443
  645    HB   ILE  86           HB       ILE  86  87.170 -11.304   0.159
  646   HG12  ILE  86          HG12      ILE  86  87.547 -11.474   2.608
  647   HG13  ILE  86          HG11      ILE  86  88.406 -12.739   1.729
  648   HG21  ILE  86          HG21      ILE  86  90.075 -10.544  -0.107
  649   HG22  ILE  86          HG22      ILE  86  88.929 -10.982  -1.374
  650   HG23  ILE  86          HG23      ILE  86  89.562 -12.221  -0.291
  651   HD11  ILE  86          HD11      ILE  86  90.298 -10.794   1.729
  652   HD12  ILE  86          HD12      ILE  86  90.180 -12.029   2.982
  653   HD13  ILE  86          HD13      ILE  86  89.481 -10.432   3.249
  654    H1U  RCY  87           H1U      RCY  87  79.125  -7.586  -2.337
  655    H1S  RCY  87           H1S      RCY  87  83.221  -8.320  -0.740
  656    HB1  RCY  87           HB1      RCY  87  86.062  -9.537  -3.953
  657    HB2  RCY  87           HB2      RCY  87  85.127  -8.043  -3.937
  658    HA   RCY  87           HA       RCY  87  87.655  -8.171  -3.008
  659    HN1  RCY  87           HN1      RCY  87  86.088  -9.365  -0.849
  Start of MODEL    7
    1    HA   MET   1           HA       MET   1  51.734  13.723  11.229
    2    HB2  MET   1           HB2      MET   1  53.059  11.109  11.975
    3    HB3  MET   1           HB1      MET   1  52.670  11.520  10.304
    4    HG2  MET   1           HG2      MET   1  54.264  13.367  12.090
    5    HG3  MET   1           HG1      MET   1  55.028  12.131  11.090
    6    HE1  MET   1           HE1      MET   1  55.946  14.785  10.912
    7    HE2  MET   1           HE2      MET   1  54.515  15.792  11.112
    8    HE3  MET   1           HE3      MET   1  55.413  15.839   9.597
    9    H    ASN   2           HN       ASN   2  50.351  12.666   9.623
   10    HA   ASN   2           HA       ASN   2  47.952  11.519  10.858
   11    HB2  ASN   2           HB2      ASN   2  47.032  11.607   8.563
   12    HB3  ASN   2           HB1      ASN   2  47.750  13.151   9.020
   13   HD21  ASN   2          HD21      ASN   2  50.273  13.211   8.414
   14   HD22  ASN   2          HD22      ASN   2  50.644  12.637   6.861
   15    H    LEU   3           HN       LEU   3  50.727  10.091  10.443
   16    HA   LEU   3           HA       LEU   3  49.614   7.447  10.124
   17    HG   LEU   3           HG       LEU   3  50.867   5.839   8.827
   18    HB2  LEU   3           HB2      LEU   3  49.570   8.039   7.762
   19    HB3  LEU   3           HB1      LEU   3  51.247   8.576   7.831
   20   HD11  LEU   3          HD11      LEU   3  50.541   4.861   6.570
   21   HD12  LEU   3          HD12      LEU   3  50.294   6.481   5.918
   22   HD13  LEU   3          HD13      LEU   3  49.144   5.811   7.076
   23   HD21  LEU   3          HD21      LEU   3  52.801   5.468   7.294
   24   HD22  LEU   3          HD22      LEU   3  53.068   6.821   8.393
   25   HD23  LEU   3          HD23      LEU   3  52.626   7.124   6.713
   26    H    GLU   4           HN       GLU   4  50.861   6.315  11.523
   27    HA   GLU   4           HA       GLU   4  53.647   7.213  12.015
   28    HB2  GLU   4           HB2      GLU   4  51.803   5.309  13.481
   29    HB3  GLU   4           HB1      GLU   4  53.488   5.562  13.936
   30    HG2  GLU   4           HG2      GLU   4  51.474   7.811  13.691
   31    HG3  GLU   4           HG1      GLU   4  51.837   6.993  15.211
   32    HA   PRO   5           HA       PRO   5  55.825   4.153   9.692
   33    HB2  PRO   5           HB2      PRO   5  56.834   3.250  12.372
   34    HB3  PRO   5           HB1      PRO   5  57.737   3.541  10.872
   35    HG2  PRO   5           HG2      PRO   5  57.682   5.319  12.881
   36    HG3  PRO   5           HG1      PRO   5  57.787   5.806  11.182
   37    HD2  PRO   5           HD2      PRO   5  55.543   6.130  13.062
   38    HD3  PRO   5           HD1      PRO   5  55.830   6.939  11.507
   39    HA   PRO   6           HA       PRO   6  52.921   0.762  10.703
   40    HB2  PRO   6           HB2      PRO   6  52.472  -0.064   8.161
   41    HB3  PRO   6           HB1      PRO   6  51.699   1.385   8.833
   42    HG2  PRO   6           HG2      PRO   6  54.009   1.166   6.980
   43    HG3  PRO   6           HG1      PRO   6  52.710   2.367   7.032
   44    HD2  PRO   6           HD2      PRO   6  55.281   2.752   8.050
   45    HD3  PRO   6           HD1      PRO   6  53.852   3.706   8.501
   46    H    LYS   7           HN       LYS   7  53.055  -1.615  10.419
   47    HA   LYS   7           HA       LYS   7  55.638  -2.620   9.335
   48    HB2  LYS   7           HB2      LYS   7  56.057  -3.916  11.377
   49    HB3  LYS   7           HB1      LYS   7  55.976  -2.195  11.754
   50    HG2  LYS   7           HG2      LYS   7  53.352  -2.900  12.025
   51    HG3  LYS   7           HG1      LYS   7  54.152  -4.383  12.548
   52    HD2  LYS   7           HD2      LYS   7  54.804  -1.619  13.611
   53    HD3  LYS   7           HD1      LYS   7  53.757  -2.781  14.427
   54    HE2  LYS   7           HE2      LYS   7  55.551  -4.333  14.725
   55    HE3  LYS   7           HE1      LYS   7  56.596  -3.442  13.618
   56    HZ1  LYS   7           HZ1      LYS   7  55.584  -1.889  15.832
   57    HZ2  LYS   7           HZ2      LYS   7  57.156  -1.979  15.194
   58    HZ3  LYS   7           HZ3      LYS   7  56.611  -3.160  16.288
   59    H    ALA   8           HN       ALA   8  53.272  -2.972   8.022
   60    HA   ALA   8           HA       ALA   8  53.039  -5.818   7.857
   61    HB1  ALA   8           HB1      ALA   8  50.903  -4.364   9.427
   62    HB2  ALA   8           HB2      ALA   8  51.805  -5.806   9.894
   63    HB3  ALA   8           HB3      ALA   8  50.588  -5.901   8.622
   64    H    GLU   9           HN       GLU   9  53.480  -4.341   5.779
   65    HA   GLU   9           HA       GLU   9  51.119  -4.595   4.128
   66    HB2  GLU   9           HB2      GLU   9  51.221  -2.044   3.523
   67    HB3  GLU   9           HB1      GLU   9  50.316  -2.554   4.948
   68    HG2  GLU   9           HG2      GLU   9  52.165  -1.990   6.405
   69    HG3  GLU   9           HG1      GLU   9  53.211  -1.663   5.023
   70    H1U  RCY  10           H1U      RCY  10  58.735  -9.754   3.195
   71    H1S  RCY  10           H1S      RCY  10  57.221  -5.748   4.640
   72    HB1  RCY  10           HB1      RCY  10  55.725  -5.882   0.877
   73    HB2  RCY  10           HB2      RCY  10  54.719  -6.642   2.111
   74    HA   RCY  10           HA       RCY  10  54.207  -3.862   1.017
   75    HN1  RCY  10           HN1      RCY  10  52.114  -5.430   2.361
   76    H    ARG  11           HN       ARG  11  53.410  -7.326   0.788
   77    HA   ARG  11           HA       ARG  11  52.602  -8.556  -1.042
   78    HE   ARG  11           HE       ARG  11  47.980 -10.161  -0.301
   79    HB2  ARG  11           HB2      ARG  11  50.893  -6.080  -0.973
   80    HB3  ARG  11           HB1      ARG  11  50.675  -7.257  -2.267
   81    HG2  ARG  11           HG2      ARG  11  50.807  -8.253   0.555
   82    HG3  ARG  11           HG1      ARG  11  49.319  -7.481   0.005
   83    HD2  ARG  11           HD2      ARG  11  49.261  -9.040  -1.936
   84    HD3  ARG  11           HD1      ARG  11  50.695  -9.847  -1.301
   85   HH11  ARG  11          HH21      ARG  11  51.346 -10.176   0.445
   86   HH12  ARG  11          HH22      ARG  11  51.178 -11.244   1.798
   87   HH21  ARG  11          HH11      ARG  11  47.741 -11.557   1.461
   88   HH22  ARG  11          HH12      ARG  11  49.136 -12.026   2.373
   89    H    SER  12           HN       SER  12  54.602  -8.461  -2.227
   90    HA   SER  12           HA       SER  12  54.389  -7.430  -4.873
   91    HG   SER  12           HG       SER  12  54.505  -4.270  -3.704
   92    HB2  SER  12           HB2      SER  12  55.804  -5.693  -2.875
   93    HB3  SER  12           HB1      SER  12  56.419  -5.773  -4.524
   94    H    ALA  13           HN       ALA  13  55.891  -8.501  -6.134
   95    HA   ALA  13           HA       ALA  13  58.521  -9.229  -5.248
   96    HB1  ALA  13           HB1      ALA  13  57.471 -10.815  -3.786
   97    HB2  ALA  13           HB2      ALA  13  58.077 -11.735  -5.163
   98    HB3  ALA  13           HB3      ALA  13  56.362 -11.341  -5.052
   99    H    THR  14           HN       THR  14  56.528 -11.551  -6.969
  100    HA   THR  14           HA       THR  14  56.626 -12.279  -9.196
  101    HB   THR  14           HB       THR  14  56.344 -10.614 -10.846
  102    HG1  THR  14           HG1      THR  14  57.390  -8.574  -9.256
  103   HG21  THR  14          HG21      THR  14  54.661 -10.534  -8.963
  104   HG22  THR  14          HG22      THR  14  54.812  -9.031  -9.874
  105   HG23  THR  14          HG23      THR  14  55.576  -9.183  -8.291
  106    H    ARG  15           HN       ARG  15  59.235 -11.388  -7.507
  107    HA   ARG  15           HA       ARG  15  61.561 -11.447  -7.878
  108    HE   ARG  15           HE       ARG  15  60.657 -15.866  -6.002
  109    HB2  ARG  15           HB2      ARG  15  60.515 -13.570  -9.768
  110    HB3  ARG  15           HB1      ARG  15  62.229 -13.345  -9.419
  111    HG2  ARG  15           HG2      ARG  15  61.911 -13.839  -7.094
  112    HG3  ARG  15           HG1      ARG  15  60.156 -13.770  -7.256
  113    HD2  ARG  15           HD2      ARG  15  60.287 -15.715  -8.839
  114    HD3  ARG  15           HD1      ARG  15  62.010 -15.832  -8.481
  115   HH11  ARG  15          HH21      ARG  15  60.893 -17.687  -8.919
  116   HH12  ARG  15          HH22      ARG  15  60.563 -19.206  -8.155
  117   HH21  ARG  15          HH11      ARG  15  60.225 -17.839  -4.986
  118   HH22  ARG  15          HH12      ARG  15  60.185 -19.292  -5.928
  119    H    VAL  16           HN       VAL  16  61.779  -9.331  -8.800
  120    HA   VAL  16           HA       VAL  16  61.639  -9.103 -11.750
  121    HB   VAL  16           HB       VAL  16  62.386  -6.675 -11.114
  122   HG11  VAL  16          HG11      VAL  16  60.037  -6.097 -10.586
  123   HG12  VAL  16          HG12      VAL  16  59.700  -7.797 -10.259
  124   HG13  VAL  16          HG13      VAL  16  60.129  -7.281 -11.890
  125   HG21  VAL  16          HG21      VAL  16  61.250  -7.546  -8.451
  126   HG22  VAL  16          HG22      VAL  16  62.035  -6.018  -8.853
  127   HG23  VAL  16          HG23      VAL  16  62.987  -7.499  -8.751
  128    H    MET  17           HN       MET  17  63.982  -7.103 -10.286
  129    HA   MET  17           HA       MET  17  66.300  -6.966 -10.650
  130    HB2  MET  17           HB2      MET  17  66.070  -9.953 -10.169
  131    HB3  MET  17           HB1      MET  17  67.552  -9.002 -10.053
  132    HG2  MET  17           HG2      MET  17  66.556  -7.653  -8.248
  133    HG3  MET  17           HG1      MET  17  65.064  -8.587  -8.367
  134    HE1  MET  17           HE1      MET  17  66.588  -8.298  -5.580
  135    HE2  MET  17           HE2      MET  17  66.260  -9.944  -5.046
  136    HE3  MET  17           HE3      MET  17  65.050  -9.070  -5.982
  137    H    GLY  18           HN       GLY  18  65.837  -6.458 -12.954
  138    HA2  GLY  18           HA2      GLY  18  67.251  -7.050 -14.976
  139    HA3  GLY  18           HA1      GLY  18  66.642  -8.694 -14.776
  140    H    GLY  19           HN       GLY  19  65.670  -5.377 -15.565
  141    HA2  GLY  19           HA2      GLY  19  64.043  -5.910 -17.721
  142    HA3  GLY  19           HA1      GLY  19  62.972  -6.179 -16.345
  143    HA   PRO  20           HA       PRO  20  61.866  -1.850 -16.903
  144    HB2  PRO  20           HB2      PRO  20  61.260  -2.224 -13.986
  145    HB3  PRO  20           HB1      PRO  20  60.279  -1.454 -15.250
  146    HG2  PRO  20           HG2      PRO  20  59.755  -3.921 -14.383
  147    HG3  PRO  20           HG1      PRO  20  59.533  -3.465 -16.079
  148    HD2  PRO  20           HD2      PRO  20  61.613  -5.205 -14.867
  149    HD3  PRO  20           HD1      PRO  20  60.998  -5.176 -16.534
  150    H1U  RCY  21           H1U      RCY  21  68.136  -1.927  -6.298
  151    H1S  RCY  21           H1S      RCY  21  66.485  -0.157 -10.409
  152    HB1  RCY  21           HB1      RCY  21  66.378  -3.224 -13.418
  153    HB2  RCY  21           HB2      RCY  21  65.216  -2.655 -12.219
  154    HA   RCY  21           HA       RCY  21  64.971  -0.537 -13.520
  155    HN1  RCY  21           HN1      RCY  21  64.056  -3.119 -14.485
  156    H    THR  22           HN       THR  22  66.075   0.849 -14.816
  157    HA   THR  22           HA       THR  22  67.368   0.016 -17.258
  158    HB   THR  22           HB       THR  22  68.008   2.320 -17.497
  159    HG1  THR  22           HG1      THR  22  67.532   2.409 -14.710
  160   HG21  THR  22          HG21      THR  22  65.896   3.414 -17.268
  161   HG22  THR  22          HG22      THR  22  65.427   2.373 -15.924
  162   HG23  THR  22          HG23      THR  22  65.532   1.712 -17.555
  163    HA   PRO  23           HA       PRO  23  71.057  -1.673 -15.241
  164    HB2  PRO  23           HB2      PRO  23  72.151  -0.982 -17.948
  165    HB3  PRO  23           HB1      PRO  23  72.344  -2.472 -17.002
  166    HG2  PRO  23           HG2      PRO  23  70.649  -2.330 -19.055
  167    HG3  PRO  23           HG1      PRO  23  70.276  -3.278 -17.606
  168    HD2  PRO  23           HD2      PRO  23  69.100  -0.702 -18.514
  169    HD3  PRO  23           HD1      PRO  23  68.398  -1.958 -17.471
  170    H    ARG  24           HN       ARG  24  73.095  -0.811 -14.509
  171    HA   ARG  24           HA       ARG  24  74.400   0.954 -13.665
  172    HE   ARG  24           HE       ARG  24  76.645  -0.754 -18.367
  173    HB2  ARG  24           HB2      ARG  24  74.035   1.712 -16.576
  174    HB3  ARG  24           HB1      ARG  24  75.083   2.616 -15.486
  175    HG2  ARG  24           HG2      ARG  24  76.594   1.087 -16.387
  176    HG3  ARG  24           HG1      ARG  24  76.072   0.231 -14.936
  177    HD2  ARG  24           HD2      ARG  24  75.556  -1.473 -16.340
  178    HD3  ARG  24           HD1      ARG  24  74.152  -0.501 -16.780
  179   HH11  ARG  24          HH21      ARG  24  73.519   0.595 -17.828
  180   HH12  ARG  24          HH22      ARG  24  73.329   1.149 -19.458
  181   HH21  ARG  24          HH11      ARG  24  76.416  -0.039 -20.500
  182   HH22  ARG  24          HH12      ARG  24  74.970   0.789 -20.971
  183    H    LYS  25           HN       LYS  25  73.530   3.530 -15.589
  184    HA   LYS  25           HA       LYS  25  72.506   5.159 -13.587
  185    HB2  LYS  25           HB2      LYS  25  71.347   6.432 -15.433
  186    HB3  LYS  25           HB1      LYS  25  73.052   6.106 -15.740
  187    HG2  LYS  25           HG2      LYS  25  71.267   3.964 -16.673
  188    HG3  LYS  25           HG1      LYS  25  70.994   5.508 -17.481
  189    HD2  LYS  25           HD2      LYS  25  73.276   5.647 -18.190
  190    HD3  LYS  25           HD1      LYS  25  73.751   4.309 -17.142
  191    HE2  LYS  25           HE2      LYS  25  73.412   3.798 -19.658
  192    HE3  LYS  25           HE1      LYS  25  72.661   2.707 -18.493
  193    HZ1  LYS  25           HZ1      LYS  25  70.599   3.427 -19.003
  194    HZ2  LYS  25           HZ2      LYS  25  71.329   3.807 -20.489
  195    HZ3  LYS  25           HZ3      LYS  25  71.095   5.018 -19.321
  196    H    GLY  26           HN       GLY  26  70.408   5.644 -12.808
  197    HA2  GLY  26           HA2      GLY  26  67.918   4.916 -13.640
  198    HA3  GLY  26           HA1      GLY  26  68.514   3.404 -12.955
  199    HA   PRO  27           HA       PRO  27  67.901   4.448  -8.728
  200    HB2  PRO  27           HB2      PRO  27  70.760   5.237  -8.328
  201    HB3  PRO  27           HB1      PRO  27  69.767   4.093  -7.403
  202    HG2  PRO  27           HG2      PRO  27  71.610   3.257  -9.133
  203    HG3  PRO  27           HG1      PRO  27  70.078   2.393  -8.917
  204    HD2  PRO  27           HD2      PRO  27  70.961   4.117 -11.186
  205    HD3  PRO  27           HD1      PRO  27  69.844   2.734 -11.185
  206    HA   PRO  28           HA       PRO  28  66.873   8.773  -8.522
  207    HB2  PRO  28           HB2      PRO  28  67.799   8.507  -5.678
  208    HB3  PRO  28           HB1      PRO  28  66.316   9.247  -6.313
  209    HG2  PRO  28           HG2      PRO  28  66.335   6.801  -5.218
  210    HG3  PRO  28           HG1      PRO  28  65.253   7.235  -6.550
  211    HD2  PRO  28           HD2      PRO  28  67.597   5.438  -6.574
  212    HD3  PRO  28           HD1      PRO  28  66.249   5.544  -7.726
  213    H    LYS  29           HN       LYS  29  67.923  10.888  -8.123
  214    HA   LYS  29           HA       LYS  29  70.906  10.687  -8.226
  215    HB2  LYS  29           HB2      LYS  29  69.031  12.842  -9.254
  216    HB3  LYS  29           HB1      LYS  29  70.791  12.906  -9.349
  217    HG2  LYS  29           HG2      LYS  29  70.898  11.113 -10.873
  218    HG3  LYS  29           HG1      LYS  29  69.273  10.557 -10.471
  219    HD2  LYS  29           HD2      LYS  29  69.260  11.679 -12.653
  220    HD3  LYS  29           HD1      LYS  29  68.336  12.621 -11.482
  221    HE2  LYS  29           HE2      LYS  29  69.943  13.967 -12.921
  222    HE3  LYS  29           HE1      LYS  29  70.139  14.176 -11.181
  223    HZ1  LYS  29           HZ1      LYS  29  72.016  12.817 -11.156
  224    HZ2  LYS  29           HZ2      LYS  29  72.220  13.767 -12.550
  225    HZ3  LYS  29           HZ3      LYS  29  71.689  12.159 -12.686
  226    H1U  RCY  30           H1U      RCY  30  71.787  10.174  -1.391
  227    H1S  RCY  30           H1S      RCY  30  69.982  11.752  -2.388
  228    HB1  RCY  30           HB1      RCY  30  68.353  11.062  -3.495
  229    HB2  RCY  30           HB2      RCY  30  67.357  12.376  -4.118
  230    HA   RCY  30           HA       RCY  30  69.359  13.625  -4.770
  231    HN1  RCY  30           HN1      RCY  30  68.778  11.042  -5.924
  232    H    LYS  31           HN       LYS  31  71.530  11.405  -5.474
  233    HA   LYS  31           HA       LYS  31  73.159  11.985  -3.040
  234    HB2  LYS  31           HB2      LYS  31  74.129   9.593  -3.464
  235    HB3  LYS  31           HB1      LYS  31  72.598   9.748  -2.603
  236    HG2  LYS  31           HG2      LYS  31  71.331   9.148  -4.512
  237    HG3  LYS  31           HG1      LYS  31  72.689   9.426  -5.603
  238    HD2  LYS  31           HD2      LYS  31  72.347   7.015  -5.263
  239    HD3  LYS  31           HD1      LYS  31  73.891   7.519  -4.577
  240    HE2  LYS  31           HE2      LYS  31  73.083   7.411  -2.364
  241    HE3  LYS  31           HE1      LYS  31  71.398   7.446  -2.884
  242    HZ1  LYS  31           HZ1      LYS  31  73.037   5.237  -3.850
  243    HZ2  LYS  31           HZ2      LYS  31  71.404   5.257  -3.383
  244    HZ3  LYS  31           HZ3      LYS  31  72.626   5.218  -2.204
  245    H    GLN  32           HN       GLN  32  74.749  13.269  -3.854
  246    HA   GLN  32           HA       GLN  32  75.642  13.122  -6.603
  247    HB2  GLN  32           HB2      GLN  32  76.913  14.455  -4.190
  248    HB3  GLN  32           HB1      GLN  32  77.392  14.720  -5.866
  249    HG2  GLN  32           HG2      GLN  32  75.198  15.618  -6.406
  250    HG3  GLN  32           HG1      GLN  32  74.603  15.229  -4.791
  251   HE21  GLN  32          HE21      GLN  32  74.786  17.937  -6.028
  252   HE22  GLN  32          HE22      GLN  32  75.799  18.845  -5.013
  253    H    ARG  33           HN       ARG  33  75.928  10.604  -6.117
  254    HA   ARG  33           HA       ARG  33  78.209   9.673  -4.700
  255    HE   ARG  33           HE       ARG  33  75.323   7.410 -10.033
  256    HB2  ARG  33           HB2      ARG  33  78.060   7.750  -6.466
  257    HB3  ARG  33           HB1      ARG  33  76.711   7.986  -5.355
  258    HG2  ARG  33           HG2      ARG  33  75.442   9.173  -7.016
  259    HG3  ARG  33           HG1      ARG  33  76.831   9.256  -8.100
  260    HD2  ARG  33           HD2      ARG  33  76.819   6.802  -8.319
  261    HD3  ARG  33           HD1      ARG  33  75.440   6.707  -7.223
  262   HH11  ARG  33          HH21      ARG  33  73.979   7.939  -6.903
  263   HH12  ARG  33          HH22      ARG  33  72.416   8.381  -7.503
  264   HH21  ARG  33          HH11      ARG  33  73.289   7.984 -10.835
  265   HH22  ARG  33          HH12      ARG  33  72.025   8.406  -9.729
  266    H    GLN  34           HN       GLN  34  79.735  11.448  -5.317
  267    HA   GLN  34           HA       GLN  34  81.604  10.549  -7.315
  268    HB2  GLN  34           HB2      GLN  34  79.842  11.546  -8.793
  269    HB3  GLN  34           HB1      GLN  34  80.088  13.091  -7.980
  270    HG2  GLN  34           HG2      GLN  34  82.388  13.192  -8.721
  271    HG3  GLN  34           HG1      GLN  34  82.299  11.553  -9.370
  272   HE21  GLN  34          HE21      GLN  34  82.766  12.311 -11.567
  273   HE22  GLN  34          HE22      GLN  34  81.606  13.162 -12.467
  274    H    THR  35           HN       THR  35  82.632  10.856  -5.096
  275    HA   THR  35           HA       THR  35  84.036  13.429  -5.064
  276    HB   THR  35           HB       THR  35  82.487  12.625  -2.591
  277    HG1  THR  35           HG1      THR  35  81.818  14.272  -4.767
  278   HG21  THR  35          HG21      THR  35  84.571  14.054  -2.411
  279   HG22  THR  35          HG22      THR  35  83.101  14.807  -1.791
  280   HG23  THR  35          HG23      THR  35  83.731  15.271  -3.372
  281    H    ARG  36           HN       ARG  36  83.481  10.220  -3.754
  282    HA   ARG  36           HA       ARG  36  84.911   8.761  -2.590
  283    HE   ARG  36           HE       ARG  36  88.948   6.383  -2.657
  284    HB2  ARG  36           HB2      ARG  36  85.998   9.198  -4.936
  285    HB3  ARG  36           HB1      ARG  36  87.192  10.114  -4.017
  286    HG2  ARG  36           HG2      ARG  36  86.423   7.232  -3.462
  287    HG3  ARG  36           HG1      ARG  36  87.872   7.739  -4.332
  288    HD2  ARG  36           HD2      ARG  36  88.322   9.203  -2.210
  289    HD3  ARG  36           HD1      ARG  36  87.194   8.100  -1.424
  290   HH11  ARG  36          HH21      ARG  36  89.265   9.158  -0.637
  291   HH12  ARG  36          HH22      ARG  36  90.745   8.625   0.090
  292   HH21  ARG  36          HH11      ARG  36  90.878   5.671  -1.720
  293   HH22  ARG  36          HH12      ARG  36  91.658   6.651  -0.524
  294    H    GLN  37           HN       GLN  37  84.765   9.550  -0.461
  295    HA   GLN  37           HA       GLN  37  87.124  11.138   0.431
  296    HB2  GLN  37           HB2      GLN  37  85.088  12.626   0.186
  297    HB3  GLN  37           HB1      GLN  37  84.312  11.657   1.438
  298    HG2  GLN  37           HG2      GLN  37  85.285  13.502   2.588
  299    HG3  GLN  37           HG1      GLN  37  86.373  12.145   2.882
  300   HE21  GLN  37          HE21      GLN  37  88.517  12.288   2.056
  301   HE22  GLN  37          HE22      GLN  37  89.093  13.625   1.183
  302    H1U  RCY  38           H1U      RCY  38  83.315   6.558   2.058
  303    H1S  RCY  38           H1S      RCY  38  82.926   8.061   0.391
  304    HB1  RCY  38           HB1      RCY  38  83.515   7.861   3.968
  305    HB2  RCY  38           HB2      RCY  38  84.985   6.891   4.025
  306    HA   RCY  38           HA       RCY  38  84.877   9.497   4.806
  307    HN1  RCY  38           HN1      RCY  38  84.723  10.726   2.792
  308    H    LYS  39           HN       LYS  39  87.510  10.248   3.444
  309    HA   LYS  39           HA       LYS  39  89.797   9.699   3.622
  310    HB2  LYS  39           HB2      LYS  39  88.515   9.277   6.289
  311    HB3  LYS  39           HB1      LYS  39  90.173   8.709   6.096
  312    HG2  LYS  39           HG2      LYS  39  90.164  11.027   6.905
  313    HG3  LYS  39           HG1      LYS  39  90.831  10.955   5.273
  314    HD2  LYS  39           HD2      LYS  39  88.644  11.610   4.343
  315    HD3  LYS  39           HD1      LYS  39  87.968  11.676   5.971
  316    HE2  LYS  39           HE2      LYS  39  89.585  13.436   6.577
  317    HE3  LYS  39           HE1      LYS  39  90.271  13.369   4.954
  318    HZ1  LYS  39           HZ1      LYS  39  88.193  14.069   4.033
  319    HZ2  LYS  39           HZ2      LYS  39  88.630  15.165   5.255
  320    HZ3  LYS  39           HZ3      LYS  39  87.431  13.997   5.547
  321    H    SER  40           HN       SER  40  88.824   7.816   2.058
  322    HA   SER  40           HA       SER  40  88.934   5.551   1.426
  323    HG   SER  40           HG       SER  40  91.846   6.570   3.614
  324    HB2  SER  40           HB2      SER  40  91.053   4.466   2.012
  325    HB3  SER  40           HB1      SER  40  91.340   6.152   1.595
  326    H    LYS  41           HN       LYS  41  90.522   4.372   4.193
  327    HA   LYS  41           HA       LYS  41  87.991   3.092   5.107
  328    HB2  LYS  41           HB2      LYS  41  89.814   1.577   4.464
  329    HB3  LYS  41           HB1      LYS  41  90.891   2.372   5.608
  330    HG2  LYS  41           HG2      LYS  41  88.605   1.703   7.104
  331    HG3  LYS  41           HG1      LYS  41  88.929   0.290   6.100
  332    HD2  LYS  41           HD2      LYS  41  91.076   1.683   7.716
  333    HD3  LYS  41           HD1      LYS  41  90.138   0.325   8.337
  334    HE2  LYS  41           HE2      LYS  41  90.902  -1.084   6.482
  335    HE3  LYS  41           HE1      LYS  41  91.795   0.274   5.797
  336    HZ1  LYS  41           HZ1      LYS  41  92.272  -0.922   8.473
  337    HZ2  LYS  41           HZ2      LYS  41  93.147   0.360   7.783
  338    HZ3  LYS  41           HZ3      LYS  41  93.224  -1.192   7.095
  339    HA   PRO  42           HA       PRO  42  88.671   5.992   8.554
  340    HB2  PRO  42           HB2      PRO  42  86.111   6.020   9.469
  341    HB3  PRO  42           HB1      PRO  42  86.620   6.934   8.036
  342    HG2  PRO  42           HG2      PRO  42  85.144   4.364   8.209
  343    HG3  PRO  42           HG1      PRO  42  84.965   5.696   7.058
  344    HD2  PRO  42           HD2      PRO  42  86.337   3.328   6.539
  345    HD3  PRO  42           HD1      PRO  42  86.565   4.848   5.648
  346    HA   PRO  43           HA       PRO  43  89.124   3.180  11.941
  347    HB2  PRO  43           HB2      PRO  43  88.627   4.805  14.103
  348    HB3  PRO  43           HB1      PRO  43  90.125   4.864  13.153
  349    HG2  PRO  43           HG2      PRO  43  87.741   6.640  13.031
  350    HG3  PRO  43           HG1      PRO  43  89.462   7.046  12.905
  351    HD2  PRO  43           HD2      PRO  43  87.827   6.867  10.721
  352    HD3  PRO  43           HD1      PRO  43  89.565   6.502  10.654
  353    H    LYS  44           HN       LYS  44  87.706   1.596  12.529
  354    HA   LYS  44           HA       LYS  44  84.851   2.288  12.933
  355    HB2  LYS  44           HB2      LYS  44  86.314  -0.351  12.656
  356    HB3  LYS  44           HB1      LYS  44  84.587  -0.228  12.993
  357    HG2  LYS  44           HG2      LYS  44  84.285   1.096  10.921
  358    HG3  LYS  44           HG1      LYS  44  86.006   0.926  10.575
  359    HD2  LYS  44           HD2      LYS  44  85.146  -0.842   9.337
  360    HD3  LYS  44           HD1      LYS  44  85.489  -1.651  10.867
  361    HE2  LYS  44           HE2      LYS  44  83.217  -2.197  10.038
  362    HE3  LYS  44           HE1      LYS  44  83.159  -1.337  11.577
  363    HZ1  LYS  44           HZ1      LYS  44  82.953   0.039   8.962
  364    HZ2  LYS  44           HZ2      LYS  44  82.594   0.662  10.501
  365    HZ3  LYS  44           HZ3      LYS  44  81.596  -0.526   9.808
  366    H    LYS  45           HN       LYS  45  83.875   2.207  14.925
  367    HA   LYS  45           HA       LYS  45  85.614   1.798  17.271
  368    HB2  LYS  45           HB2      LYS  45  82.805   2.825  16.860
  369    HB3  LYS  45           HB1      LYS  45  83.395   2.428  18.474
  370    HG2  LYS  45           HG2      LYS  45  85.103   4.152  16.719
  371    HG3  LYS  45           HG1      LYS  45  83.693   4.877  17.492
  372    HD2  LYS  45           HD2      LYS  45  84.495   4.391  19.668
  373    HD3  LYS  45           HD1      LYS  45  85.682   3.236  19.062
  374    HE2  LYS  45           HE2      LYS  45  86.796   5.331  19.682
  375    HE3  LYS  45           HE1      LYS  45  86.886   5.093  17.937
  376    HZ1  LYS  45           HZ1      LYS  45  86.028   7.339  19.083
  377    HZ2  LYS  45           HZ2      LYS  45  84.551   6.524  18.885
  378    HZ3  LYS  45           HZ3      LYS  45  85.543   6.829  17.540
  379    H    GLY  46           HN       GLY  46  82.762   0.319  15.762
  380    HA2  GLY  46           HA2      GLY  46  82.996  -2.280  16.096
  381    HA3  GLY  46           HA1      GLY  46  82.831  -1.851  17.800
  382    H    VAL  47           HN       VAL  47  80.816  -2.977  17.987
  383    HA   VAL  47           HA       VAL  47  78.579  -2.162  16.253
  384    HB   VAL  47           HB       VAL  47  78.785  -4.064  18.603
  385   HG11  VAL  47          HG11      VAL  47  76.560  -3.220  18.705
  386   HG12  VAL  47          HG12      VAL  47  76.439  -4.731  17.804
  387   HG13  VAL  47          HG13      VAL  47  76.411  -3.190  16.948
  388   HG21  VAL  47          HG21      VAL  47  78.301  -5.740  16.807
  389   HG22  VAL  47          HG22      VAL  47  79.816  -4.875  16.543
  390   HG23  VAL  47          HG23      VAL  47  78.378  -4.439  15.618
  391    H    GLN  48           HN       GLN  48  78.186   0.011  16.749
  392    HA   GLN  48           HA       GLN  48  76.936   0.480  19.405
  393    HB2  GLN  48           HB2      GLN  48  79.097   2.236  18.194
  394    HB3  GLN  48           HB1      GLN  48  78.133   2.656  19.610
  395    HG2  GLN  48           HG2      GLN  48  80.073   1.735  20.564
  396    HG3  GLN  48           HG1      GLN  48  78.957   0.369  20.556
  397   HE21  GLN  48          HE21      GLN  48  80.578  -1.285  20.310
  398   HE22  GLN  48          HE22      GLN  48  81.521  -1.434  18.907
  399    H    GLY  49           HN       GLY  49  77.095   0.977  16.027
  400    HA2  GLY  49           HA2      GLY  49  74.551   1.843  15.559
  401    HA3  GLY  49           HA1      GLY  49  75.361   3.346  16.006
  402    H1U  RCY  50           H1U      RCY  50  75.266   5.127   5.413
  403    H1S  RCY  50           H1S      RCY  50  73.570   3.229   9.442
  404    HB1  RCY  50           HB1      RCY  50  75.997   4.975  10.446
  405    HB2  RCY  50           HB2      RCY  50  75.689   5.802  11.972
  406    HA   RCY  50           HA       RCY  50  76.417   2.872  11.658
  407    HN1  RCY  50           HN1      RCY  50  75.491   4.376  14.026
  408    H    GLY  51           HN       GLY  51  77.441   6.102  11.619
  409    HA2  GLY  51           HA2      GLY  51  80.235   5.302  11.517
  410    HA3  GLY  51           HA1      GLY  51  79.629   6.954  11.391
  411    H    ASP  52           HN       ASP  52  79.827   8.264  13.164
  412    HA   ASP  52           HA       ASP  52  80.032   7.118  15.863
  413    HB2  ASP  52           HB2      ASP  52  82.343   6.889  15.121
  414    HB3  ASP  52           HB1      ASP  52  82.364   8.564  14.569
  415    H    ASP  53           HN       ASP  53  79.711   9.788  13.675
  416    HA   ASP  53           HA       ASP  53  78.193  11.321  15.582
  417    HB2  ASP  53           HB2      ASP  53  79.774  13.268  15.713
  418    HB3  ASP  53           HB1      ASP  53  80.362  11.834  16.556
  419    H    ILE  54           HN       ILE  54  80.023  11.192  12.575
  420    HA   ILE  54           HA       ILE  54  78.586  13.464  11.419
  421    HB   ILE  54           HB       ILE  54  80.954  12.861  10.808
  422   HG12  ILE  54          HG12      ILE  54  80.410  12.908   8.233
  423   HG13  ILE  54          HG11      ILE  54  78.746  13.108   8.783
  424   HG21  ILE  54          HG21      ILE  54  79.738  10.666   9.135
  425   HG22  ILE  54          HG22      ILE  54  80.318  10.346  10.770
  426   HG23  ILE  54          HG23      ILE  54  81.435  10.932   9.537
  427   HD11  ILE  54          HD11      ILE  54  81.043  14.846   9.721
  428   HD12  ILE  54          HD12      ILE  54  79.324  15.097  10.027
  429   HD13  ILE  54          HD13      ILE  54  79.965  15.281   8.394
  430    HA   PRO  55           HA       PRO  55  75.229  10.715  10.211
  431    HB2  PRO  55           HB2      PRO  55  73.635  12.560   9.013
  432    HB3  PRO  55           HB1      PRO  55  73.822  12.466  10.776
  433    HG2  PRO  55           HG2      PRO  55  75.090  14.344   8.847
  434    HG3  PRO  55           HG1      PRO  55  74.455  14.651  10.471
  435    HD2  PRO  55           HD2      PRO  55  77.141  14.317   9.909
  436    HD3  PRO  55           HD1      PRO  55  76.413  14.000  11.499
  437    H    GLY  56           HN       GLY  56  75.130   9.408   8.434
  438    HA2  GLY  56           HA2      GLY  56  75.647   8.620   6.272
  439    HA3  GLY  56           HA1      GLY  56  74.800  10.084   5.774
  440    H    MET  57           HN       MET  57  77.975   9.534   7.343
  441    HA   MET  57           HA       MET  57  80.060  10.497   6.829
  442    HB2  MET  57           HB2      MET  57  79.621   8.753   4.982
  443    HB3  MET  57           HB1      MET  57  79.226  10.126   3.949
  444    HG2  MET  57           HG2      MET  57  81.567   9.629   3.625
  445    HG3  MET  57           HG1      MET  57  81.466  11.121   4.559
  446    HE1  MET  57           HE1      MET  57  83.664  10.565   7.349
  447    HE2  MET  57           HE2      MET  57  82.202  11.456   6.934
  448    HE3  MET  57           HE3      MET  57  83.508  11.322   5.759
  449    H    GLU  58           HN       GLU  58  79.924  11.794   3.861
  450    HA   GLU  58           HA       GLU  58  78.466  14.259   4.400
  451    HB2  GLU  58           HB2      GLU  58  80.558  14.476   5.807
  452    HB3  GLU  58           HB1      GLU  58  81.491  14.423   4.310
  453    HG2  GLU  58           HG2      GLU  58  80.432  16.427   3.490
  454    HG3  GLU  58           HG1      GLU  58  79.270  16.420   4.818
  455    H    GLY  59           HN       GLY  59  80.072  12.092   2.364
  456    HA2  GLY  59           HA2      GLY  59  79.225  13.602   0.004
  457    HA3  GLY  59           HA1      GLY  59  80.975  13.438   0.149
  458    H1U  RCY  60           H1U      RCY  60  74.400  10.666  -2.173
  459    H1S  RCY  60           H1S      RCY  60  75.865   7.757   0.163
  460    HB1  RCY  60           HB1      RCY  60  78.443   7.919  -0.832
  461    HB2  RCY  60           HB2      RCY  60  78.362   9.611  -1.324
  462    HA   RCY  60           HA       RCY  60  80.050   8.491   0.936
  463    HN1  RCY  60           HN1      RCY  60  80.024  10.742   1.610
  464    H    GLY  61           HN       GLY  61  79.817   7.721  -1.961
  465    HA2  GLY  61           HA2      GLY  61  81.555   8.649  -3.795
  466    HA3  GLY  61           HA1      GLY  61  82.687   8.018  -2.597
  467    H    THR  62           HN       THR  62  80.013   7.096  -4.740
  468    HA   THR  62           HA       THR  62  81.258   4.437  -5.071
  469    HB   THR  62           HB       THR  62  79.098   3.274  -4.608
  470    HG1  THR  62           HG1      THR  62  78.156   5.681  -4.690
  471   HG21  THR  62          HG21      THR  62  80.948   3.624  -2.879
  472   HG22  THR  62          HG22      THR  62  79.347   3.257  -2.237
  473   HG23  THR  62          HG23      THR  62  79.946   4.916  -2.217
  474    H    ASP  63           HN       ASP  63  81.431   5.946  -7.121
  475    HA   ASP  63           HA       ASP  63  79.056   6.272  -8.736
  476    HB2  ASP  63           HB2      ASP  63  80.639   6.767 -10.563
  477    HB3  ASP  63           HB1      ASP  63  81.101   7.625  -9.092
  478    H    ILE  64           HN       ILE  64  79.551   3.559  -7.624
  479    HA   ILE  64           HA       ILE  64  79.660   1.313  -8.320
  480    HB   ILE  64           HB       ILE  64  78.094   2.466 -10.644
  481   HG12  ILE  64          HG12      ILE  64  76.224   1.531  -8.935
  482   HG13  ILE  64          HG11      ILE  64  77.448   2.035  -7.770
  483   HG21  ILE  64          HG21      ILE  64  78.251  -0.284  -9.379
  484   HG22  ILE  64          HG22      ILE  64  78.702   0.157 -11.026
  485   HG23  ILE  64          HG23      ILE  64  77.008   0.190 -10.537
  486   HD11  ILE  64          HD11      ILE  64  77.468   4.282  -8.659
  487   HD12  ILE  64          HD12      ILE  64  75.788   3.840  -8.358
  488   HD13  ILE  64          HD13      ILE  64  76.426   3.811 -10.002
  489    H    THR  65           HN       THR  65  82.035   1.611  -8.782
  490    HA   THR  65           HA       THR  65  82.891   2.090 -11.501
  491    HB   THR  65           HB       THR  65  84.312   0.707  -9.200
  492    HG1  THR  65           HG1      THR  65  84.822   2.649  -8.603
  493   HG21  THR  65          HG21      THR  65  85.709   0.054 -10.871
  494   HG22  THR  65          HG22      THR  65  86.247   1.733 -10.837
  495   HG23  THR  65          HG23      THR  65  85.039   1.218 -12.014
  496    H    VAL  66           HN       VAL  66  80.806   0.316 -11.615
  497    HA   VAL  66           HA       VAL  66  80.229  -1.678 -12.696
  498    HB   VAL  66           HB       VAL  66  83.117  -2.426 -13.022
  499   HG11  VAL  66          HG11      VAL  66  81.219  -3.786 -13.944
  500   HG12  VAL  66          HG12      VAL  66  82.326  -3.199 -15.185
  501   HG13  VAL  66          HG13      VAL  66  80.771  -2.403 -14.943
  502   HG21  VAL  66          HG21      VAL  66  81.810   0.062 -14.007
  503   HG22  VAL  66          HG22      VAL  66  82.780  -0.835 -15.176
  504   HG23  VAL  66          HG23      VAL  66  83.513  -0.258 -13.679
  505    H    ILE  67           HN       ILE  67  82.379  -1.511 -10.030
  506    HA   ILE  67           HA       ILE  67  81.456  -4.209  -9.150
  507    HB   ILE  67           HB       ILE  67  84.277  -3.176  -8.755
  508   HG12  ILE  67          HG12      ILE  67  83.223  -5.259 -10.697
  509   HG13  ILE  67          HG11      ILE  67  83.833  -3.664 -11.140
  510   HG21  ILE  67          HG21      ILE  67  83.350  -4.771  -7.055
  511   HG22  ILE  67          HG22      ILE  67  84.717  -5.429  -7.955
  512   HG23  ILE  67          HG23      ILE  67  83.075  -5.931  -8.355
  513   HD11  ILE  67          HD11      ILE  67  85.372  -5.965  -9.923
  514   HD12  ILE  67          HD12      ILE  67  86.004  -4.318  -9.962
  515   HD13  ILE  67          HD13      ILE  67  85.660  -5.167 -11.469
  516    H1U  RCY  68           H1U      RCY  68  76.708   2.206  -2.968
  517    H1S  RCY  68           H1S      RCY  68  77.433  -0.027  -4.645
  518    HB1  RCY  68           HB1      RCY  68  78.394  -1.915  -5.053
  519    HB2  RCY  68           HB2      RCY  68  78.431  -1.897  -6.815
  520    HA   RCY  68           HA       RCY  68  81.058  -1.301  -5.714
  521    HN1  RCY  68           HN1      RCY  68  79.963  -3.185  -7.721
  522    HA   PRO  69           HA       PRO  69  81.809  -3.913  -2.256
  523    HB2  PRO  69           HB2      PRO  69  79.225  -2.887  -1.113
  524    HB3  PRO  69           HB1      PRO  69  80.809  -3.059  -0.330
  525    HG2  PRO  69           HG2      PRO  69  79.886  -0.702  -1.244
  526    HG3  PRO  69           HG1      PRO  69  81.607  -1.115  -1.213
  527    HD2  PRO  69           HD2      PRO  69  79.841  -0.775  -3.533
  528    HD3  PRO  69           HD1      PRO  69  81.615  -0.863  -3.480
  529    H    TRP  70           HN       TRP  70  78.550  -3.899  -3.614
  530    HA   TRP  70           HA       TRP  70  77.602  -6.336  -2.475
  531    HD1  TRP  70           HD1      TRP  70  75.583  -7.967  -3.250
  532    HE1  TRP  70           HE1      TRP  70  74.750  -9.564  -5.093
  533    HE3  TRP  70           HE3      TRP  70  76.673  -5.182  -7.388
  534    HZ2  TRP  70           HZ2      TRP  70  74.569  -9.650  -7.950
  535    HZ3  TRP  70           HZ3      TRP  70  76.162  -6.042  -9.652
  536    HH2  TRP  70           HH2      TRP  70  75.113  -8.268  -9.941
  537    HB2  TRP  70           HB2      TRP  70  75.942  -5.091  -3.564
  538    HB3  TRP  70           HB1      TRP  70  76.962  -4.771  -4.965
  539    H    GLU  71           HN       GLU  71  80.253  -5.830  -4.420
  540    HA   GLU  71           HA       GLU  71  80.276  -8.697  -5.251
  541    HB2  GLU  71           HB2      GLU  71  81.171  -6.355  -6.963
  542    HB3  GLU  71           HB1      GLU  71  81.302  -8.059  -7.397
  543    HG2  GLU  71           HG2      GLU  71  78.684  -6.668  -6.768
  544    HG3  GLU  71           HG1      GLU  71  79.298  -6.927  -8.401
  545    H    ALA  72           HN       ALA  72  82.133  -5.731  -4.632
  546    HA   ALA  72           HA       ALA  72  84.681  -7.142  -4.544
  547    HB1  ALA  72           HB1      ALA  72  85.471  -4.950  -3.513
  548    HB2  ALA  72           HB2      ALA  72  83.817  -4.367  -3.698
  549    HB3  ALA  72           HB3      ALA  72  84.758  -4.815  -5.121
  550    H1U  RCY  73           H1U      RCY  73  78.521  -1.828   1.906
  551    H1S  RCY  73           H1S      RCY  73  79.398  -6.525   1.735
  552    HB1  RCY  73           HB1      RCY  73  80.864  -7.300  -0.192
  553    HB2  RCY  73           HB2      RCY  73  81.326  -5.608  -0.006
  554    HA   RCY  73           HA       RCY  73  83.724  -6.384   0.211
  555    HN1  RCY  73           HN1      RCY  73  82.292  -6.044  -2.167
  556    H    ASN  74           HN       ASN  74  85.044  -8.105   0.602
  557    HA   ASN  74           HA       ASN  74  83.825 -10.789   0.700
  558    HB2  ASN  74           HB2      ASN  74  84.823 -10.420  -1.638
  559    HB3  ASN  74           HB1      ASN  74  86.398 -10.411  -0.842
  560   HD21  ASN  74          HD21      ASN  74  84.577 -12.468  -2.561
  561   HD22  ASN  74          HD22      ASN  74  84.913 -13.934  -1.774
  562    H    HIS  75           HN       HIS  75  84.770  -8.994   2.725
  563    HA   HIS  75           HA       HIS  75  86.455 -10.776   4.222
  564    HD1  HIS  75           HD1      HIS  75  89.009  -8.612   5.963
  565    HD2  HIS  75           HD2      HIS  75  89.394 -11.837   3.346
  566    HE1  HIS  75           HE1      HIS  75  90.713 -10.174   6.998
  567    HE2  HIS  75           HE2      HIS  75  90.956 -12.141   5.415
  568    HB2  HIS  75           HB2      HIS  75  87.999  -9.498   2.463
  569    HB3  HIS  75           HB1      HIS  75  87.900  -8.207   3.659
  570    H1U  RCY  76           H1U      RCY  76  82.918  -1.011   5.792
  571    H1S  RCY  76           H1S      RCY  76  86.483  -3.204   6.456
  572    HB1  RCY  76           HB1      RCY  76  85.286  -5.641   7.246
  573    HB2  RCY  76           HB2      RCY  76  85.050  -6.390   5.668
  574    HA   RCY  76           HA       RCY  76  87.084  -7.357   7.694
  575    HN1  RCY  76           HN1      RCY  76  87.682  -8.611   5.800
  576    H    GLU  77           HN       GLU  77  83.765  -7.563   6.491
  577    HA   GLU  77           HA       GLU  77  82.726  -8.433   9.006
  578    HB2  GLU  77           HB2      GLU  77  81.612  -8.476   6.195
  579    HB3  GLU  77           HB1      GLU  77  80.687  -9.069   7.574
  580    HG2  GLU  77           HG2      GLU  77  80.131  -6.722   7.158
  581    HG3  GLU  77           HG1      GLU  77  80.991  -6.866   8.691
  582    H    LEU  78           HN       LEU  78  81.632 -10.570   9.375
  583    HA   LEU  78           HA       LEU  78  82.541 -12.833   7.748
  584    HG   LEU  78           HG       LEU  78  83.054 -14.925   9.308
  585    HB2  LEU  78           HB2      LEU  78  84.466 -12.258   9.329
  586    HB3  LEU  78           HB1      LEU  78  83.397 -12.728  10.649
  587   HD11  LEU  78          HD11      LEU  78  85.477 -13.707   7.977
  588   HD12  LEU  78          HD12      LEU  78  84.042 -14.392   7.215
  589   HD13  LEU  78          HD13      LEU  78  85.212 -15.450   8.003
  590   HD21  LEU  78          HD21      LEU  78  85.151 -15.875  10.294
  591   HD22  LEU  78          HD22      LEU  78  84.265 -14.852  11.425
  592   HD23  LEU  78          HD23      LEU  78  85.703 -14.232  10.615
  593    H    HIS  79           HN       HIS  79  80.046 -12.562   7.801
  594    HA   HIS  79           HA       HIS  79  78.981 -14.630   9.530
  595    HD1  HIS  79           HD1      HIS  79  78.347 -11.536   7.837
  596    HD2  HIS  79           HD2      HIS  79  78.043 -10.121  11.749
  597    HE1  HIS  79           HE1      HIS  79  78.220  -9.012   7.677
  598    HE2  HIS  79           HE2      HIS  79  78.035  -8.138  10.052
  599    HB2  HIS  79           HB2      HIS  79  77.278 -13.115  10.627
  600    HB3  HIS  79           HB1      HIS  79  78.931 -12.889  11.199
  601    H    GLU  80           HN       GLU  80  76.408 -14.537   9.253
  602    HA   GLU  80           HA       GLU  80  74.751 -14.955   7.647
  603    HB2  GLU  80           HB2      GLU  80  75.524 -12.248   6.560
  604    HB3  GLU  80           HB1      GLU  80  73.917 -12.966   6.680
  605    HG2  GLU  80           HG2      GLU  80  74.113 -12.884   9.170
  606    HG3  GLU  80           HG1      GLU  80  75.654 -12.044   8.988
  607    H    LEU  81           HN       LEU  81  74.468 -14.141   5.046
  608    HA   LEU  81           HA       LEU  81  75.999 -16.010   3.573
  609    HG   LEU  81           HG       LEU  81  75.561 -12.731   1.869
  610    HB2  LEU  81           HB2      LEU  81  74.974 -15.053   1.625
  611    HB3  LEU  81           HB1      LEU  81  73.789 -14.948   2.925
  612   HD11  LEU  81          HD11      LEU  81  73.391 -11.625   1.469
  613   HD12  LEU  81          HD12      LEU  81  72.552 -13.031   2.124
  614   HD13  LEU  81          HD13      LEU  81  73.473 -13.172   0.626
  615   HD21  LEU  81          HD21      LEU  81  75.581 -12.484   4.256
  616   HD22  LEU  81          HD22      LEU  81  73.869 -12.888   4.376
  617   HD23  LEU  81          HD23      LEU  81  74.365 -11.357   3.655
  618    H    ALA  82           HN       ALA  82  77.489 -13.681   5.107
  619    HA   ALA  82           HA       ALA  82  78.881 -12.210   3.058
  620    HB1  ALA  82           HB1      ALA  82  79.927 -12.858   5.825
  621    HB2  ALA  82           HB2      ALA  82  78.750 -11.581   5.512
  622    HB3  ALA  82           HB3      ALA  82  80.363 -11.487   4.806
  623    H    GLN  83           HN       GLN  83  78.859 -14.907   2.269
  624    HA   GLN  83           HA       GLN  83  81.721 -15.345   1.906
  625    HB2  GLN  83           HB2      GLN  83  81.071 -16.414   4.170
  626    HB3  GLN  83           HB1      GLN  83  80.188 -17.600   3.208
  627    HG2  GLN  83           HG2      GLN  83  82.307 -18.593   3.465
  628    HG3  GLN  83           HG1      GLN  83  82.408 -17.840   1.873
  629   HE21  GLN  83          HE21      GLN  83  83.499 -15.650   1.792
  630   HE22  GLN  83          HE22      GLN  83  84.692 -15.289   2.944
  631    H    TYR  84           HN       TYR  84  78.426 -15.888   1.155
  632    HA   TYR  84           HA       TYR  84  79.251 -17.277  -1.352
  633    HD1  TYR  84           HD2      TYR  84  80.001 -19.721  -0.676
  634    HD2  TYR  84           HD1      TYR  84  75.993 -19.297  -2.162
  635    HE1  TYR  84           HE2      TYR  84  80.442 -21.480  -2.368
  636    HE2  TYR  84           HE1      TYR  84  76.434 -21.056  -3.853
  637    HH   TYR  84           HH       TYR  84  79.551 -22.163  -4.582
  638    HB2  TYR  84           HB2      TYR  84  78.044 -18.659   0.688
  639    HB3  TYR  84           HB1      TYR  84  76.639 -18.127  -0.233
  640    H    GLY  85           HN       GLY  85  78.118 -14.550  -0.218
  641    HA2  GLY  85           HA2      GLY  85  76.477 -14.024  -2.599
  642    HA3  GLY  85           HA1      GLY  85  75.628 -13.852  -1.061
  643    H    ILE  86           HN       ILE  86  78.513 -13.098  -0.049
  644    HA   ILE  86           HA       ILE  86  79.236 -10.964   0.725
  645    HB   ILE  86           HB       ILE  86  80.288  -9.748  -1.294
  646   HG12  ILE  86          HG12      ILE  86  79.329 -12.286  -2.656
  647   HG13  ILE  86          HG11      ILE  86  78.676 -10.675  -2.956
  648   HG21  ILE  86          HG21      ILE  86  82.043 -11.428  -1.472
  649   HG22  ILE  86          HG22      ILE  86  80.944 -12.683  -0.898
  650   HG23  ILE  86          HG23      ILE  86  81.455 -11.392   0.190
  651   HD11  ILE  86          HD11      ILE  86  81.089  -9.976  -3.497
  652   HD12  ILE  86          HD12      ILE  86  80.283 -11.011  -4.676
  653   HD13  ILE  86          HD13      ILE  86  81.455 -11.700  -3.553
  654    H1U  RCY  87           H1U      RCY  87  76.670  -3.374  -2.292
  655    H1S  RCY  87           H1S      RCY  87  75.407  -6.917  -0.072
  656    HB1  RCY  87           HB1      RCY  87  75.612  -8.716   2.553
  657    HB2  RCY  87           HB2      RCY  87  74.401  -9.489   1.530
  658    HA   RCY  87           HA       RCY  87  75.436  -8.650  -0.469
  659    HN1  RCY  87           HN1      RCY  87  77.052 -10.191   1.348
  Start of MODEL    8
    1    HA   MET   1           HA       MET   1  60.089 -13.801  17.594
    2    HB2  MET   1           HB2      MET   1  62.026 -15.337  16.934
    3    HB3  MET   1           HB1      MET   1  62.899 -14.666  18.311
    4    HG2  MET   1           HG2      MET   1  61.851 -16.605  19.178
    5    HG3  MET   1           HG1      MET   1  60.811 -15.279  19.699
    6    HE1  MET   1           HE1      MET   1  58.500 -16.013  19.908
    7    HE2  MET   1           HE2      MET   1  59.322 -17.559  20.103
    8    HE3  MET   1           HE3      MET   1  57.871 -17.460  19.108
    9    H    ASN   2           HN       ASN   2  62.412 -14.122  19.912
   10    HA   ASN   2           HA       ASN   2  61.174 -12.227  21.683
   11    HB2  ASN   2           HB2      ASN   2  62.358 -14.295  22.438
   12    HB3  ASN   2           HB1      ASN   2  63.887 -13.558  21.958
   13   HD21  ASN   2          HD21      ASN   2  61.917 -14.013  24.625
   14   HD22  ASN   2          HD22      ASN   2  62.426 -12.694  25.565
   15    H    LEU   3           HN       LEU   3  64.064 -12.123  19.653
   16    HA   LEU   3           HA       LEU   3  64.068  -9.222  19.714
   17    HG   LEU   3           HG       LEU   3  64.824  -7.944  21.471
   18    HB2  LEU   3           HB2      LEU   3  65.361 -10.348  21.858
   19    HB3  LEU   3           HB1      LEU   3  66.682 -10.215  20.700
   20   HD11  LEU   3          HD11      LEU   3  66.412  -8.732  23.277
   21   HD12  LEU   3          HD12      LEU   3  66.665  -7.065  22.759
   22   HD13  LEU   3          HD13      LEU   3  67.742  -8.340  22.186
   23   HD21  LEU   3          HD21      LEU   3  66.716  -6.635  20.310
   24   HD22  LEU   3          HD22      LEU   3  65.624  -7.546  19.267
   25   HD23  LEU   3          HD23      LEU   3  67.222  -8.189  19.647
   26    H    GLU   4           HN       GLU   4  64.846 -12.186  18.390
   27    HA   GLU   4           HA       GLU   4  67.165 -11.631  16.842
   28    HB2  GLU   4           HB2      GLU   4  64.777 -13.416  16.307
   29    HB3  GLU   4           HB1      GLU   4  66.203 -13.383  15.270
   30    HG2  GLU   4           HG2      GLU   4  66.303 -13.923  18.250
   31    HG3  GLU   4           HG1      GLU   4  66.262 -15.191  17.024
   32    HA   PRO   5           HA       PRO   5  66.190  -8.555  13.839
   33    HB2  PRO   5           HB2      PRO   5  66.698 -10.721  11.822
   34    HB3  PRO   5           HB1      PRO   5  67.301  -9.052  11.853
   35    HG2  PRO   5           HG2      PRO   5  68.812 -11.134  12.612
   36    HG3  PRO   5           HG1      PRO   5  68.955  -9.535  13.358
   37    HD2  PRO   5           HD2      PRO   5  67.879 -12.028  14.512
   38    HD3  PRO   5           HD1      PRO   5  68.427 -10.553  15.336
   39    HA   PRO   6           HA       PRO   6  61.955  -9.418  12.743
   40    HB2  PRO   6           HB2      PRO   6  61.475  -7.382  10.997
   41    HB3  PRO   6           HB1      PRO   6  61.661  -7.121  12.743
   42    HG2  PRO   6           HG2      PRO   6  63.637  -6.700  10.557
   43    HG3  PRO   6           HG1      PRO   6  63.305  -5.707  11.986
   44    HD2  PRO   6           HD2      PRO   6  65.426  -7.446  11.827
   45    HD3  PRO   6           HD1      PRO   6  64.646  -6.996  13.359
   46    H    LYS   7           HN       LYS   7  61.050 -10.842  11.302
   47    HA   LYS   7           HA       LYS   7  62.520 -11.584   8.895
   48    HB2  LYS   7           HB2      LYS   7  59.736 -12.503   9.600
   49    HB3  LYS   7           HB1      LYS   7  60.976 -13.368   8.691
   50    HG2  LYS   7           HG2      LYS   7  61.072 -12.690  11.646
   51    HG3  LYS   7           HG1      LYS   7  60.821 -14.292  10.953
   52    HD2  LYS   7           HD2      LYS   7  63.068 -13.950   9.757
   53    HD3  LYS   7           HD1      LYS   7  63.315 -12.589  10.851
   54    HE2  LYS   7           HE2      LYS   7  62.859 -14.182  12.770
   55    HE3  LYS   7           HE1      LYS   7  62.917 -15.497  11.596
   56    HZ1  LYS   7           HZ1      LYS   7  65.069 -13.797  12.595
   57    HZ2  LYS   7           HZ2      LYS   7  65.151 -14.272  10.966
   58    HZ3  LYS   7           HZ3      LYS   7  65.087 -15.445  12.193
   59    H    ALA   8           HN       ALA   8  59.147 -10.587   9.377
   60    HA   ALA   8           HA       ALA   8  57.687  -9.423   7.951
   61    HB1  ALA   8           HB1      ALA   8  59.211  -7.577   8.541
   62    HB2  ALA   8           HB2      ALA   8  58.660  -7.425   6.873
   63    HB3  ALA   8           HB3      ALA   8  60.281  -8.032   7.215
   64    H    GLU   9           HN       GLU   9  59.776 -11.637   6.851
   65    HA   GLU   9           HA       GLU   9  60.113 -12.703   4.785
   66    HB2  GLU   9           HB2      GLU   9  57.393 -11.462   4.265
   67    HB3  GLU   9           HB1      GLU   9  58.112 -12.777   3.335
   68    HG2  GLU   9           HG2      GLU   9  56.668 -13.838   4.904
   69    HG3  GLU   9           HG1      GLU   9  58.294 -14.044   5.555
   70    H1U  RCY  10           H1U      RCY  10  58.162 -15.287  -2.976
   71    H1S  RCY  10           H1S      RCY  10  58.876 -10.831  -1.945
   72    HB1  RCY  10           HB1      RCY  10  58.491  -9.079  -0.001
   73    HB2  RCY  10           HB2      RCY  10  58.589 -10.760   0.520
   74    HA   RCY  10           HA       RCY  10  60.687  -9.325   1.827
   75    HN1  RCY  10           HN1      RCY  10  58.212 -10.651   2.854
   76    H    ARG  11           HN       ARG  11  57.222  -8.521   1.486
   77    HA   ARG  11           HA       ARG  11  57.861  -5.693   1.981
   78    HE   ARG  11           HE       ARG  11  55.977  -5.257  -3.017
   79    HB2  ARG  11           HB2      ARG  11  55.156  -6.986   1.524
   80    HB3  ARG  11           HB1      ARG  11  55.543  -5.271   1.389
   81    HG2  ARG  11           HG2      ARG  11  57.252  -5.945  -0.393
   82    HG3  ARG  11           HG1      ARG  11  56.479  -7.530  -0.389
   83    HD2  ARG  11           HD2      ARG  11  54.331  -6.526  -0.974
   84    HD3  ARG  11           HD1      ARG  11  55.033  -4.910  -0.880
   85   HH11  ARG  11          HH21      ARG  11  54.945  -8.200  -1.547
   86   HH12  ARG  11          HH22      ARG  11  55.223  -9.160  -2.961
   87   HH21  ARG  11          HH11      ARG  11  56.346  -6.494  -4.873
   88   HH22  ARG  11          HH12      ARG  11  56.017  -8.194  -4.845
   89    H    SER  12           HN       SER  12  55.121  -5.306   3.196
   90    HA   SER  12           HA       SER  12  54.221  -5.095   5.351
   91    HG   SER  12           HG       SER  12  53.638  -8.440   5.229
   92    HB2  SER  12           HB2      SER  12  55.799  -7.523   6.180
   93    HB3  SER  12           HB1      SER  12  54.195  -7.017   6.701
   94    H    ALA  13           HN       ALA  13  54.897  -3.625   6.834
   95    HA   ALA  13           HA       ALA  13  57.420  -3.945   8.259
   96    HB1  ALA  13           HB1      ALA  13  58.062  -2.917   6.016
   97    HB2  ALA  13           HB2      ALA  13  58.549  -1.997   7.439
   98    HB3  ALA  13           HB3      ALA  13  57.141  -1.494   6.504
   99    H    THR  14           HN       THR  14  54.568  -3.639   8.864
  100    HA   THR  14           HA       THR  14  53.184  -2.469  10.344
  101    HB   THR  14           HB       THR  14  54.260  -1.501  12.265
  102    HG1  THR  14           HG1      THR  14  56.797  -1.621  11.159
  103   HG21  THR  14          HG21      THR  14  54.500  -3.945  12.037
  104   HG22  THR  14          HG22      THR  14  55.900  -3.245  12.850
  105   HG23  THR  14          HG23      THR  14  56.009  -3.714  11.153
  106    H    ARG  15           HN       ARG  15  55.700   0.034  10.191
  107    HA   ARG  15           HA       ARG  15  54.370   1.617   8.194
  108    HE   ARG  15           HE       ARG  15  51.112   3.269   8.561
  109    HB2  ARG  15           HB2      ARG  15  52.687   1.860   9.990
  110    HB3  ARG  15           HB1      ARG  15  53.941   2.455  11.079
  111    HG2  ARG  15           HG2      ARG  15  54.274   4.427   9.787
  112    HG3  ARG  15           HG1      ARG  15  53.366   3.776   8.422
  113    HD2  ARG  15           HD2      ARG  15  52.060   4.163  11.113
  114    HD3  ARG  15           HD1      ARG  15  52.168   5.488   9.954
  115   HH11  ARG  15          HH21      ARG  15  50.363   5.337  11.216
  116   HH12  ARG  15          HH22      ARG  15  48.648   5.206  11.006
  117   HH21  ARG  15          HH11      ARG  15  48.878   3.086   8.272
  118   HH22  ARG  15          HH12      ARG  15  47.808   3.932   9.339
  119    H    VAL  16           HN       VAL  16  56.703   1.567   7.665
  120    HA   VAL  16           HA       VAL  16  58.465   3.156   9.439
  121    HB   VAL  16           HB       VAL  16  59.086   1.824   6.786
  122   HG11  VAL  16          HG11      VAL  16  60.677   3.580   7.381
  123   HG12  VAL  16          HG12      VAL  16  61.431   2.005   7.625
  124   HG13  VAL  16          HG13      VAL  16  60.835   2.921   9.009
  125   HG21  VAL  16          HG21      VAL  16  60.095   0.043   8.196
  126   HG22  VAL  16          HG22      VAL  16  58.355   0.173   8.452
  127   HG23  VAL  16          HG23      VAL  16  59.474   0.851   9.635
  128    H    MET  17           HN       MET  17  59.558   5.070   8.638
  129    HA   MET  17           HA       MET  17  58.799   6.223   6.073
  130    HB2  MET  17           HB2      MET  17  57.842   8.313   7.407
  131    HB3  MET  17           HB1      MET  17  56.792   6.962   6.981
  132    HG2  MET  17           HG2      MET  17  56.573   7.656   9.378
  133    HG3  MET  17           HG1      MET  17  57.078   5.977   9.187
  134    HE1  MET  17           HE1      MET  17  57.443   7.752  11.896
  135    HE2  MET  17           HE2      MET  17  58.956   6.989  12.379
  136    HE3  MET  17           HE3      MET  17  57.691   6.022  11.625
  137    H    GLY  18           HN       GLY  18  59.753   8.497   5.892
  138    HA2  GLY  18           HA2      GLY  18  61.855   9.130   7.858
  139    HA3  GLY  18           HA1      GLY  18  62.428   8.671   6.254
  140    H    GLY  19           HN       GLY  19  59.423  10.418   6.781
  141    HA2  GLY  19           HA2      GLY  19  58.917  12.709   6.420
  142    HA3  GLY  19           HA1      GLY  19  60.633  13.016   6.149
  143    HA   PRO  20           HA       PRO  20  57.904  13.133   2.160
  144    HB2  PRO  20           HB2      PRO  20  59.816  15.436   1.926
  145    HB3  PRO  20           HB1      PRO  20  58.128  15.315   1.390
  146    HG2  PRO  20           HG2      PRO  20  58.806  16.621   3.617
  147    HG3  PRO  20           HG1      PRO  20  57.292  15.711   3.489
  148    HD2  PRO  20           HD2      PRO  20  59.729  15.072   5.052
  149    HD3  PRO  20           HD1      PRO  20  58.056  14.527   5.298
  150    H1U  RCY  21           H1U      RCY  21  57.997   3.314   0.966
  151    H1S  RCY  21           H1S      RCY  21  60.727   6.874   0.856
  152    HB1  RCY  21           HB1      RCY  21  61.709   9.607   1.935
  153    HB2  RCY  21           HB2      RCY  21  61.679   8.951   0.298
  154    HA   RCY  21           HA       RCY  21  61.804  11.503   0.489
  155    HN1  RCY  21           HN1      RCY  21  59.094  11.121   1.653
  156    H    THR  22           HN       THR  22  61.387  12.459  -1.519
  157    HA   THR  22           HA       THR  22  60.035  10.698  -3.498
  158    HB   THR  22           HB       THR  22  58.240  12.144  -3.204
  159    HG1  THR  22           HG1      THR  22  59.571  13.952  -4.828
  160   HG21  THR  22          HG21      THR  22  58.662  14.654  -2.828
  161   HG22  THR  22          HG22      THR  22  60.342  14.205  -2.532
  162   HG23  THR  22          HG23      THR  22  59.064  13.569  -1.496
  163    HA   PRO  23           HA       PRO  23  64.170  11.716  -5.166
  164    HB2  PRO  23           HB2      PRO  23  62.862  10.309  -7.470
  165    HB3  PRO  23           HB1      PRO  23  64.492  10.096  -6.798
  166    HG2  PRO  23           HG2      PRO  23  62.546   8.357  -6.286
  167    HG3  PRO  23           HG1      PRO  23  63.742   8.792  -5.053
  168    HD2  PRO  23           HD2      PRO  23  60.871   9.573  -5.241
  169    HD3  PRO  23           HD1      PRO  23  61.901   9.393  -3.804
  170    H    ARG  24           HN       ARG  24  64.463  13.787  -5.870
  171    HA   ARG  24           HA       ARG  24  62.437  15.062  -7.591
  172    HE   ARG  24           HE       ARG  24  61.752  17.670  -4.782
  173    HB2  ARG  24           HB2      ARG  24  63.534  16.228  -5.625
  174    HB3  ARG  24           HB1      ARG  24  65.030  16.239  -6.557
  175    HG2  ARG  24           HG2      ARG  24  64.156  18.304  -7.158
  176    HG3  ARG  24           HG1      ARG  24  63.470  17.290  -8.428
  177    HD2  ARG  24           HD2      ARG  24  61.699  18.675  -7.503
  178    HD3  ARG  24           HD1      ARG  24  61.420  17.003  -7.017
  179   HH11  ARG  24          HH21      ARG  24  63.068  19.940  -7.018
  180   HH12  ARG  24          HH22      ARG  24  63.484  21.100  -5.801
  181   HH21  ARG  24          HH11      ARG  24  62.288  19.172  -3.179
  182   HH22  ARG  24          HH12      ARG  24  63.042  20.665  -3.627
  183    H    LYS  25           HN       LYS  25  65.364  16.463  -8.287
  184    HA   LYS  25           HA       LYS  25  65.303  15.740 -11.042
  185    HB2  LYS  25           HB2      LYS  25  67.653  16.785  -9.434
  186    HB3  LYS  25           HB1      LYS  25  67.492  16.836 -11.189
  187    HG2  LYS  25           HG2      LYS  25  65.500  18.261 -10.984
  188    HG3  LYS  25           HG1      LYS  25  65.616  18.188  -9.226
  189    HD2  LYS  25           HD2      LYS  25  66.715  20.193  -9.654
  190    HD3  LYS  25           HD1      LYS  25  68.070  19.063  -9.658
  191    HE2  LYS  25           HE2      LYS  25  68.266  20.469 -11.620
  192    HE3  LYS  25           HE1      LYS  25  67.797  18.854 -12.151
  193    HZ1  LYS  25           HZ1      LYS  25  66.428  21.291 -12.505
  194    HZ2  LYS  25           HZ2      LYS  25  65.458  20.238 -11.590
  195    HZ3  LYS  25           HZ3      LYS  25  66.038  19.756 -13.113
  196    H    GLY  26           HN       GLY  26  68.143  15.186 -11.438
  197    HA2  GLY  26           HA2      GLY  26  69.710  13.395 -11.273
  198    HA3  GLY  26           HA1      GLY  26  68.604  12.558 -10.182
  199    HA   PRO  27           HA       PRO  27  66.913  11.752 -14.612
  200    HB2  PRO  27           HB2      PRO  27  68.866  12.767 -16.522
  201    HB3  PRO  27           HB1      PRO  27  67.168  13.231 -16.326
  202    HG2  PRO  27           HG2      PRO  27  69.282  14.850 -15.747
  203    HG3  PRO  27           HG1      PRO  27  67.678  15.001 -15.013
  204    HD2  PRO  27           HD2      PRO  27  70.172  13.798 -13.860
  205    HD3  PRO  27           HD1      PRO  27  68.890  14.732 -13.052
  206    HA   PRO  28           HA       PRO  28  69.033   7.925 -15.294
  207    HB2  PRO  28           HB2      PRO  28  68.626   8.367 -18.227
  208    HB3  PRO  28           HB1      PRO  28  68.227   6.951 -17.234
  209    HG2  PRO  28           HG2      PRO  28  66.361   8.689 -18.053
  210    HG3  PRO  28           HG1      PRO  28  66.258   7.851 -16.497
  211    HD2  PRO  28           HD2      PRO  28  66.848  10.705 -17.046
  212    HD3  PRO  28           HD1      PRO  28  66.196   9.950 -15.576
  213    H    LYS  29           HN       LYS  29  71.197   7.570 -15.302
  214    HA   LYS  29           HA       LYS  29  73.155   7.686 -17.088
  215    HB2  LYS  29           HB2      LYS  29  72.764   9.861 -17.959
  216    HB3  LYS  29           HB1      LYS  29  72.555  10.560 -16.352
  217    HG2  LYS  29           HG2      LYS  29  74.837  10.599 -15.921
  218    HG3  LYS  29           HG1      LYS  29  75.173   9.265 -17.025
  219    HD2  LYS  29           HD2      LYS  29  74.851  10.681 -18.951
  220    HD3  LYS  29           HD1      LYS  29  74.254  12.001 -17.945
  221    HE2  LYS  29           HE2      LYS  29  77.011  10.845 -17.536
  222    HE3  LYS  29           HE1      LYS  29  76.717  12.120 -18.719
  223    HZ1  LYS  29           HZ1      LYS  29  76.584  12.219 -15.802
  224    HZ2  LYS  29           HZ2      LYS  29  75.476  13.174 -16.667
  225    HZ3  LYS  29           HZ3      LYS  29  77.146  13.383 -16.902
  226    H1U  RCY  30           H1U      RCY  30  74.106   1.461  -9.388
  227    H1S  RCY  30           H1S      RCY  30  73.807   2.414 -13.284
  228    HB1  RCY  30           HB1      RCY  30  73.679   5.461 -12.607
  229    HB2  RCY  30           HB2      RCY  30  75.388   5.185 -12.274
  230    HA   RCY  30           HA       RCY  30  74.797   7.571 -12.889
  231    HN1  RCY  30           HN1      RCY  30  73.951   6.303 -15.437
  232    H    LYS  31           HN       LYS  31  76.866   8.238 -12.639
  233    HA   LYS  31           HA       LYS  31  78.826   8.311 -14.601
  234    HB2  LYS  31           HB2      LYS  31  79.648   7.833 -11.744
  235    HB3  LYS  31           HB1      LYS  31  80.357   8.926 -12.930
  236    HG2  LYS  31           HG2      LYS  31  77.663   9.249 -11.574
  237    HG3  LYS  31           HG1      LYS  31  79.101  10.233 -11.297
  238    HD2  LYS  31           HD2      LYS  31  77.590  10.003 -13.918
  239    HD3  LYS  31           HD1      LYS  31  77.552  11.386 -12.823
  240    HE2  LYS  31           HE2      LYS  31  80.175  11.295 -13.104
  241    HE3  LYS  31           HE1      LYS  31  79.781  10.429 -14.589
  242    HZ1  LYS  31           HZ1      LYS  31  79.713  12.554 -15.347
  243    HZ2  LYS  31           HZ2      LYS  31  79.236  13.206 -13.852
  244    HZ3  LYS  31           HZ3      LYS  31  78.101  12.414 -14.837
  245    H    GLN  32           HN       GLN  32  80.643   6.983 -15.125
  246    HA   GLN  32           HA       GLN  32  80.999   4.381 -13.860
  247    HB2  GLN  32           HB2      GLN  32  80.567   3.199 -16.134
  248    HB3  GLN  32           HB1      GLN  32  79.168   3.640 -15.153
  249    HG2  GLN  32           HG2      GLN  32  78.731   5.582 -16.483
  250    HG3  GLN  32           HG1      GLN  32  80.283   5.444 -17.310
  251   HE21  GLN  32          HE21      GLN  32  80.541   3.609 -18.847
  252   HE22  GLN  32          HE22      GLN  32  79.171   2.876 -19.531
  253    H    ARG  33           HN       ARG  33  83.100   5.581 -13.745
  254    HA   ARG  33           HA       ARG  33  84.819   4.788 -15.982
  255    HE   ARG  33           HE       ARG  33  88.624   6.208 -18.045
  256    HB2  ARG  33           HB2      ARG  33  84.057   6.956 -16.800
  257    HB3  ARG  33           HB1      ARG  33  84.439   7.710 -15.254
  258    HG2  ARG  33           HG2      ARG  33  86.210   8.110 -16.962
  259    HG3  ARG  33           HG1      ARG  33  86.816   7.223 -15.563
  260    HD2  ARG  33           HD2      ARG  33  86.943   5.203 -16.732
  261    HD3  ARG  33           HD1      ARG  33  85.762   5.713 -17.938
  262   HH11  ARG  33          HH21      ARG  33  85.477   7.356 -18.862
  263   HH12  ARG  33          HH22      ARG  33  86.020   8.273 -20.227
  264   HH21  ARG  33          HH11      ARG  33  89.351   7.399 -19.824
  265   HH22  ARG  33          HH12      ARG  33  88.214   8.297 -20.772
  266    H    GLN  34           HN       GLN  34  84.280   5.846 -12.750
  267    HA   GLN  34           HA       GLN  34  87.129   5.207 -12.092
  268    HB2  GLN  34           HB2      GLN  34  85.546   7.261 -10.552
  269    HB3  GLN  34           HB1      GLN  34  87.293   7.027 -10.605
  270    HG2  GLN  34           HG2      GLN  34  87.015   8.895 -11.987
  271    HG3  GLN  34           HG1      GLN  34  87.023   7.573 -13.155
  272   HE21  GLN  34          HE21      GLN  34  84.179   7.019 -11.703
  273   HE22  GLN  34          HE22      GLN  34  83.147   8.003 -12.624
  274    H    THR  35           HN       THR  35  86.283   5.853  -9.223
  275    HA   THR  35           HA       THR  35  85.614   4.550  -7.386
  276    HB   THR  35           HB       THR  35  83.345   3.666  -9.182
  277    HG1  THR  35           HG1      THR  35  83.993   6.074  -8.958
  278   HG21  THR  35          HG21      THR  35  83.509   4.273  -6.216
  279   HG22  THR  35          HG22      THR  35  83.521   2.657  -6.922
  280   HG23  THR  35          HG23      THR  35  82.090   3.676  -7.077
  281    H    ARG  36           HN       ARG  36  87.221   2.956  -7.269
  282    HA   ARG  36           HA       ARG  36  86.400   0.277  -8.156
  283    HE   ARG  36           HE       ARG  36  87.911   3.783  -7.691
  284    HB2  ARG  36           HB2      ARG  36  88.966   0.127  -9.038
  285    HB3  ARG  36           HB1      ARG  36  87.604   0.485 -10.095
  286    HG2  ARG  36           HG2      ARG  36  89.388   2.136 -10.442
  287    HG3  ARG  36           HG1      ARG  36  87.976   2.915  -9.727
  288    HD2  ARG  36           HD2      ARG  36  89.832   1.832  -7.728
  289    HD3  ARG  36           HD1      ARG  36  90.553   3.083  -8.741
  290   HH11  ARG  36          HH21      ARG  36  91.329   3.748  -7.243
  291   HH12  ARG  36          HH22      ARG  36  91.331   5.081  -6.136
  292   HH21  ARG  36          HH11      ARG  36  87.894   5.524  -6.249
  293   HH22  ARG  36          HH12      ARG  36  89.386   6.086  -5.574
  294    H    GLN  37           HN       GLN  37  87.351   2.099  -5.745
  295    HA   GLN  37           HA       GLN  37  89.608   0.566  -4.699
  296    HB2  GLN  37           HB2      GLN  37  88.902   3.046  -4.187
  297    HB3  GLN  37           HB1      GLN  37  87.838   2.304  -2.993
  298    HG2  GLN  37           HG2      GLN  37  90.836   1.877  -3.182
  299    HG3  GLN  37           HG1      GLN  37  90.019   2.889  -1.991
  300   HE21  GLN  37          HE21      GLN  37  90.871  -0.396  -2.806
  301   HE22  GLN  37          HE22      GLN  37  90.149  -1.131  -1.457
  302    H1U  RCY  38           H1U      RCY  38  87.909   3.344  -0.841
  303    H1S  RCY  38           H1S      RCY  38  85.835  -1.028  -0.613
  304    HB1  RCY  38           HB1      RCY  38  85.032  -3.211  -4.188
  305    HB2  RCY  38           HB2      RCY  38  85.316  -1.560  -4.739
  306    HA   RCY  38           HA       RCY  38  87.138  -2.382  -2.585
  307    HN1  RCY  38           HN1      RCY  38  88.095  -1.447  -5.203
  308    H    LYS  39           HN       LYS  39  85.940  -4.736  -3.356
  309    HA   LYS  39           HA       LYS  39  86.478  -6.911  -4.037
  310    HB2  LYS  39           HB2      LYS  39  87.819  -5.448  -6.332
  311    HB3  LYS  39           HB1      LYS  39  87.386  -7.156  -6.306
  312    HG2  LYS  39           HG2      LYS  39  85.078  -6.701  -6.350
  313    HG3  LYS  39           HG1      LYS  39  85.303  -5.038  -5.807
  314    HD2  LYS  39           HD2      LYS  39  86.568  -5.860  -8.390
  315    HD3  LYS  39           HD1      LYS  39  84.826  -5.586  -8.366
  316    HE2  LYS  39           HE2      LYS  39  86.857  -3.598  -7.316
  317    HE3  LYS  39           HE1      LYS  39  86.169  -3.534  -8.938
  318    HZ1  LYS  39           HZ1      LYS  39  85.090  -2.463  -6.650
  319    HZ2  LYS  39           HZ2      LYS  39  84.143  -3.838  -6.968
  320    HZ3  LYS  39           HZ3      LYS  39  84.319  -2.632  -8.152
  321    H    SER  40           HN       SER  40  88.820  -4.667  -3.172
  322    HA   SER  40           HA       SER  40  91.137  -6.443  -3.514
  323    HG   SER  40           HG       SER  40  93.279  -4.107  -2.778
  324    HB2  SER  40           HB2      SER  40  91.363  -3.960  -3.645
  325    HB3  SER  40           HB1      SER  40  90.884  -3.852  -1.953
  326    H    LYS  41           HN       LYS  41  91.314  -4.887  -0.536
  327    HA   LYS  41           HA       LYS  41  91.464  -7.323   0.947
  328    HB2  LYS  41           HB2      LYS  41  92.443  -5.027   1.555
  329    HB3  LYS  41           HB1      LYS  41  90.831  -4.620   2.141
  330    HG2  LYS  41           HG2      LYS  41  91.754  -5.467   4.090
  331    HG3  LYS  41           HG1      LYS  41  91.081  -6.948   3.407
  332    HD2  LYS  41           HD2      LYS  41  93.316  -7.352   2.303
  333    HD3  LYS  41           HD1      LYS  41  93.950  -5.991   3.228
  334    HE2  LYS  41           HE2      LYS  41  93.306  -7.117   5.329
  335    HE3  LYS  41           HE1      LYS  41  92.680  -8.482   4.403
  336    HZ1  LYS  41           HZ1      LYS  41  94.765  -9.150   3.797
  337    HZ2  LYS  41           HZ2      LYS  41  95.097  -8.510   5.335
  338    HZ3  LYS  41           HZ3      LYS  41  95.440  -7.601   3.942
  339    HA   PRO  42           HA       PRO  42  86.962  -7.712   1.224
  340    HB2  PRO  42           HB2      PRO  42  86.882 -10.247   2.193
  341    HB3  PRO  42           HB1      PRO  42  87.253  -9.891   0.495
  342    HG2  PRO  42           HG2      PRO  42  89.098 -10.590   2.719
  343    HG3  PRO  42           HG1      PRO  42  89.144 -11.077   1.017
  344    HD2  PRO  42           HD2      PRO  42  90.712  -9.064   2.101
  345    HD3  PRO  42           HD1      PRO  42  90.293  -9.189   0.378
  346    HA   PRO  43           HA       PRO  43  86.153  -6.819   5.488
  347    HB2  PRO  43           HB2      PRO  43  83.603  -7.775   5.788
  348    HB3  PRO  43           HB1      PRO  43  83.987  -6.302   4.877
  349    HG2  PRO  43           HG2      PRO  43  83.413  -9.043   3.874
  350    HG3  PRO  43           HG1      PRO  43  82.913  -7.474   3.223
  351    HD2  PRO  43           HD2      PRO  43  84.988  -8.927   2.176
  352    HD3  PRO  43           HD1      PRO  43  84.908  -7.153   2.095
  353    H    LYS  44           HN       LYS  44  85.654  -7.846   7.626
  354    HA   LYS  44           HA       LYS  44  87.032 -10.300   7.998
  355    HB2  LYS  44           HB2      LYS  44  86.594  -8.600   9.787
  356    HB3  LYS  44           HB1      LYS  44  84.911  -9.126   9.818
  357    HG2  LYS  44           HG2      LYS  44  85.566 -11.371  10.465
  358    HG3  LYS  44           HG1      LYS  44  87.273 -10.967  10.280
  359    HD2  LYS  44           HD2      LYS  44  86.653 -10.881  12.649
  360    HD3  LYS  44           HD1      LYS  44  87.037  -9.259  12.072
  361    HE2  LYS  44           HE2      LYS  44  84.198 -10.207  11.919
  362    HE3  LYS  44           HE1      LYS  44  84.837  -9.689  13.479
  363    HZ1  LYS  44           HZ1      LYS  44  83.906  -8.080  11.439
  364    HZ2  LYS  44           HZ2      LYS  44  85.592  -7.873  11.443
  365    HZ3  LYS  44           HZ3      LYS  44  84.695  -7.583  12.856
  366    H    LYS  45           HN       LYS  45  83.619 -10.038   8.966
  367    HA   LYS  45           HA       LYS  45  82.579 -11.946   7.118
  368    HB2  LYS  45           HB2      LYS  45  84.195 -13.080   9.204
  369    HB3  LYS  45           HB1      LYS  45  82.519 -13.541   9.499
  370    HG2  LYS  45           HG2      LYS  45  82.311 -14.442   7.255
  371    HG3  LYS  45           HG1      LYS  45  83.911 -13.840   6.821
  372    HD2  LYS  45           HD2      LYS  45  84.065 -16.219   7.342
  373    HD3  LYS  45           HD1      LYS  45  84.896 -15.295   8.595
  374    HE2  LYS  45           HE2      LYS  45  83.203 -15.655  10.169
  375    HE3  LYS  45           HE1      LYS  45  81.991 -15.993   8.934
  376    HZ1  LYS  45           HZ1      LYS  45  82.663 -18.124   8.721
  377    HZ2  LYS  45           HZ2      LYS  45  83.177 -17.893  10.323
  378    HZ3  LYS  45           HZ3      LYS  45  84.292 -17.777   9.046
  379    H    GLY  46           HN       GLY  46  80.340 -12.379   7.547
  380    HA2  GLY  46           HA2      GLY  46  79.151 -11.412  10.054
  381    HA3  GLY  46           HA1      GLY  46  78.744 -10.456   8.628
  382    H    VAL  47           HN       VAL  47  78.847 -13.888   9.647
  383    HA   VAL  47           HA       VAL  47  77.411 -15.662   9.093
  384    HB   VAL  47           HB       VAL  47  75.386 -13.403   9.012
  385   HG11  VAL  47          HG11      VAL  47  74.367 -15.332   8.070
  386   HG12  VAL  47          HG12      VAL  47  73.875 -15.347   9.764
  387   HG13  VAL  47          HG13      VAL  47  75.169 -16.410   9.212
  388   HG21  VAL  47          HG21      VAL  47  74.972 -14.226  11.397
  389   HG22  VAL  47          HG22      VAL  47  76.478 -13.343  11.144
  390   HG23  VAL  47          HG23      VAL  47  76.496 -15.103  11.259
  391    H    GLN  48           HN       GLN  48  75.284 -13.603   7.274
  392    HA   GLN  48           HA       GLN  48  75.516 -15.150   4.898
  393    HB2  GLN  48           HB2      GLN  48  73.616 -13.579   5.532
  394    HB3  GLN  48           HB1      GLN  48  74.655 -12.248   5.025
  395    HG2  GLN  48           HG2      GLN  48  74.140 -14.585   3.190
  396    HG3  GLN  48           HG1      GLN  48  73.006 -13.237   3.276
  397   HE21  GLN  48          HE21      GLN  48  73.790 -11.095   2.588
  398   HE22  GLN  48          HE22      GLN  48  75.182 -10.948   1.629
  399    H    GLY  49           HN       GLY  49  77.693 -15.345   4.253
  400    HA2  GLY  49           HA2      GLY  49  79.391 -12.999   3.924
  401    HA3  GLY  49           HA1      GLY  49  79.784 -14.640   3.411
  402    H1U  RCY  50           H1U      RCY  50  73.849  -6.706   2.084
  403    H1S  RCY  50           H1S      RCY  50  77.273  -8.105  -0.543
  404    HB1  RCY  50           HB1      RCY  50  78.648  -9.695   0.249
  405    HB2  RCY  50           HB2      RCY  50  77.255 -10.331   1.123
  406    HA   RCY  50           HA       RCY  50  77.791 -12.536  -0.221
  407    HN1  RCY  50           HN1      RCY  50  79.114 -11.598   2.265
  408    H    GLY  51           HN       GLY  51  80.780 -12.795   0.793
  409    HA2  GLY  51           HA2      GLY  51  82.531 -11.391  -0.864
  410    HA3  GLY  51           HA1      GLY  51  82.813 -13.058  -0.361
  411    H    ASP  52           HN       ASP  52  83.103 -11.505  -3.025
  412    HA   ASP  52           HA       ASP  52  82.341 -13.745  -4.715
  413    HB2  ASP  52           HB2      ASP  52  80.187 -12.383  -4.384
  414    HB3  ASP  52           HB1      ASP  52  80.976 -11.116  -5.324
  415    H    ASP  53           HN       ASP  53  82.080 -11.384  -6.841
  416    HA   ASP  53           HA       ASP  53  84.838 -10.392  -6.906
  417    HB2  ASP  53           HB2      ASP  53  83.852 -12.350  -9.006
  418    HB3  ASP  53           HB1      ASP  53  85.372 -11.457  -9.076
  419    H    ILE  54           HN       ILE  54  84.284 -10.383 -10.004
  420    HA   ILE  54           HA       ILE  54  83.506  -7.727 -10.295
  421    HB   ILE  54           HB       ILE  54  82.863 -10.009 -12.182
  422   HG12  ILE  54          HG12      ILE  54  85.239  -8.137 -12.243
  423   HG13  ILE  54          HG11      ILE  54  85.291  -9.695 -11.416
  424   HG21  ILE  54          HG21      ILE  54  83.066  -7.010 -12.578
  425   HG22  ILE  54          HG22      ILE  54  81.633  -8.014 -12.800
  426   HG23  ILE  54          HG23      ILE  54  83.002  -8.175 -13.901
  427   HD11  ILE  54          HD11      ILE  54  84.661  -9.255 -14.350
  428   HD12  ILE  54          HD12      ILE  54  84.635 -10.818 -13.532
  429   HD13  ILE  54          HD13      ILE  54  86.153  -9.934 -13.699
  430    HA   PRO  55           HA       PRO  55  79.201  -8.305  -8.974
  431    HB2  PRO  55           HB2      PRO  55  78.634  -5.688  -8.513
  432    HB3  PRO  55           HB1      PRO  55  79.601  -6.664  -7.389
  433    HG2  PRO  55           HG2      PRO  55  80.490  -4.651  -9.384
  434    HG3  PRO  55           HG1      PRO  55  81.122  -4.997  -7.767
  435    HD2  PRO  55           HD2      PRO  55  82.277  -5.891 -10.136
  436    HD3  PRO  55           HD1      PRO  55  82.541  -6.629  -8.541
  437    H    GLY  56           HN       GLY  56  79.801  -5.344 -10.913
  438    HA2  GLY  56           HA2      GLY  56  77.351  -5.915 -12.472
  439    HA3  GLY  56           HA1      GLY  56  78.300  -4.429 -12.548
  440    H    MET  57           HN       MET  57  80.722  -5.001 -13.290
  441    HA   MET  57           HA       MET  57  81.110  -7.178 -15.109
  442    HB2  MET  57           HB2      MET  57  81.086  -5.726 -17.222
  443    HB3  MET  57           HB1      MET  57  79.510  -6.177 -16.569
  444    HG2  MET  57           HG2      MET  57  79.277  -4.019 -15.487
  445    HG3  MET  57           HG1      MET  57  80.920  -3.568 -15.941
  446    HE1  MET  57           HE1      MET  57  77.582  -4.976 -17.494
  447    HE2  MET  57           HE2      MET  57  77.110  -3.547 -18.409
  448    HE3  MET  57           HE3      MET  57  77.335  -3.434 -16.666
  449    H    GLU  58           HN       GLU  58  81.988  -4.179 -13.698
  450    HA   GLU  58           HA       GLU  58  84.804  -4.758 -13.925
  451    HB2  GLU  58           HB2      GLU  58  84.250  -3.895 -16.250
  452    HB3  GLU  58           HB1      GLU  58  83.866  -2.346 -15.498
  453    HG2  GLU  58           HG2      GLU  58  86.151  -2.196 -16.202
  454    HG3  GLU  58           HG1      GLU  58  86.187  -2.416 -14.452
  455    H    GLY  59           HN       GLY  59  82.494  -2.043 -13.607
  456    HA2  GLY  59           HA2      GLY  59  82.809  -1.548 -10.896
  457    HA3  GLY  59           HA1      GLY  59  84.148  -0.677 -11.645
  458    H1U  RCY  60           H1U      RCY  60  76.407   4.010  -5.183
  459    H1S  RCY  60           H1S      RCY  60  77.521   2.235  -8.708
  460    HB1  RCY  60           HB1      RCY  60  78.582   0.413 -10.847
  461    HB2  RCY  60           HB2      RCY  60  78.392   2.165 -10.923
  462    HA   RCY  60           HA       RCY  60  79.951   1.368 -12.667
  463    HN1  RCY  60           HN1      RCY  60  81.131  -0.180 -10.519
  464    H    GLY  61           HN       GLY  61  79.273   3.724 -11.064
  465    HA2  GLY  61           HA2      GLY  61  81.891   5.036 -10.615
  466    HA3  GLY  61           HA1      GLY  61  80.857   5.716 -11.871
  467    H    THR  62           HN       THR  62  81.753   6.473  -8.949
  468    HA   THR  62           HA       THR  62  79.094   7.599  -8.211
  469    HB   THR  62           HB       THR  62  79.768   7.101  -5.767
  470    HG1  THR  62           HG1      THR  62  81.907   6.428  -6.382
  471   HG21  THR  62          HG21      THR  62  78.957   4.663  -6.042
  472   HG22  THR  62          HG22      THR  62  78.872   5.028  -7.765
  473   HG23  THR  62          HG23      THR  62  77.893   5.946  -6.620
  474    H    ASP  63           HN       ASP  63  80.676   9.257  -9.429
  475    HA   ASP  63           HA       ASP  63  82.810  10.431  -7.912
  476    HB2  ASP  63           HB2      ASP  63  82.341  10.790 -10.385
  477    HB3  ASP  63           HB1      ASP  63  81.027  11.864  -9.901
  478    H    ILE  64           HN       ILE  64  81.414  10.213  -5.839
  479    HA   ILE  64           HA       ILE  64  79.918  11.126  -4.263
  480    HB   ILE  64           HB       ILE  64  81.903  12.303  -3.689
  481   HG12  ILE  64          HG12      ILE  64  79.931  14.548  -4.116
  482   HG13  ILE  64          HG11      ILE  64  79.602  13.259  -2.958
  483   HG21  ILE  64          HG21      ILE  64  82.569  14.381  -4.910
  484   HG22  ILE  64          HG22      ILE  64  81.277  14.074  -6.070
  485   HG23  ILE  64          HG23      ILE  64  82.622  12.943  -5.929
  486   HD11  ILE  64          HD11      ILE  64  81.585  13.771  -1.699
  487   HD12  ILE  64          HD12      ILE  64  80.750  15.299  -1.980
  488   HD13  ILE  64          HD13      ILE  64  82.162  14.875  -2.948
  489    H    THR  65           HN       THR  65  77.856  11.045  -5.191
  490    HA   THR  65           HA       THR  65  76.944  12.996  -7.106
  491    HB   THR  65           HB       THR  65  75.398  11.205  -5.197
  492    HG1  THR  65           HG1      THR  65  76.014   9.801  -6.616
  493   HG21  THR  65          HG21      THR  65  73.728  11.758  -7.295
  494   HG22  THR  65          HG22      THR  65  74.558  13.302  -7.094
  495   HG23  THR  65          HG23      THR  65  73.680  12.589  -5.740
  496    H    VAL  66           HN       VAL  66  78.291  14.084  -4.782
  497    HA   VAL  66           HA       VAL  66  78.103  16.043  -3.523
  498    HB   VAL  66           HB       VAL  66  75.156  16.186  -4.125
  499   HG11  VAL  66          HG11      VAL  66  77.298  18.325  -4.014
  500   HG12  VAL  66          HG12      VAL  66  76.354  17.824  -2.611
  501   HG13  VAL  66          HG13      VAL  66  75.551  18.560  -3.997
  502   HG21  VAL  66          HG21      VAL  66  76.267  17.629  -6.151
  503   HG22  VAL  66          HG22      VAL  66  75.711  15.965  -6.333
  504   HG23  VAL  66          HG23      VAL  66  77.418  16.297  -6.039
  505    H    ILE  67           HN       ILE  67  76.096  13.274  -3.110
  506    HA   ILE  67           HA       ILE  67  75.987  13.877  -0.189
  507    HB   ILE  67           HB       ILE  67  73.671  12.763  -1.796
  508   HG12  ILE  67          HG12      ILE  67  72.783  14.983  -0.452
  509   HG13  ILE  67          HG11      ILE  67  74.432  15.459  -0.859
  510   HG21  ILE  67          HG21      ILE  67  72.512  13.020   0.463
  511   HG22  ILE  67          HG22      ILE  67  74.119  13.208   1.164
  512   HG23  ILE  67          HG23      ILE  67  73.682  11.705   0.351
  513   HD11  ILE  67          HD11      ILE  67  72.162  14.748  -2.695
  514   HD12  ILE  67          HD12      ILE  67  73.825  14.517  -3.234
  515   HD13  ILE  67          HD13      ILE  67  73.263  16.123  -2.770
  516    H1U  RCY  68           H1U      RCY  68  74.352   7.823   0.482
  517    H1S  RCY  68           H1S      RCY  68  76.675   9.154  -3.022
  518    HB1  RCY  68           HB1      RCY  68  79.407   9.098  -0.245
  519    HB2  RCY  68           HB2      RCY  68  79.615  10.843  -0.366
  520    HA   RCY  68           HA       RCY  68  76.890   9.523  -0.286
  521    HN1  RCY  68           HN1      RCY  68  77.644  12.377   0.213
  522    HA   PRO  69           HA       PRO  69  76.852   8.625   4.026
  523    HB2  PRO  69           HB2      PRO  69  79.243   6.889   3.476
  524    HB3  PRO  69           HB1      PRO  69  77.789   6.528   4.429
  525    HG2  PRO  69           HG2      PRO  69  78.091   5.619   1.939
  526    HG3  PRO  69           HG1      PRO  69  76.510   6.117   2.561
  527    HD2  PRO  69           HD2      PRO  69  78.223   7.453   0.547
  528    HD3  PRO  69           HD1      PRO  69  76.475   7.611   0.822
  529    H    TRP  70           HN       TRP  70  79.665   9.880   2.479
  530    HA   TRP  70           HA       TRP  70  81.240  10.261   4.898
  531    HD1  TRP  70           HD1      TRP  70  81.633   8.294   3.622
  532    HE1  TRP  70           HE1      TRP  70  82.231   6.734   1.659
  533    HE3  TRP  70           HE3      TRP  70  82.842  11.764   0.076
  534    HZ2  TRP  70           HZ2      TRP  70  83.107   6.932  -1.061
  535    HZ3  TRP  70           HZ3      TRP  70  83.553  11.054  -2.186
  536    HH2  TRP  70           HH2      TRP  70  83.687   8.647  -2.761
  537    HB2  TRP  70           HB2      TRP  70  81.561  11.884   2.377
  538    HB3  TRP  70           HB1      TRP  70  82.800  11.360   3.518
  539    H    GLU  71           HN       GLU  71  78.508  11.807   3.553
  540    HA   GLU  71           HA       GLU  71  78.980  14.192   5.309
  541    HB2  GLU  71           HB2      GLU  71  77.601  14.039   2.613
  542    HB3  GLU  71           HB1      GLU  71  77.523  15.444   3.677
  543    HG2  GLU  71           HG2      GLU  71  79.950  15.691   3.592
  544    HG3  GLU  71           HG1      GLU  71  80.092  14.225   2.623
  545    H    ALA  72           HN       ALA  72  76.386  12.345   3.663
  546    HA   ALA  72           HA       ALA  72  74.406  13.181   5.633
  547    HB1  ALA  72           HB1      ALA  72  72.982  11.445   4.459
  548    HB2  ALA  72           HB2      ALA  72  74.372  11.102   3.429
  549    HB3  ALA  72           HB3      ALA  72  73.627  12.701   3.402
  550    H1U  RCY  73           H1U      RCY  73  73.805   1.464   4.471
  551    H1S  RCY  73           H1S      RCY  73  75.699   5.871   3.642
  552    HB1  RCY  73           HB1      RCY  73  72.783   7.768   6.248
  553    HB2  RCY  73           HB2      RCY  73  74.153   6.794   6.786
  554    HA   RCY  73           HA       RCY  73  73.976   9.150   7.783
  555    HN1  RCY  73           HN1      RCY  73  73.828   9.969   5.106
  556    H    ASN  74           HN       ASN  74  75.953   9.827   8.748
  557    HA   ASN  74           HA       ASN  74  78.487   8.794   7.621
  558    HB2  ASN  74           HB2      ASN  74  77.796  10.647   9.903
  559    HB3  ASN  74           HB1      ASN  74  79.428  10.008   9.700
  560   HD21  ASN  74          HD21      ASN  74  76.963  12.082   8.190
  561   HD22  ASN  74          HD22      ASN  74  78.020  12.826   7.089
  562    H    HIS  75           HN       HIS  75  76.133   7.363   9.297
  563    HA   HIS  75           HA       HIS  75  77.572   6.231  11.546
  564    HD1  HIS  75           HD1      HIS  75  75.603   6.373  13.675
  565    HD2  HIS  75           HD2      HIS  75  73.698   7.673  10.199
  566    HE1  HIS  75           HE1      HIS  75  74.185   8.364  14.338
  567    HE2  HIS  75           HE2      HIS  75  73.020   9.165  12.231
  568    HB2  HIS  75           HB2      HIS  75  75.096   5.231  10.103
  569    HB3  HIS  75           HB1      HIS  75  75.674   4.650  11.665
  570    H1U  RCY  76           H1U      RCY  76  79.840  -1.549   5.896
  571    H1S  RCY  76           H1S      RCY  76  79.873   3.053   5.205
  572    HB1  RCY  76           HB1      RCY  76  81.385   3.200   8.515
  573    HB2  RCY  76           HB2      RCY  76  80.956   4.843   8.994
  574    HA   RCY  76           HA       RCY  76  79.013   2.588   9.441
  575    HN1  RCY  76           HN1      RCY  76  79.283   4.889  11.258
  576    H    GLU  77           HN       GLU  77  82.156   3.767  10.358
  577    HA   GLU  77           HA       GLU  77  82.727   1.391  11.885
  578    HB2  GLU  77           HB2      GLU  77  84.243   4.016  11.926
  579    HB3  GLU  77           HB1      GLU  77  84.870   2.420  12.339
  580    HG2  GLU  77           HG2      GLU  77  84.508   1.660  10.029
  581    HG3  GLU  77           HG1      GLU  77  83.844   3.239   9.605
  582    H    LEU  78           HN       LEU  78  80.595   1.925  13.201
  583    HA   LEU  78           HA       LEU  78  81.483   2.759  15.851
  584    HG   LEU  78           HG       LEU  78  79.478   3.923  17.128
  585    HB2  LEU  78           HB2      LEU  78  80.902   4.929  14.678
  586    HB3  LEU  78           HB1      LEU  78  79.250   4.334  14.538
  587   HD11  LEU  78          HD11      LEU  78  80.936   5.643  18.184
  588   HD12  LEU  78          HD12      LEU  78  81.569   6.055  16.590
  589   HD13  LEU  78          HD13      LEU  78  81.865   4.455  17.270
  590   HD21  LEU  78          HD21      LEU  78  78.613   6.198  17.528
  591   HD22  LEU  78          HD22      LEU  78  77.922   5.522  16.053
  592   HD23  LEU  78          HD23      LEU  78  79.221   6.711  15.954
  593    H    HIS  79           HN       HIS  79  78.978   1.653  13.662
  594    HA   HIS  79           HA       HIS  79  78.019  -0.256  15.638
  595    HD1  HIS  79           HD1      HIS  79  76.951  -0.373  17.728
  596    HD2  HIS  79           HD2      HIS  79  76.761   3.754  17.148
  597    HE1  HIS  79           HE1      HIS  79  77.356   0.687  19.992
  598    HE2  HIS  79           HE2      HIS  79  77.243   3.199  19.653
  599    HB2  HIS  79           HB2      HIS  79  76.369   2.172  14.928
  600    HB3  HIS  79           HB1      HIS  79  75.599   0.660  15.410
  601    H    GLU  80           HN       GLU  80  75.865   1.117  13.240
  602    HA   GLU  80           HA       GLU  80  75.242   0.348  11.101
  603    HB2  GLU  80           HB2      GLU  80  77.874  -0.231  11.098
  604    HB3  GLU  80           HB1      GLU  80  77.236  -1.875  11.101
  605    HG2  GLU  80           HG2      GLU  80  75.763  -1.220   9.158
  606    HG3  GLU  80           HG1      GLU  80  76.630   0.315   9.095
  607    H    LEU  81           HN       LEU  81  76.341  -2.434  13.089
  608    HA   LEU  81           HA       LEU  81  74.136  -4.097  12.243
  609    HG   LEU  81           HG       LEU  81  76.229  -3.096  14.932
  610    HB2  LEU  81           HB2      LEU  81  74.858  -5.374  14.439
  611    HB3  LEU  81           HB1      LEU  81  75.922  -5.369  13.034
  612   HD11  LEU  81          HD11      LEU  81  76.989  -5.955  15.573
  613   HD12  LEU  81          HD12      LEU  81  76.046  -4.841  16.563
  614   HD13  LEU  81          HD13      LEU  81  77.773  -4.568  16.330
  615   HD21  LEU  81          HD21      LEU  81  78.302  -4.911  13.681
  616   HD22  LEU  81          HD22      LEU  81  78.516  -3.259  14.260
  617   HD23  LEU  81          HD23      LEU  81  77.575  -3.567  12.801
  618    H    ALA  82           HN       ALA  82  74.612  -1.782  14.829
  619    HA   ALA  82           HA       ALA  82  72.376  -2.589  16.451
  620    HB1  ALA  82           HB1      ALA  82  74.330  -0.971  17.022
  621    HB2  ALA  82           HB2      ALA  82  72.727  -0.588  17.648
  622    HB3  ALA  82           HB3      ALA  82  73.345   0.258  16.229
  623    H    GLN  83           HN       GLN  83  72.718  -0.380  13.701
  624    HA   GLN  83           HA       GLN  83  70.024   0.653  13.861
  625    HB2  GLN  83           HB2      GLN  83  72.320   0.861  12.040
  626    HB3  GLN  83           HB1      GLN  83  70.779   0.857  11.187
  627    HG2  GLN  83           HG2      GLN  83  69.970   2.723  12.474
  628    HG3  GLN  83           HG1      GLN  83  71.347   2.634  13.573
  629   HE21  GLN  83          HE21      GLN  83  70.247   3.905  10.523
  630   HE22  GLN  83          HE22      GLN  83  71.708   4.639  10.069
  631    H    TYR  84           HN       TYR  84  71.060  -2.422  13.314
  632    HA   TYR  84           HA       TYR  84  68.528  -3.110  11.937
  633    HD1  TYR  84           HD2      TYR  84  67.875  -3.320   9.475
  634    HD2  TYR  84           HD1      TYR  84  71.880  -1.810   9.836
  635    HE1  TYR  84           HE2      TYR  84  67.363  -1.562   7.801
  636    HE2  TYR  84           HE1      TYR  84  71.368  -0.052   8.162
  637    HH   TYR  84           HH       TYR  84  68.111   0.237   6.740
  638    HB2  TYR  84           HB2      TYR  84  71.292  -3.813  10.918
  639    HB3  TYR  84           HB1      TYR  84  69.844  -4.696  10.431
  640    H    GLY  85           HN       GLY  85  70.995  -5.496  11.965
  641    HA2  GLY  85           HA2      GLY  85  70.773  -6.456  14.641
  642    HA3  GLY  85           HA1      GLY  85  69.554  -7.265  13.654
  643    H    ILE  86           HN       ILE  86  72.987  -6.914  14.237
  644    HA   ILE  86           HA       ILE  86  74.820  -8.140  13.415
  645    HB   ILE  86           HB       ILE  86  72.857 -10.399  12.987
  646   HG12  ILE  86          HG12      ILE  86  72.452  -9.082  15.171
  647   HG13  ILE  86          HG11      ILE  86  72.735 -10.817  15.322
  648   HG21  ILE  86          HG21      ILE  86  75.128 -10.942  12.436
  649   HG22  ILE  86          HG22      ILE  86  74.814 -11.659  14.016
  650   HG23  ILE  86          HG23      ILE  86  75.735 -10.160  13.896
  651   HD11  ILE  86          HD11      ILE  86  74.997 -10.491  16.005
  652   HD12  ILE  86          HD12      ILE  86  74.054  -9.319  16.925
  653   HD13  ILE  86          HD13      ILE  86  74.976  -8.796  15.516
  654    H1U  RCY  87           H1U      RCY  87  77.102  -5.665   3.250
  655    H1S  RCY  87           H1S      RCY  87  74.973  -6.458   6.572
  656    HB1  RCY  87           HB1      RCY  87  72.862  -5.306   9.840
  657    HB2  RCY  87           HB2      RCY  87  72.497  -5.868   8.211
  658    HA   RCY  87           HA       RCY  87  72.690  -7.959   9.086
  659    HN1  RCY  87           HN1      RCY  87  73.318  -6.585  11.463
  Start of MODEL    9
    1    HA   MET   1           HA       MET   1  52.880   6.497 -12.059
    2    HB2  MET   1           HB2      MET   1  50.027   7.501 -11.848
    3    HB3  MET   1           HB1      MET   1  51.109   7.326 -10.466
    4    HG2  MET   1           HG2      MET   1  51.261   9.616 -11.199
    5    HG3  MET   1           HG1      MET   1  52.754   8.814 -11.685
    6    HE1  MET   1           HE1      MET   1  49.111   9.470 -12.754
    7    HE2  MET   1           HE2      MET   1  49.327  10.379 -14.248
    8    HE3  MET   1           HE3      MET   1  49.938  11.033 -12.730
    9    H    ASN   2           HN       ASN   2  53.131   4.227 -12.007
   10    HA   ASN   2           HA       ASN   2  51.289   2.782 -10.339
   11    HB2  ASN   2           HB2      ASN   2  50.625   1.074 -12.082
   12    HB3  ASN   2           HB1      ASN   2  49.874   2.656 -12.291
   13   HD21  ASN   2          HD21      ASN   2  52.827   0.873 -13.366
   14   HD22  ASN   2          HD22      ASN   2  52.838   1.543 -14.926
   15    H    LEU   3           HN       LEU   3  54.199   3.192 -11.950
   16    HA   LEU   3           HA       LEU   3  55.180   0.466 -11.882
   17    HG   LEU   3           HG       LEU   3  57.640   0.341 -11.862
   18    HB2  LEU   3           HB2      LEU   3  56.089   2.529 -13.210
   19    HB3  LEU   3           HB1      LEU   3  56.959   2.894 -11.721
   20   HD11  LEU   3          HD11      LEU   3  57.929  -0.354 -14.236
   21   HD12  LEU   3          HD12      LEU   3  57.018   1.069 -14.741
   22   HD13  LEU   3          HD13      LEU   3  56.230  -0.191 -13.791
   23   HD21  LEU   3          HD21      LEU   3  59.612   1.050 -13.299
   24   HD22  LEU   3          HD22      LEU   3  59.286   2.098 -11.918
   25   HD23  LEU   3          HD23      LEU   3  58.788   2.591 -13.537
   26    H    GLU   4           HN       GLU   4  54.191   2.304  -9.402
   27    HA   GLU   4           HA       GLU   4  56.268   2.368  -7.506
   28    HB2  GLU   4           HB2      GLU   4  54.274   1.945  -5.845
   29    HB3  GLU   4           HB1      GLU   4  54.309   3.426  -6.801
   30    HG2  GLU   4           HG2      GLU   4  52.738   2.569  -8.375
   31    HG3  GLU   4           HG1      GLU   4  52.910   0.924  -7.762
   32    HA   PRO   5           HA       PRO   5  57.314  -2.036  -7.384
   33    HB2  PRO   5           HB2      PRO   5  58.292  -1.129  -4.694
   34    HB3  PRO   5           HB1      PRO   5  59.106  -2.144  -5.902
   35    HG2  PRO   5           HG2      PRO   5  59.731   0.428  -5.590
   36    HG3  PRO   5           HG1      PRO   5  59.732  -0.342  -7.185
   37    HD2  PRO   5           HD2      PRO   5  57.817   1.634  -6.061
   38    HD3  PRO   5           HD1      PRO   5  58.222   1.294  -7.758
   39    HA   PRO   6           HA       PRO   6  53.999  -3.695  -4.940
   40    HB2  PRO   6           HB2      PRO   6  54.953  -6.203  -4.381
   41    HB3  PRO   6           HB1      PRO   6  54.357  -5.721  -5.982
   42    HG2  PRO   6           HG2      PRO   6  57.157  -5.949  -5.001
   43    HG3  PRO   6           HG1      PRO   6  56.471  -6.386  -6.575
   44    HD2  PRO   6           HD2      PRO   6  57.889  -4.079  -6.160
   45    HD3  PRO   6           HD1      PRO   6  56.613  -4.224  -7.389
   46    H    LYS   7           HN       LYS   7  53.481  -4.582  -2.745
   47    HA   LYS   7           HA       LYS   7  55.647  -4.146  -0.735
   48    HB2  LYS   7           HB2      LYS   7  53.933  -2.990   0.709
   49    HB3  LYS   7           HB1      LYS   7  54.377  -2.082  -0.737
   50    HG2  LYS   7           HG2      LYS   7  52.376  -2.843  -1.892
   51    HG3  LYS   7           HG1      LYS   7  51.957  -3.897  -0.541
   52    HD2  LYS   7           HD2      LYS   7  51.710  -1.944   0.930
   53    HD3  LYS   7           HD1      LYS   7  52.168  -0.875  -0.396
   54    HE2  LYS   7           HE2      LYS   7  49.716  -0.954  -0.146
   55    HE3  LYS   7           HE1      LYS   7  50.212  -1.644  -1.692
   56    HZ1  LYS   7           HZ1      LYS   7  49.569  -3.175   0.770
   57    HZ2  LYS   7           HZ2      LYS   7  50.075  -3.849  -0.706
   58    HZ3  LYS   7           HZ3      LYS   7  48.583  -3.043  -0.604
   59    H    ALA   8           HN       ALA   8  54.290  -6.553  -1.899
   60    HA   ALA   8           HA       ALA   8  53.894  -7.981   0.585
   61    HB1  ALA   8           HB1      ALA   8  51.471  -7.359  -1.128
   62    HB2  ALA   8           HB2      ALA   8  51.706  -6.952   0.572
   63    HB3  ALA   8           HB3      ALA   8  51.504  -8.636   0.089
   64    H    GLU   9           HN       GLU   9  55.010  -7.906  -2.376
   65    HA   GLU   9           HA       GLU   9  54.021 -10.363  -3.552
   66    HB2  GLU   9           HB2      GLU   9  55.050  -8.648  -4.956
   67    HB3  GLU   9           HB1      GLU   9  56.563  -8.787  -4.060
   68    HG2  GLU   9           HG2      GLU   9  56.977 -10.976  -4.881
   69    HG3  GLU   9           HG1      GLU   9  55.317 -11.162  -5.448
   70    H1U  RCY  10           H1U      RCY  10  60.543  -8.008   3.578
   71    H1S  RCY  10           H1S      RCY  10  59.509 -11.939   1.902
   72    HB1  RCY  10           HB1      RCY  10  58.967 -10.460  -0.844
   73    HB2  RCY  10           HB2      RCY  10  58.621 -11.613  -2.133
   74    HA   RCY  10           HA       RCY  10  56.785 -12.566  -0.744
   75    HN1  RCY  10           HN1      RCY  10  56.088  -9.718  -0.940
   76    H    ARG  11           HN       ARG  11  55.668 -12.596   1.227
   77    HA   ARG  11           HA       ARG  11  56.225 -10.593   3.289
   78    HE   ARG  11           HE       ARG  11  53.967 -10.853   7.678
   79    HB2  ARG  11           HB2      ARG  11  54.089 -12.244   2.775
   80    HB3  ARG  11           HB1      ARG  11  54.878 -13.108   4.092
   81    HG2  ARG  11           HG2      ARG  11  54.156 -10.162   4.162
   82    HG3  ARG  11           HG1      ARG  11  53.200 -11.444   4.905
   83    HD2  ARG  11           HD2      ARG  11  55.307 -12.100   6.182
   84    HD3  ARG  11           HD1      ARG  11  56.013 -10.587   5.614
   85   HH11  ARG  11          HH21      ARG  11  55.376  -8.888   5.220
   86   HH12  ARG  11          HH22      ARG  11  54.869  -7.395   5.937
   87   HH21  ARG  11          HH11      ARG  11  53.297  -8.914   8.628
   88   HH22  ARG  11          HH12      ARG  11  53.692  -7.410   7.866
   89    H    SER  12           HN       SER  12  58.074 -12.974   2.125
   90    HA   SER  12           HA       SER  12  60.014 -13.977   3.001
   91    HG   SER  12           HG       SER  12  61.593 -13.371   4.050
   92    HB2  SER  12           HB2      SER  12  59.752 -11.846   4.611
   93    HB3  SER  12           HB1      SER  12  59.405 -13.105   5.793
   94    H    ALA  13           HN       ALA  13  60.064 -15.008   5.816
   95    HA   ALA  13           HA       ALA  13  57.774 -16.844   5.959
   96    HB1  ALA  13           HB1      ALA  13  59.027 -18.875   5.677
   97    HB2  ALA  13           HB2      ALA  13  60.555 -17.995   5.616
   98    HB3  ALA  13           HB3      ALA  13  59.402 -17.856   4.287
   99    H    THR  14           HN       THR  14  59.736 -14.851   7.479
  100    HA   THR  14           HA       THR  14  59.255 -15.981  10.088
  101    HB   THR  14           HB       THR  14  61.099 -17.454   9.599
  102    HG1  THR  14           HG1      THR  14  61.710 -15.217  11.195
  103   HG21  THR  14          HG21      THR  14  63.294 -16.547   8.861
  104   HG22  THR  14          HG22      THR  14  62.565 -14.947   8.727
  105   HG23  THR  14          HG23      THR  14  62.020 -16.255   7.677
  106    H    ARG  15           HN       ARG  15  60.075 -13.508   7.995
  107    HA   ARG  15           HA       ARG  15  60.545 -11.230   8.308
  108    HE   ARG  15           HE       ARG  15  56.963 -10.172   9.416
  109    HB2  ARG  15           HB2      ARG  15  58.424 -11.601   9.707
  110    HB3  ARG  15           HB1      ARG  15  59.490 -11.640  11.112
  111    HG2  ARG  15           HG2      ARG  15  60.317  -9.406  10.603
  112    HG3  ARG  15           HG1      ARG  15  59.379  -9.365   9.110
  113    HD2  ARG  15           HD2      ARG  15  58.277  -9.496  11.931
  114    HD3  ARG  15           HD1      ARG  15  58.170  -8.129  10.822
  115   HH11  ARG  15          HH21      ARG  15  56.659  -8.836  12.580
  116   HH12  ARG  15          HH22      ARG  15  54.970  -9.195  12.714
  117   HH21  ARG  15          HH11      ARG  15  54.759 -10.649   9.573
  118   HH22  ARG  15          HH12      ARG  15  53.894 -10.221  11.012
  119    H    VAL  16           HN       VAL  16  62.884 -12.027   8.325
  120    HA   VAL  16           HA       VAL  16  64.385 -12.489  10.659
  121    HB   VAL  16           HB       VAL  16  65.202 -10.999   8.146
  122   HG11  VAL  16          HG11      VAL  16  67.513 -11.793   8.877
  123   HG12  VAL  16          HG12      VAL  16  66.796 -12.141  10.450
  124   HG13  VAL  16          HG13      VAL  16  66.818 -10.488   9.837
  125   HG21  VAL  16          HG21      VAL  16  65.993 -13.131   7.367
  126   HG22  VAL  16          HG22      VAL  16  64.345 -13.387   7.939
  127   HG23  VAL  16          HG23      VAL  16  65.712 -13.878   8.939
  128    H    MET  17           HN       MET  17  65.812 -10.970  11.844
  129    HA   MET  17           HA       MET  17  64.474  -8.801  12.997
  130    HB2  MET  17           HB2      MET  17  67.447  -9.268  12.638
  131    HB3  MET  17           HB1      MET  17  66.782  -7.982  13.647
  132    HG2  MET  17           HG2      MET  17  66.019 -10.889  13.991
  133    HG3  MET  17           HG1      MET  17  67.353 -10.142  14.869
  134    HE1  MET  17           HE1      MET  17  64.545 -10.520  17.513
  135    HE2  MET  17           HE2      MET  17  66.010 -11.192  16.801
  136    HE3  MET  17           HE3      MET  17  64.450 -11.496  16.042
  137    H    GLY  18           HN       GLY  18  63.518  -7.322  11.606
  138    HA2  GLY  18           HA2      GLY  18  64.883  -5.104  10.650
  139    HA3  GLY  18           HA1      GLY  18  64.907  -6.235   9.296
  140    H    GLY  19           HN       GLY  19  62.243  -6.198  11.567
  141    HA2  GLY  19           HA2      GLY  19  60.298  -5.881   9.485
  142    HA3  GLY  19           HA1      GLY  19  59.964  -5.759  11.213
  143    HA   PRO  20           HA       PRO  20  59.427  -1.403  11.370
  144    HB2  PRO  20           HB2      PRO  20  62.122  -1.160  12.668
  145    HB3  PRO  20           HB1      PRO  20  60.568  -0.457  13.160
  146    HG2  PRO  20           HG2      PRO  20  61.591  -2.608  14.371
  147    HG3  PRO  20           HG1      PRO  20  59.848  -2.397  14.144
  148    HD2  PRO  20           HD2      PRO  20  61.689  -4.288  12.798
  149    HD3  PRO  20           HD1      PRO  20  59.927  -4.384  13.005
  150    H1U  RCY  21           H1U      RCY  21  62.890   4.119   6.635
  151    H1S  RCY  21           H1S      RCY  21  63.934   0.402   8.063
  152    HB1  RCY  21           HB1      RCY  21  63.951  -2.928   7.808
  153    HB2  RCY  21           HB2      RCY  21  64.683  -2.354   9.306
  154    HA   RCY  21           HA       RCY  21  63.351  -0.176   8.896
  155    HN1  RCY  21           HN1      RCY  21  62.423  -2.650  10.068
  156    H    THR  22           HN       THR  22  62.087   0.884   7.439
  157    HA   THR  22           HA       THR  22  61.095  -0.645   5.092
  158    HB   THR  22           HB       THR  22  58.944   0.791   5.291
  159    HG1  THR  22           HG1      THR  22  60.285   1.585   7.425
  160   HG21  THR  22          HG21      THR  22  59.562  -1.465   7.216
  161   HG22  THR  22          HG22      THR  22  58.892  -1.612   5.592
  162   HG23  THR  22          HG23      THR  22  57.935  -0.875   6.877
  163    HA   PRO  23           HA       PRO  23  62.686   2.595   2.549
  164    HB2  PRO  23           HB2      PRO  23  59.848   2.958   1.637
  165    HB3  PRO  23           HB1      PRO  23  61.331   2.828   0.671
  166    HG2  PRO  23           HG2      PRO  23  59.642   0.771   0.973
  167    HG3  PRO  23           HG1      PRO  23  61.391   0.545   0.825
  168    HD2  PRO  23           HD2      PRO  23  59.665   0.168   3.192
  169    HD3  PRO  23           HD1      PRO  23  61.292  -0.468   2.874
  170    H    ARG  24           HN       ARG  24  63.178   4.637   3.245
  171    HA   ARG  24           HA       ARG  24  60.974   6.375   4.261
  172    HE   ARG  24           HE       ARG  24  62.084   6.897   8.601
  173    HB2  ARG  24           HB2      ARG  24  63.555   5.663   5.658
  174    HB3  ARG  24           HB1      ARG  24  62.710   7.169   6.014
  175    HG2  ARG  24           HG2      ARG  24  61.127   4.628   6.009
  176    HG3  ARG  24           HG1      ARG  24  62.179   4.954   7.387
  177    HD2  ARG  24           HD2      ARG  24  60.305   7.079   6.370
  178    HD3  ARG  24           HD1      ARG  24  59.722   5.825   7.465
  179   HH11  ARG  24          HH21      ARG  24  58.887   7.829   7.710
  180   HH12  ARG  24          HH22      ARG  24  58.750   9.034   8.946
  181   HH21  ARG  24          HH11      ARG  24  61.924   8.465  10.221
  182   HH22  ARG  24          HH12      ARG  24  60.470   9.394  10.368
  183    H    LYS  25           HN       LYS  25  61.256   8.561   3.770
  184    HA   LYS  25           HA       LYS  25  62.715   9.316   1.512
  185    HB2  LYS  25           HB2      LYS  25  61.986  11.052   3.893
  186    HB3  LYS  25           HB1      LYS  25  62.440  11.652   2.297
  187    HG2  LYS  25           HG2      LYS  25  60.495  10.750   1.281
  188    HG3  LYS  25           HG1      LYS  25  60.153   9.714   2.667
  189    HD2  LYS  25           HD2      LYS  25  58.650  11.683   2.614
  190    HD3  LYS  25           HD1      LYS  25  59.677  11.690   4.049
  191    HE2  LYS  25           HE2      LYS  25  61.085  13.377   3.178
  192    HE3  LYS  25           HE1      LYS  25  60.504  13.131   1.531
  193    HZ1  LYS  25           HZ1      LYS  25  58.368  14.005   2.157
  194    HZ2  LYS  25           HZ2      LYS  25  59.574  15.127   2.572
  195    HZ3  LYS  25           HZ3      LYS  25  58.856  14.164   3.774
  196    H    GLY  26           HN       GLY  26  63.660  10.430   4.780
  197    HA2  GLY  26           HA2      GLY  26  65.794  10.652   5.737
  198    HA3  GLY  26           HA1      GLY  26  66.372   9.478   4.553
  199    HA   PRO  27           HA       PRO  27  68.101  13.876   3.827
  200    HB2  PRO  27           HB2      PRO  27  70.462  12.101   3.343
  201    HB3  PRO  27           HB1      PRO  27  70.386  13.679   4.152
  202    HG2  PRO  27           HG2      PRO  27  70.625  11.410   5.530
  203    HG3  PRO  27           HG1      PRO  27  69.678  12.777   6.139
  204    HD2  PRO  27           HD2      PRO  27  68.728  10.177   5.034
  205    HD3  PRO  27           HD1      PRO  27  67.957  11.248   6.224
  206    HA   PRO  28           HA       PRO  28  67.603  13.882  -0.572
  207    HB2  PRO  28           HB2      PRO  28  70.431  14.871  -0.710
  208    HB3  PRO  28           HB1      PRO  28  68.977  15.510  -1.500
  209    HG2  PRO  28           HG2      PRO  28  70.037  16.654   0.678
  210    HG3  PRO  28           HG1      PRO  28  68.294  16.641   0.367
  211    HD2  PRO  28           HD2      PRO  28  69.830  15.155   2.412
  212    HD3  PRO  28           HD1      PRO  28  68.098  15.550   2.370
  213    H    LYS  29           HN       LYS  29  68.525  12.870  -2.583
  214    HA   LYS  29           HA       LYS  29  69.254  10.207  -2.310
  215    HB2  LYS  29           HB2      LYS  29  70.351  10.499  -4.629
  216    HB3  LYS  29           HB1      LYS  29  68.643  10.911  -4.485
  217    HG2  LYS  29           HG2      LYS  29  70.404  13.162  -3.835
  218    HG3  LYS  29           HG1      LYS  29  70.619  12.583  -5.487
  219    HD2  LYS  29           HD2      LYS  29  68.202  12.768  -5.887
  220    HD3  LYS  29           HD1      LYS  29  67.957  13.306  -4.225
  221    HE2  LYS  29           HE2      LYS  29  69.700  14.746  -6.245
  222    HE3  LYS  29           HE1      LYS  29  68.039  15.199  -5.861
  223    HZ1  LYS  29           HZ1      LYS  29  69.021  16.473  -4.321
  224    HZ2  LYS  29           HZ2      LYS  29  70.462  15.572  -4.323
  225    HZ3  LYS  29           HZ3      LYS  29  69.123  15.037  -3.424
  226    H1U  RCY  30           H1U      RCY  30  69.811   9.408  -5.304
  227    H1S  RCY  30           H1S      RCY  30  71.376  13.039  -4.110
  228    HB1  RCY  30           HB1      RCY  30  74.064  11.437  -3.236
  229    HB2  RCY  30           HB2      RCY  30  75.106  12.537  -2.333
  230    HA   RCY  30           HA       RCY  30  73.451  11.223  -0.922
  231    HN1  RCY  30           HN1      RCY  30  71.242  12.969  -1.751
  232    H    LYS  31           HN       LYS  31  75.250  12.628   0.060
  233    HA   LYS  31           HA       LYS  31  74.504  15.358   0.776
  234    HB2  LYS  31           HB2      LYS  31  73.467  13.336   2.366
  235    HB3  LYS  31           HB1      LYS  31  74.936  13.775   3.230
  236    HG2  LYS  31           HG2      LYS  31  72.836  15.755   2.297
  237    HG3  LYS  31           HG1      LYS  31  72.966  15.134   3.943
  238    HD2  LYS  31           HD2      LYS  31  75.405  16.327   2.687
  239    HD3  LYS  31           HD1      LYS  31  74.139  17.418   3.252
  240    HE2  LYS  31           HE2      LYS  31  75.225  15.207   5.000
  241    HE3  LYS  31           HE1      LYS  31  75.977  16.801   4.945
  242    HZ1  LYS  31           HZ1      LYS  31  73.432  17.478   5.257
  243    HZ2  LYS  31           HZ2      LYS  31  74.490  17.220   6.561
  244    HZ3  LYS  31           HZ3      LYS  31  73.425  15.990   6.072
  245    H    GLN  32           HN       GLN  32  76.656  15.127  -0.527
  246    HA   GLN  32           HA       GLN  32  78.992  15.331  -0.538
  247    HB2  GLN  32           HB2      GLN  32  78.713  15.777   2.444
  248    HB3  GLN  32           HB1      GLN  32  79.986  16.375   1.380
  249    HG2  GLN  32           HG2      GLN  32  78.369  17.781   0.190
  250    HG3  GLN  32           HG1      GLN  32  77.059  17.150   1.189
  251   HE21  GLN  32          HE21      GLN  32  79.434  17.206   3.385
  252   HE22  GLN  32          HE22      GLN  32  79.302  18.795   3.969
  253    H    ARG  33           HN       ARG  33  80.077  13.461  -0.895
  254    HA   ARG  33           HA       ARG  33  80.230  11.466   1.338
  255    HE   ARG  33           HE       ARG  33  78.279   7.458  -1.079
  256    HB2  ARG  33           HB2      ARG  33  80.299  11.101  -1.668
  257    HB3  ARG  33           HB1      ARG  33  80.739   9.825  -0.532
  258    HG2  ARG  33           HG2      ARG  33  78.541   9.812   0.435
  259    HG3  ARG  33           HG1      ARG  33  78.087  11.281  -0.429
  260    HD2  ARG  33           HD2      ARG  33  77.103   9.467  -1.642
  261    HD3  ARG  33           HD1      ARG  33  78.497   9.990  -2.587
  262   HH11  ARG  33          HH21      ARG  33  80.154   9.747  -2.849
  263   HH12  ARG  33          HH22      ARG  33  81.420   8.624  -3.219
  264   HH21  ARG  33          HH11      ARG  33  79.921   5.978  -1.552
  265   HH22  ARG  33          HH12      ARG  33  81.288   6.490  -2.485
  266    H    GLN  34           HN       GLN  34  82.163  11.916   2.335
  267    HA   GLN  34           HA       GLN  34  84.502  12.765   0.780
  268    HB2  GLN  34           HB2      GLN  34  84.313  11.997   3.709
  269    HB3  GLN  34           HB1      GLN  34  85.632  12.878   2.938
  270    HG2  GLN  34           HG2      GLN  34  84.312  14.572   3.937
  271    HG3  GLN  34           HG1      GLN  34  83.832  14.593   2.240
  272   HE21  GLN  34          HE21      GLN  34  82.845  13.243   5.424
  273   HE22  GLN  34          HE22      GLN  34  81.194  13.150   5.042
  274    H    THR  35           HN       THR  35  86.116  11.423   0.067
  275    HA   THR  35           HA       THR  35  86.724   8.885   1.313
  276    HB   THR  35           HB       THR  35  84.807   7.978   0.274
  277    HG1  THR  35           HG1      THR  35  85.923   6.491  -0.663
  278   HG21  THR  35          HG21      THR  35  84.106   9.828  -1.078
  279   HG22  THR  35          HG22      THR  35  84.329   8.465  -2.175
  280   HG23  THR  35          HG23      THR  35  85.555   9.728  -2.077
  281    H    ARG  36           HN       ARG  36  88.629  10.524   1.026
  282    HA   ARG  36           HA       ARG  36  89.838  10.370  -1.682
  283    HE   ARG  36           HE       ARG  36  88.813  14.908  -2.575
  284    HB2  ARG  36           HB2      ARG  36  90.930  11.758   0.779
  285    HB3  ARG  36           HB1      ARG  36  91.403  12.023  -0.899
  286    HG2  ARG  36           HG2      ARG  36  88.654  12.585   0.253
  287    HG3  ARG  36           HG1      ARG  36  89.879  13.804  -0.102
  288    HD2  ARG  36           HD2      ARG  36  89.866  12.794  -2.500
  289    HD3  ARG  36           HD1      ARG  36  88.322  12.085  -2.026
  290   HH11  ARG  36          HH21      ARG  36  86.939  12.564  -0.878
  291   HH12  ARG  36          HH22      ARG  36  85.548  13.586  -0.734
  292   HH21  ARG  36          HH11      ARG  36  87.007  16.256  -2.396
  293   HH22  ARG  36          HH12      ARG  36  85.586  15.676  -1.594
  294    H    GLN  37           HN       GLN  37  89.630   8.266   0.711
  295    HA   GLN  37           HA       GLN  37  92.524   7.555   0.802
  296    HB2  GLN  37           HB2      GLN  37  91.137   5.706   2.377
  297    HB3  GLN  37           HB1      GLN  37  92.003   7.123   2.964
  298    HG2  GLN  37           HG2      GLN  37  89.741   7.214   3.831
  299    HG3  GLN  37           HG1      GLN  37  89.907   8.470   2.605
  300   HE21  GLN  37          HE21      GLN  37  87.788   6.122   3.603
  301   HE22  GLN  37          HE22      GLN  37  87.022   5.783   2.127
  302    H1U  RCY  38           H1U      RCY  38  82.923   3.226  -2.808
  303    H1S  RCY  38           H1S      RCY  38  87.236   3.246  -2.479
  304    HB1  RCY  38           HB1      RCY  38  89.602   3.639  -2.765
  305    HB2  RCY  38           HB2      RCY  38  90.397   5.187  -2.483
  306    HA   RCY  38           HA       RCY  38  89.304   3.407  -0.284
  307    HN1  RCY  38           HN1      RCY  38  89.723   5.373   0.929
  308    H    LYS  39           HN       LYS  39  90.669   1.799   0.406
  309    HA   LYS  39           HA       LYS  39  92.535   0.379   0.446
  310    HB2  LYS  39           HB2      LYS  39  91.976   0.451  -2.069
  311    HB3  LYS  39           HB1      LYS  39  93.310   1.598  -2.209
  312    HG2  LYS  39           HG2      LYS  39  94.661  -0.206  -0.876
  313    HG3  LYS  39           HG1      LYS  39  93.391  -1.303  -1.417
  314    HD2  LYS  39           HD2      LYS  39  95.098   0.441  -3.218
  315    HD3  LYS  39           HD1      LYS  39  95.276  -1.301  -3.006
  316    HE2  LYS  39           HE2      LYS  39  93.976  -1.108  -4.968
  317    HE3  LYS  39           HE1      LYS  39  92.787  -1.437  -3.707
  318    HZ1  LYS  39           HZ1      LYS  39  91.884   0.574  -3.938
  319    HZ2  LYS  39           HZ2      LYS  39  92.711   0.652  -5.420
  320    HZ3  LYS  39           HZ3      LYS  39  93.387   1.356  -4.029
  321    H    SER  40           HN       SER  40  93.438   1.695   2.196
  322    HA   SER  40           HA       SER  40  96.086   2.703   1.538
  323    HG   SER  40           HG       SER  40  95.805   4.904   0.344
  324    HB2  SER  40           HB2      SER  40  93.920   4.629   2.414
  325    HB3  SER  40           HB1      SER  40  95.640   4.990   2.532
  326    H    LYS  41           HN       LYS  41  93.490   2.670   3.994
  327    HA   LYS  41           HA       LYS  41  95.481   2.574   6.156
  328    HB2  LYS  41           HB2      LYS  41  92.456   2.469   6.125
  329    HB3  LYS  41           HB1      LYS  41  93.409   2.344   7.603
  330    HG2  LYS  41           HG2      LYS  41  94.267   4.537   7.374
  331    HG3  LYS  41           HG1      LYS  41  93.798   4.634   5.676
  332    HD2  LYS  41           HD2      LYS  41  91.615   4.162   7.646
  333    HD3  LYS  41           HD1      LYS  41  92.341   5.770   7.630
  334    HE2  LYS  41           HE2      LYS  41  90.492   5.787   6.074
  335    HE3  LYS  41           HE1      LYS  41  91.984   5.819   5.134
  336    HZ1  LYS  41           HZ1      LYS  41  90.166   4.173   4.463
  337    HZ2  LYS  41           HZ2      LYS  41  90.671   3.265   5.807
  338    HZ3  LYS  41           HZ3      LYS  41  91.762   3.603   4.549
  339    HA   PRO  42           HA       PRO  42  95.611  -1.872   6.182
  340    HB2  PRO  42           HB2      PRO  42  96.616  -2.295   8.681
  341    HB3  PRO  42           HB1      PRO  42  97.595  -1.638   7.354
  342    HG2  PRO  42           HG2      PRO  42  96.284  -0.206   9.612
  343    HG3  PRO  42           HG1      PRO  42  97.882   0.048   8.889
  344    HD2  PRO  42           HD2      PRO  42  95.705   1.623   8.313
  345    HD3  PRO  42           HD1      PRO  42  97.046   1.358   7.176
  346    HA   PRO  43           HA       PRO  43  91.958  -3.296   8.274
  347    HB2  PRO  43           HB2      PRO  43  92.470  -5.952   8.554
  348    HB3  PRO  43           HB1      PRO  43  92.167  -5.203   6.973
  349    HG2  PRO  43           HG2      PRO  43  94.755  -5.977   8.224
  350    HG3  PRO  43           HG1      PRO  43  94.220  -6.139   6.543
  351    HD2  PRO  43           HD2      PRO  43  95.876  -4.120   7.418
  352    HD3  PRO  43           HD1      PRO  43  94.803  -3.970   6.009
  353    H    LYS  44           HN       LYS  44  91.258  -3.294  10.392
  354    HA   LYS  44           HA       LYS  44  92.891  -4.551  12.492
  355    HB2  LYS  44           HB2      LYS  44  93.425  -1.921  11.981
  356    HB3  LYS  44           HB1      LYS  44  92.138  -1.756  13.170
  357    HG2  LYS  44           HG2      LYS  44  94.020  -1.894  14.544
  358    HG3  LYS  44           HG1      LYS  44  93.505  -3.580  14.487
  359    HD2  LYS  44           HD2      LYS  44  95.119  -4.055  12.719
  360    HD3  LYS  44           HD1      LYS  44  95.588  -2.356  12.654
  361    HE2  LYS  44           HE2      LYS  44  96.245  -2.543  15.092
  362    HE3  LYS  44           HE1      LYS  44  95.995  -4.283  14.954
  363    HZ1  LYS  44           HZ1      LYS  44  97.725  -4.494  13.445
  364    HZ2  LYS  44           HZ2      LYS  44  98.331  -3.366  14.561
  365    HZ3  LYS  44           HZ3      LYS  44  97.738  -2.842  13.057
  366    H    LYS  45           HN       LYS  45  90.420  -1.991  12.741
  367    HA   LYS  45           HA       LYS  45  88.123  -3.583  12.992
  368    HB2  LYS  45           HB2      LYS  45  89.917  -3.909  15.239
  369    HB3  LYS  45           HB1      LYS  45  88.436  -3.129  15.787
  370    HG2  LYS  45           HG2      LYS  45  87.074  -4.902  14.910
  371    HG3  LYS  45           HG1      LYS  45  88.442  -5.608  14.048
  372    HD2  LYS  45           HD2      LYS  45  89.560  -5.990  16.265
  373    HD3  LYS  45           HD1      LYS  45  88.078  -5.448  17.053
  374    HE2  LYS  45           HE2      LYS  45  88.075  -7.887  16.917
  375    HE3  LYS  45           HE1      LYS  45  86.826  -7.240  15.855
  376    HZ1  LYS  45           HZ1      LYS  45  89.558  -7.958  14.948
  377    HZ2  LYS  45           HZ2      LYS  45  88.231  -7.533  13.976
  378    HZ3  LYS  45           HZ3      LYS  45  88.222  -8.999  14.835
  379    H    GLY  46           HN       GLY  46  86.901  -1.854  12.339
  380    HA2  GLY  46           HA2      GLY  46  85.561   0.058  12.804
  381    HA3  GLY  46           HA1      GLY  46  86.521   0.345  14.256
  382    H    VAL  47           HN       VAL  47  89.100   0.266  12.943
  383    HA   VAL  47           HA       VAL  47  89.542   2.940  12.321
  384    HB   VAL  47           HB       VAL  47  91.574   2.206  11.126
  385   HG11  VAL  47          HG11      VAL  47  92.587   1.011  12.959
  386   HG12  VAL  47          HG12      VAL  47  91.025   0.386  13.486
  387   HG13  VAL  47          HG13      VAL  47  91.387   2.104  13.649
  388   HG21  VAL  47          HG21      VAL  47  90.796   0.382   9.802
  389   HG22  VAL  47          HG22      VAL  47  90.142  -0.458  11.208
  390   HG23  VAL  47          HG23      VAL  47  91.888  -0.341  10.983
  391    H    GLN  48           HN       GLN  48  89.042   4.244  10.610
  392    HA   GLN  48           HA       GLN  48  88.705   3.175   7.919
  393    HB2  GLN  48           HB2      GLN  48  86.434   3.186   9.606
  394    HB3  GLN  48           HB1      GLN  48  86.225   4.561   8.523
  395    HG2  GLN  48           HG2      GLN  48  86.842   1.719   7.659
  396    HG3  GLN  48           HG1      GLN  48  85.270   2.509   7.536
  397   HE21  GLN  48          HE21      GLN  48  88.502   2.349   6.134
  398   HE22  GLN  48          HE22      GLN  48  88.175   3.354   4.805
  399    H    GLY  49           HN       GLY  49  89.172   5.685  10.143
  400    HA2  GLY  49           HA2      GLY  49  90.077   7.831   9.695
  401    HA3  GLY  49           HA1      GLY  49  89.812   7.551   7.974
  402    H1U  RCY  50           H1U      RCY  50  85.137   2.443   3.401
  403    H1S  RCY  50           H1S      RCY  50  86.051   5.614   5.806
  404    HB1  RCY  50           HB1      RCY  50  83.668   8.264   8.083
  405    HB2  RCY  50           HB2      RCY  50  84.539   6.768   8.423
  406    HA   RCY  50           HA       RCY  50  85.861   9.483   8.138
  407    HN1  RCY  50           HN1      RCY  50  86.979   6.834   8.331
  408    H    GLY  51           HN       GLY  51  83.496   8.100   9.846
  409    HA2  GLY  51           HA2      GLY  51  82.776   8.207  12.090
  410    HA3  GLY  51           HA1      GLY  51  84.456   8.458  12.570
  411    H    ASP  52           HN       ASP  52  83.560  10.602  10.120
  412    HA   ASP  52           HA       ASP  52  83.354  12.810  12.108
  413    HB2  ASP  52           HB2      ASP  52  84.015  12.718   9.158
  414    HB3  ASP  52           HB1      ASP  52  83.686  14.232  10.000
  415    H    ASP  53           HN       ASP  53  81.587  11.234   9.502
  416    HA   ASP  53           HA       ASP  53  79.514  13.244   9.304
  417    HB2  ASP  53           HB2      ASP  53  78.267  11.485   8.075
  418    HB3  ASP  53           HB1      ASP  53  79.920  11.647   7.482
  419    H    ILE  54           HN       ILE  54  77.167  11.683   9.536
  420    HA   ILE  54           HA       ILE  54  77.098  11.091  12.474
  421    HB   ILE  54           HB       ILE  54  74.783  12.238  10.904
  422   HG12  ILE  54          HG12      ILE  54  75.628  14.350  12.341
  423   HG13  ILE  54          HG11      ILE  54  77.188  13.578  12.051
  424   HG21  ILE  54          HG21      ILE  54  75.417  12.404  13.857
  425   HG22  ILE  54          HG22      ILE  54  74.497  11.069  13.162
  426   HG23  ILE  54          HG23      ILE  54  73.875  12.716  13.060
  427   HD11  ILE  54          HD11      ILE  54  75.249  14.731  10.074
  428   HD12  ILE  54          HD12      ILE  54  76.299  13.406   9.572
  429   HD13  ILE  54          HD13      ILE  54  77.001  14.915  10.156
  430    HA   PRO  55           HA       PRO  55  75.486   7.452  10.115
  431    HB2  PRO  55           HB2      PRO  55  77.018   5.553  11.301
  432    HB3  PRO  55           HB1      PRO  55  77.616   6.550   9.960
  433    HG2  PRO  55           HG2      PRO  55  78.158   6.779  12.871
  434    HG3  PRO  55           HG1      PRO  55  79.235   7.059  11.494
  435    HD2  PRO  55           HD2      PRO  55  77.946   9.067  12.933
  436    HD3  PRO  55           HD1      PRO  55  78.595   9.252  11.289
  437    H    GLY  56           HN       GLY  56  74.157   5.669  10.920
  438    HA2  GLY  56           HA2      GLY  56  72.910   4.492  12.565
  439    HA3  GLY  56           HA1      GLY  56  73.744   5.415  13.817
  440    H    MET  57           HN       MET  57  72.419   7.253  11.227
  441    HA   MET  57           HA       MET  57  69.794   7.654  12.433
  442    HB2  MET  57           HB2      MET  57  71.342   8.950  13.948
  443    HB3  MET  57           HB1      MET  57  71.774   9.947  12.560
  444    HG2  MET  57           HG2      MET  57  69.993  11.240  13.071
  445    HG3  MET  57           HG1      MET  57  68.979   9.902  12.529
  446    HE1  MET  57           HE1      MET  57  67.785   8.084  15.496
  447    HE2  MET  57           HE2      MET  57  69.276   7.581  14.704
  448    HE3  MET  57           HE3      MET  57  67.958   8.251  13.744
  449    H    GLU  58           HN       GLU  58  69.700   6.962  10.034
  450    HA   GLU  58           HA       GLU  58  69.164   9.365   8.447
  451    HB2  GLU  58           HB2      GLU  58  70.621   8.557   6.539
  452    HB3  GLU  58           HB1      GLU  58  71.510   9.161   7.936
  453    HG2  GLU  58           HG2      GLU  58  70.845   6.231   7.633
  454    HG3  GLU  58           HG1      GLU  58  72.305   6.927   6.929
  455    H    GLY  59           HN       GLY  59  69.663   7.202   6.129
  456    HA2  GLY  59           HA2      GLY  59  68.016   5.030   6.250
  457    HA3  GLY  59           HA1      GLY  59  66.855   6.351   6.100
  458    H1U  RCY  60           H1U      RCY  60  76.398   5.719   2.950
  459    H1S  RCY  60           H1S      RCY  60  72.417   6.175   1.673
  460    HB1  RCY  60           HB1      RCY  60  70.024   6.681   0.968
  461    HB2  RCY  60           HB2      RCY  60  69.991   5.776   2.481
  462    HA   RCY  60           HA       RCY  60  68.557   8.415   2.094
  463    HN1  RCY  60           HN1      RCY  60  68.311   8.060   4.404
  464    H    GLY  61           HN       GLY  61  68.398   6.901  -0.116
  465    HA2  GLY  61           HA2      GLY  61  66.387   4.836  -0.056
  466    HA3  GLY  61           HA1      GLY  61  65.671   6.385  -0.510
  467    H    THR  62           HN       THR  62  67.115   7.597  -2.221
  468    HA   THR  62           HA       THR  62  67.703   7.587  -4.501
  469    HB   THR  62           HB       THR  62  69.623   5.973  -4.974
  470    HG1  THR  62           HG1      THR  62  70.028   5.464  -2.360
  471   HG21  THR  62          HG21      THR  62  69.629   7.916  -2.665
  472   HG22  THR  62          HG22      THR  62  70.221   8.165  -4.308
  473   HG23  THR  62          HG23      THR  62  71.106   7.114  -3.202
  474    H    ASP  63           HN       ASP  63  65.889   6.935  -5.661
  475    HA   ASP  63           HA       ASP  63  64.962   4.194  -5.733
  476    HB2  ASP  63           HB2      ASP  63  63.676   5.034  -7.776
  477    HB3  ASP  63           HB1      ASP  63  63.365   5.901  -6.271
  478    H    ILE  64           HN       ILE  64  67.613   3.971  -6.135
  479    HA   ILE  64           HA       ILE  64  69.240   3.119  -7.574
  480    HB   ILE  64           HB       ILE  64  66.856   2.382  -9.282
  481   HG12  ILE  64          HG12      ILE  64  67.786   0.136  -7.901
  482   HG13  ILE  64          HG11      ILE  64  67.794   1.422  -6.693
  483   HG21  ILE  64          HG21      ILE  64  68.798   2.068 -10.591
  484   HG22  ILE  64          HG22      ILE  64  68.514   0.481  -9.876
  485   HG23  ILE  64          HG23      ILE  64  69.753   1.542  -9.204
  486   HD11  ILE  64          HD11      ILE  64  65.458   1.956  -7.208
  487   HD12  ILE  64          HD12      ILE  64  65.604   0.250  -6.786
  488   HD13  ILE  64          HD13      ILE  64  65.439   0.729  -8.475
  489    H    THR  65           HN       THR  65  69.909   5.369  -8.019
  490    HA   THR  65           HA       THR  65  68.910   6.901 -10.173
  491    HB   THR  65           HB       THR  65  71.849   6.719  -9.474
  492    HG1  THR  65           HG1      THR  65  70.275   6.930  -7.650
  493   HG21  THR  65          HG21      THR  65  71.907   9.019 -10.159
  494   HG22  THR  65          HG22      THR  65  70.147   9.104 -10.230
  495   HG23  THR  65          HG23      THR  65  71.031   8.138 -11.411
  496    H    VAL  66           HN       VAL  66  70.641   3.945 -10.123
  497    HA   VAL  66           HA       VAL  66  70.434   3.698 -13.019
  498    HB   VAL  66           HB       VAL  66  73.071   3.028 -12.882
  499   HG11  VAL  66          HG11      VAL  66  72.190   5.888 -13.325
  500   HG12  VAL  66          HG12      VAL  66  71.813   4.597 -14.466
  501   HG13  VAL  66          HG13      VAL  66  73.493   5.017 -14.133
  502   HG21  VAL  66          HG21      VAL  66  72.998   3.950 -10.468
  503   HG22  VAL  66          HG22      VAL  66  72.892   5.543 -11.217
  504   HG23  VAL  66          HG23      VAL  66  74.301   4.524 -11.509
  505    H    ILE  67           HN       ILE  67  72.680   2.199 -10.702
  506    HA   ILE  67           HA       ILE  67  71.054  -0.293 -10.787
  507    HB   ILE  67           HB       ILE  67  74.055  -0.229 -11.208
  508   HG12  ILE  67          HG12      ILE  67  71.814  -0.726 -13.196
  509   HG13  ILE  67          HG11      ILE  67  72.833   0.713 -13.148
  510   HG21  ILE  67          HG21      ILE  67  72.029  -2.469 -11.493
  511   HG22  ILE  67          HG22      ILE  67  73.097  -2.257 -10.106
  512   HG23  ILE  67          HG23      ILE  67  73.775  -2.604 -11.696
  513   HD11  ILE  67          HD11      ILE  67  73.811  -0.702 -14.801
  514   HD12  ILE  67          HD12      ILE  67  73.661  -2.127 -13.773
  515   HD13  ILE  67          HD13      ILE  67  74.831  -0.870 -13.373
  516    H1U  RCY  68           H1U      RCY  68  74.610   2.432  -1.241
  517    H1S  RCY  68           H1S      RCY  68  70.681   3.333  -3.957
  518    HB1  RCY  68           HB1      RCY  68  70.603  -0.087  -5.000
  519    HB2  RCY  68           HB2      RCY  68  69.646   0.100  -6.464
  520    HA   RCY  68           HA       RCY  68  72.647   0.292  -6.592
  521    HN1  RCY  68           HN1      RCY  68  70.487  -0.082  -8.575
  522    HA   PRO  69           HA       PRO  69  73.632  -3.861  -5.516
  523    HB2  PRO  69           HB2      PRO  69  72.157  -3.431  -2.933
  524    HB3  PRO  69           HB1      PRO  69  73.757  -4.153  -3.207
  525    HG2  PRO  69           HG2      PRO  69  73.502  -1.650  -2.349
  526    HG3  PRO  69           HG1      PRO  69  74.771  -2.100  -3.499
  527    HD2  PRO  69           HD2      PRO  69  72.296  -0.516  -3.966
  528    HD3  PRO  69           HD1      PRO  69  73.837  -0.491  -4.853
  529    H    TRP  70           HN       TRP  70  70.329  -2.809  -5.390
  530    HA   TRP  70           HA       TRP  70  69.138  -5.412  -4.961
  531    HD1  TRP  70           HD1      TRP  70  67.568  -0.915  -5.837
  532    HE1  TRP  70           HE1      TRP  70  68.247   0.427  -3.744
  533    HE3  TRP  70           HE3      TRP  70  69.092  -4.727  -2.800
  534    HZ2  TRP  70           HZ2      TRP  70  69.300  -0.052  -1.124
  535    HZ3  TRP  70           HZ3      TRP  70  69.926  -4.259  -0.517
  536    HH2  TRP  70           HH2      TRP  70  70.033  -1.931   0.326
  537    HB2  TRP  70           HB2      TRP  70  67.680  -3.346  -6.555
  538    HB3  TRP  70           HB1      TRP  70  67.109  -4.336  -5.212
  539    H    GLU  71           HN       GLU  71  70.876  -4.104  -7.529
  540    HA   GLU  71           HA       GLU  71  70.091  -6.355  -9.268
  541    HB2  GLU  71           HB2      GLU  71  69.843  -3.458 -10.143
  542    HB3  GLU  71           HB1      GLU  71  69.717  -4.851 -11.219
  543    HG2  GLU  71           HG2      GLU  71  67.859  -5.692  -9.664
  544    HG3  GLU  71           HG1      GLU  71  67.867  -4.076  -8.958
  545    H    ALA  72           HN       ALA  72  72.440  -4.619  -7.858
  546    HA   ALA  72           HA       ALA  72  74.284  -4.265 -10.086
  547    HB1  ALA  72           HB1      ALA  72  74.258  -3.043  -7.784
  548    HB2  ALA  72           HB2      ALA  72  75.816  -3.473  -8.490
  549    HB3  ALA  72           HB3      ALA  72  75.128  -4.463  -7.201
  550    H1U  RCY  73           H1U      RCY  73  77.167  -6.086  -1.449
  551    H1S  RCY  73           H1S      RCY  73  74.451  -8.158  -4.871
  552    HB1  RCY  73           HB1      RCY  73  73.942 -10.000  -7.556
  553    HB2  RCY  73           HB2      RCY  73  73.705  -8.553  -6.578
  554    HA   RCY  73           HA       RCY  73  76.181  -8.236  -7.950
  555    HN1  RCY  73           HN1      RCY  73  73.914  -6.672  -7.475
  556    H    ASN  74           HN       ASN  74  76.746  -8.379 -10.137
  557    HA   ASN  74           HA       ASN  74  75.633 -10.523 -11.656
  558    HB2  ASN  74           HB2      ASN  74  74.167  -8.091 -11.866
  559    HB3  ASN  74           HB1      ASN  74  75.053  -8.274 -13.379
  560   HD21  ASN  74          HD21      ASN  74  73.320  -8.992 -14.722
  561   HD22  ASN  74          HD22      ASN  74  72.465 -10.432 -14.445
  562    H    HIS  75           HN       HIS  75  77.720  -7.845 -11.223
  563    HA   HIS  75           HA       HIS  75  79.687  -9.019 -13.041
  564    HD1  HIS  75           HD1      HIS  75  80.761  -8.882 -15.318
  565    HD2  HIS  75           HD2      HIS  75  80.796  -4.804 -14.440
  566    HE1  HIS  75           HE1      HIS  75  82.878  -7.946 -16.348
  567    HE2  HIS  75           HE2      HIS  75  82.911  -5.465 -15.820
  568    HB2  HIS  75           HB2      HIS  75  78.326  -7.661 -14.601
  569    HB3  HIS  75           HB1      HIS  75  78.598  -6.240 -13.594
  570    H1U  RCY  76           H1U      RCY  76  79.577  -0.869  -4.981
  571    H1S  RCY  76           H1S      RCY  76  77.917  -3.889  -7.664
  572    HB1  RCY  76           HB1      RCY  76  81.412  -5.058  -8.792
  573    HB2  RCY  76           HB2      RCY  76  80.329  -6.369  -9.257
  574    HA   RCY  76           HA       RCY  76  81.390  -4.358 -11.252
  575    HN1  RCY  76           HN1      RCY  76  79.862  -5.609 -12.527
  576    H    GLU  77           HN       GLU  77  82.667  -6.260 -12.856
  577    HA   GLU  77           HA       GLU  77  84.492  -7.901 -11.313
  578    HB2  GLU  77           HB2      GLU  77  83.805  -8.208 -13.774
  579    HB3  GLU  77           HB1      GLU  77  84.963  -6.927 -14.135
  580    HG2  GLU  77           HG2      GLU  77  86.192  -8.949 -14.377
  581    HG3  GLU  77           HG1      GLU  77  86.668  -8.311 -12.803
  582    H    LEU  78           HN       LEU  78  84.648  -5.467 -10.104
  583    HA   LEU  78           HA       LEU  78  87.146  -4.198 -11.146
  584    HG   LEU  78           HG       LEU  78  85.468  -2.798 -12.052
  585    HB2  LEU  78           HB2      LEU  78  84.826  -3.228  -9.526
  586    HB3  LEU  78           HB1      LEU  78  86.400  -2.498  -9.214
  587   HD11  LEU  78          HD11      LEU  78  84.497  -0.460 -11.810
  588   HD12  LEU  78          HD12      LEU  78  84.566  -0.700 -10.064
  589   HD13  LEU  78          HD13      LEU  78  83.552  -1.746 -11.059
  590   HD21  LEU  78          HD21      LEU  78  86.822  -0.726 -12.286
  591   HD22  LEU  78          HD22      LEU  78  87.762  -2.045 -11.589
  592   HD23  LEU  78          HD23      LEU  78  87.144  -0.758 -10.552
  593    H    HIS  79           HN       HIS  79  85.682  -4.876  -7.940
  594    HA   HIS  79           HA       HIS  79  88.294  -4.994  -6.672
  595    HD1  HIS  79           HD1      HIS  79  84.550  -3.348  -5.320
  596    HD2  HIS  79           HD2      HIS  79  88.647  -3.495  -4.549
  597    HE1  HIS  79           HE1      HIS  79  85.204  -1.047  -4.487
  598    HE2  HIS  79           HE2      HIS  79  87.696  -1.123  -4.015
  599    HB2  HIS  79           HB2      HIS  79  85.476  -5.606  -5.784
  600    HB3  HIS  79           HB1      HIS  79  86.851  -6.004  -4.754
  601    H    GLU  80           HN       GLU  80  89.600  -6.649  -7.378
  602    HA   GLU  80           HA       GLU  80  88.424  -9.373  -7.649
  603    HB2  GLU  80           HB2      GLU  80  91.263  -9.175  -8.285
  604    HB3  GLU  80           HB1      GLU  80  89.925  -9.677  -9.318
  605    HG2  GLU  80           HG2      GLU  80  89.357  -7.286  -9.704
  606    HG3  GLU  80           HG1      GLU  80  90.756  -6.819  -8.735
  607    H    LEU  81           HN       LEU  81  90.357  -7.446  -5.555
  608    HA   LEU  81           HA       LEU  81  91.732  -9.700  -4.288
  609    HG   LEU  81           HG       LEU  81  93.906  -8.515  -4.188
  610    HB2  LEU  81           HB2      LEU  81  91.492  -6.752  -3.683
  611    HB3  LEU  81           HB1      LEU  81  92.261  -7.860  -2.547
  612   HD11  LEU  81          HD11      LEU  81  92.159  -6.925  -6.073
  613   HD12  LEU  81          HD12      LEU  81  92.651  -8.613  -6.207
  614   HD13  LEU  81          HD13      LEU  81  93.831  -7.328  -6.465
  615   HD21  LEU  81          HD21      LEU  81  93.581  -5.514  -4.452
  616   HD22  LEU  81          HD22      LEU  81  95.083  -6.439  -4.477
  617   HD23  LEU  81          HD23      LEU  81  94.164  -6.290  -2.979
  618    H    ALA  82           HN       ALA  82  89.177  -7.406  -3.249
  619    HA   ALA  82           HA       ALA  82  88.577  -8.867  -0.838
  620    HB1  ALA  82           HB1      ALA  82  87.936  -6.531  -1.019
  621    HB2  ALA  82           HB2      ALA  82  86.468  -7.495  -0.856
  622    HB3  ALA  82           HB3      ALA  82  86.944  -6.873  -2.436
  623    H    GLN  83           HN       GLN  83  87.889 -10.968  -0.983
  624    HA   GLN  83           HA       GLN  83  85.589 -11.530  -2.809
  625    HB2  GLN  83           HB2      GLN  83  87.907 -13.423  -2.332
  626    HB3  GLN  83           HB1      GLN  83  86.551 -13.660  -3.435
  627    HG2  GLN  83           HG2      GLN  83  87.387 -11.346  -4.431
  628    HG3  GLN  83           HG1      GLN  83  88.916 -11.842  -3.704
  629   HE21  GLN  83          HE21      GLN  83  87.810 -11.777  -6.645
  630   HE22  GLN  83          HE22      GLN  83  88.236 -13.308  -7.242
  631    H    TYR  84           HN       TYR  84  85.445 -10.921  -0.025
  632    HA   TYR  84           HA       TYR  84  84.056 -13.318   0.888
  633    HD1  TYR  84           HD2      TYR  84  85.376 -15.647   1.195
  634    HD2  TYR  84           HD1      TYR  84  85.020 -13.206   4.712
  635    HE1  TYR  84           HE2      TYR  84  84.459 -17.582   2.446
  636    HE2  TYR  84           HE1      TYR  84  84.103 -15.141   5.962
  637    HH   TYR  84           HH       TYR  84  83.653 -18.307   4.376
  638    HB2  TYR  84           HB2      TYR  84  86.646 -13.449   1.502
  639    HB3  TYR  84           HB1      TYR  84  86.157 -12.373   2.811
  640    H    GLY  85           HN       GLY  85  85.051 -10.000   1.281
  641    HA2  GLY  85           HA2      GLY  85  83.551  -8.257   1.979
  642    HA3  GLY  85           HA1      GLY  85  82.535  -9.474   2.750
  643    H    ILE  86           HN       ILE  86  86.045  -9.128   3.165
  644    HA   ILE  86           HA       ILE  86  85.668  -9.072   6.073
  645    HB   ILE  86           HB       ILE  86  87.561 -10.301   4.966
  646   HG12  ILE  86          HG12      ILE  86  88.620  -8.087   6.731
  647   HG13  ILE  86          HG11      ILE  86  87.568  -9.353   7.367
  648   HG21  ILE  86          HG21      ILE  86  89.312  -9.159   3.889
  649   HG22  ILE  86          HG22      ILE  86  88.858  -7.607   4.593
  650   HG23  ILE  86          HG23      ILE  86  87.877  -8.314   3.309
  651   HD11  ILE  86          HD11      ILE  86  89.145 -11.074   6.597
  652   HD12  ILE  86          HD12      ILE  86  89.961  -9.928   7.661
  653   HD13  ILE  86          HD13      ILE  86  90.189  -9.827   5.915
  654    H1U  RCY  87           H1U      RCY  87  80.268  -4.992   4.031
  655    H1S  RCY  87           H1S      RCY  87  82.437  -6.975   7.213
  656    HB1  RCY  87           HB1      RCY  87  84.356  -4.005   7.768
  657    HB2  RCY  87           HB2      RCY  87  85.686  -4.471   8.826
  658    HA   RCY  87           HA       RCY  87  85.513  -4.632   5.931
  659    HN1  RCY  87           HN1      RCY  87  85.392  -7.214   7.205
  Start of MODEL   10
    1    HA   MET   1           HA       MET   1  60.179 -10.428  16.939
    2    HB2  MET   1           HB2      MET   1  59.578  -9.143  14.272
    3    HB3  MET   1           HB1      MET   1  59.259  -8.511  15.887
    4    HG2  MET   1           HG2      MET   1  61.952  -8.842  14.544
    5    HG3  MET   1           HG1      MET   1  61.183  -7.337  15.047
    6    HE1  MET   1           HE1      MET   1  60.614  -6.662  17.204
    7    HE2  MET   1           HE2      MET   1  61.345  -7.150  18.731
    8    HE3  MET   1           HE3      MET   1  60.014  -8.089  18.059
    9    H    ASN   2           HN       ASN   2  59.982 -12.944  15.191
   10    HA   ASN   2           HA       ASN   2  58.296 -14.310  14.250
   11    HB2  ASN   2           HB2      ASN   2  56.340 -14.513  15.796
   12    HB3  ASN   2           HB1      ASN   2  57.890 -14.582  16.634
   13   HD21  ASN   2          HD21      ASN   2  58.387 -12.895  18.130
   14   HD22  ASN   2          HD22      ASN   2  57.316 -11.626  18.486
   15    H    LEU   3           HN       LEU   3  58.370 -11.513  13.214
   16    HA   LEU   3           HA       LEU   3  55.581 -11.459  12.162
   17    HG   LEU   3           HG       LEU   3  55.295 -10.754  14.546
   18    HB2  LEU   3           HB2      LEU   3  57.107  -9.174  13.419
   19    HB3  LEU   3           HB1      LEU   3  55.810  -8.883  12.262
   20   HD11  LEU   3          HD11      LEU   3  55.458  -7.738  14.703
   21   HD12  LEU   3          HD12      LEU   3  56.218  -8.924  15.764
   22   HD13  LEU   3          HD13      LEU   3  54.472  -8.685  15.817
   23   HD21  LEU   3          HD21      LEU   3  53.711 -10.235  12.586
   24   HD22  LEU   3          HD22      LEU   3  53.523  -8.637  13.310
   25   HD23  LEU   3          HD23      LEU   3  53.037 -10.075  14.208
   26    H    GLU   4           HN       GLU   4  58.046 -12.454  10.988
   27    HA   GLU   4           HA       GLU   4  59.341 -10.633   9.266
   28    HB2  GLU   4           HB2      GLU   4  59.978 -13.036   9.618
   29    HB3  GLU   4           HB1      GLU   4  58.614 -13.496   8.599
   30    HG2  GLU   4           HG2      GLU   4  59.560 -12.145   6.747
   31    HG3  GLU   4           HG1      GLU   4  60.944 -11.743   7.764
   32    HA   PRO   5           HA       PRO   5  55.713  -9.248   6.924
   33    HB2  PRO   5           HB2      PRO   5  57.917  -8.487   5.040
   34    HB3  PRO   5           HB1      PRO   5  56.532  -7.528   5.598
   35    HG2  PRO   5           HG2      PRO   5  58.981  -7.142   6.576
   36    HG3  PRO   5           HG1      PRO   5  57.539  -6.992   7.594
   37    HD2  PRO   5           HD2      PRO   5  59.597  -9.145   7.560
   38    HD3  PRO   5           HD1      PRO   5  58.559  -8.596   8.894
   39    HA   PRO   6           HA       PRO   6  55.287 -12.550   3.973
   40    HB2  PRO   6           HB2      PRO   6  53.367 -11.541   2.326
   41    HB3  PRO   6           HB1      PRO   6  53.024 -12.050   3.992
   42    HG2  PRO   6           HG2      PRO   6  53.450  -9.309   2.910
   43    HG3  PRO   6           HG1      PRO   6  52.282  -9.879   4.114
   44    HD2  PRO   6           HD2      PRO   6  54.620  -8.589   4.774
   45    HD3  PRO   6           HD1      PRO   6  53.804  -9.748   5.848
   46    H    LYS   7           HN       LYS   7  55.534 -13.065   1.620
   47    HA   LYS   7           HA       LYS   7  57.621 -11.403   0.419
   48    HB2  LYS   7           HB2      LYS   7  56.722 -13.417  -1.413
   49    HB3  LYS   7           HB1      LYS   7  58.222 -13.378  -0.495
   50    HG2  LYS   7           HG2      LYS   7  57.111 -15.396   0.151
   51    HG3  LYS   7           HG1      LYS   7  56.883 -14.269   1.488
   52    HD2  LYS   7           HD2      LYS   7  54.704 -14.996   1.222
   53    HD3  LYS   7           HD1      LYS   7  54.697 -13.629   0.106
   54    HE2  LYS   7           HE2      LYS   7  55.429 -15.305  -1.697
   55    HE3  LYS   7           HE1      LYS   7  54.981 -16.565  -0.547
   56    HZ1  LYS   7           HZ1      LYS   7  52.980 -16.312  -1.511
   57    HZ2  LYS   7           HZ2      LYS   7  53.297 -14.729  -2.040
   58    HZ3  LYS   7           HZ3      LYS   7  52.832 -15.013  -0.431
   59    H    ALA   8           HN       ALA   8  54.995 -12.837  -1.432
   60    HA   ALA   8           HA       ALA   8  53.684 -11.885  -3.139
   61    HB1  ALA   8           HB1      ALA   8  52.475  -9.818  -2.423
   62    HB2  ALA   8           HB2      ALA   8  53.533  -9.725  -1.015
   63    HB3  ALA   8           HB3      ALA   8  52.431 -11.090  -1.202
   64    H    GLU   9           HN       GLU   9  54.046  -8.610  -2.548
   65    HA   GLU   9           HA       GLU   9  56.568  -8.095  -3.844
   66    HB2  GLU   9           HB2      GLU   9  54.991  -9.061  -5.698
   67    HB3  GLU   9           HB1      GLU   9  54.216  -7.479  -5.624
   68    HG2  GLU   9           HG2      GLU   9  55.873  -7.233  -7.298
   69    HG3  GLU   9           HG1      GLU   9  56.596  -6.507  -5.862
   70    H1U  RCY  10           H1U      RCY  10  56.834  -6.529   5.129
   71    H1S  RCY  10           H1S      RCY  10  56.816  -4.520   1.319
   72    HB1  RCY  10           HB1      RCY  10  55.463  -3.418  -0.823
   73    HB2  RCY  10           HB2      RCY  10  55.987  -3.853  -2.449
   74    HA   RCY  10           HA       RCY  10  53.869  -5.164  -0.744
   75    HN1  RCY  10           HN1      RCY  10  54.573  -7.193  -1.697
   76    H    ARG  11           HN       ARG  11  51.841  -5.253  -1.980
   77    HA   ARG  11           HA       ARG  11  51.710  -3.743  -4.502
   78    HE   ARG  11           HE       ARG  11  46.384  -4.815  -2.497
   79    HB2  ARG  11           HB2      ARG  11  49.278  -4.264  -4.376
   80    HB3  ARG  11           HB1      ARG  11  50.277  -5.711  -4.235
   81    HG2  ARG  11           HG2      ARG  11  50.083  -5.576  -1.759
   82    HG3  ARG  11           HG1      ARG  11  49.018  -4.181  -1.938
   83    HD2  ARG  11           HD2      ARG  11  48.420  -6.807  -3.302
   84    HD3  ARG  11           HD1      ARG  11  47.892  -6.482  -1.651
   85   HH11  ARG  11          HH21      ARG  11  48.408  -6.263  -4.884
   86   HH12  ARG  11          HH22      ARG  11  47.484  -5.665  -6.221
   87   HH21  ARG  11          HH11      ARG  11  45.166  -4.026  -4.231
   88   HH22  ARG  11          HH12      ARG  11  45.649  -4.399  -5.852
   89    H    SER  12           HN       SER  12  52.413  -2.491  -1.789
   90    HA   SER  12           HA       SER  12  50.404  -0.868  -0.750
   91    HG   SER  12           HG       SER  12  52.391   1.418   0.443
   92    HB2  SER  12           HB2      SER  12  52.503  -0.653   0.290
   93    HB3  SER  12           HB1      SER  12  53.335  -0.374  -1.237
   94    H    ALA  13           HN       ALA  13  52.652   0.292  -3.291
   95    HA   ALA  13           HA       ALA  13  50.536   1.247  -4.999
   96    HB1  ALA  13           HB1      ALA  13  52.033   3.434  -3.540
   97    HB2  ALA  13           HB2      ALA  13  50.451   2.862  -3.010
   98    HB3  ALA  13           HB3      ALA  13  50.634   3.598  -4.602
   99    H    THR  14           HN       THR  14  51.995   0.119  -6.457
  100    HA   THR  14           HA       THR  14  53.832  -0.044  -7.919
  101    HB   THR  14           HB       THR  14  54.546   2.283  -8.792
  102    HG1  THR  14           HG1      THR  14  53.515   3.978  -7.997
  103   HG21  THR  14          HG21      THR  14  52.269   2.598  -9.885
  104   HG22  THR  14          HG22      THR  14  51.693   1.280  -8.864
  105   HG23  THR  14          HG23      THR  14  52.970   0.987 -10.045
  106    H    ARG  15           HN       ARG  15  54.258   0.620  -4.852
  107    HA   ARG  15           HA       ARG  15  56.093   1.027  -3.447
  108    HE   ARG  15           HE       ARG  15  59.563   1.766  -4.880
  109    HB2  ARG  15           HB2      ARG  15  56.665  -1.062  -5.045
  110    HB3  ARG  15           HB1      ARG  15  57.953   0.023  -5.561
  111    HG2  ARG  15           HG2      ARG  15  57.373  -0.716  -2.676
  112    HG3  ARG  15           HG1      ARG  15  58.649  -1.433  -3.660
  113    HD2  ARG  15           HD2      ARG  15  58.394   1.474  -2.846
  114    HD3  ARG  15           HD1      ARG  15  59.641   0.335  -2.339
  115   HH11  ARG  15          HH21      ARG  15  60.597  -1.037  -3.159
  116   HH12  ARG  15          HH22      ARG  15  61.931  -1.357  -4.216
  117   HH21  ARG  15          HH11      ARG  15  61.299   1.364  -6.270
  118   HH22  ARG  15          HH12      ARG  15  62.328   0.002  -5.978
  119    H    VAL  16           HN       VAL  16  55.802   3.356  -3.763
  120    HA   VAL  16           HA       VAL  16  58.287   4.592  -4.675
  121    HB   VAL  16           HB       VAL  16  56.916   6.238  -6.141
  122   HG11  VAL  16          HG11      VAL  16  58.531   4.306  -6.838
  123   HG12  VAL  16          HG12      VAL  16  57.462   4.999  -8.058
  124   HG13  VAL  16          HG13      VAL  16  57.052   3.461  -7.297
  125   HG21  VAL  16          HG21      VAL  16  55.085   3.839  -6.351
  126   HG22  VAL  16          HG22      VAL  16  54.848   5.448  -7.032
  127   HG23  VAL  16          HG23      VAL  16  54.727   5.201  -5.290
  128    H    MET  17           HN       MET  17  57.184   4.449  -2.132
  129    HA   MET  17           HA       MET  17  55.460   6.598  -1.415
  130    HB2  MET  17           HB2      MET  17  56.652   6.353   0.865
  131    HB3  MET  17           HB1      MET  17  55.809   4.937   0.237
  132    HG2  MET  17           HG2      MET  17  57.838   3.921  -0.488
  133    HG3  MET  17           HG1      MET  17  58.745   5.421  -0.293
  134    HE1  MET  17           HE1      MET  17  56.620   2.794   1.226
  135    HE2  MET  17           HE2      MET  17  56.041   3.983   2.390
  136    HE3  MET  17           HE3      MET  17  57.069   2.658   2.931
  137    H    GLY  18           HN       GLY  18  58.194   7.131   0.437
  138    HA2  GLY  18           HA2      GLY  18  58.543   9.799  -0.696
  139    HA3  GLY  18           HA1      GLY  18  59.410   9.143   0.693
  140    H    GLY  19           HN       GLY  19  60.524  10.602  -1.611
  141    HA2  GLY  19           HA2      GLY  19  62.531  10.459  -2.830
  142    HA3  GLY  19           HA1      GLY  19  62.776   8.857  -2.135
  143    HA   PRO  20           HA       PRO  20  59.635   8.493  -5.990
  144    HB2  PRO  20           HB2      PRO  20  60.952  10.759  -7.448
  145    HB3  PRO  20           HB1      PRO  20  59.263  10.215  -7.499
  146    HG2  PRO  20           HG2      PRO  20  59.988  12.380  -6.130
  147    HG3  PRO  20           HG1      PRO  20  58.719  11.292  -5.544
  148    HD2  PRO  20           HD2      PRO  20  61.502  11.643  -4.541
  149    HD3  PRO  20           HD1      PRO  20  60.045  11.122  -3.668
  150    H1U  RCY  21           H1U      RCY  21  64.708   1.695  -4.166
  151    H1S  RCY  21           H1S      RCY  21  63.655   2.059  -7.620
  152    HB1  RCY  21           HB1      RCY  21  62.104   4.368  -6.594
  153    HB2  RCY  21           HB2      RCY  21  63.267   5.214  -5.573
  154    HA   RCY  21           HA       RCY  21  63.649   6.843  -7.427
  155    HN1  RCY  21           HN1      RCY  21  61.081   6.630  -6.033
  156    H    THR  22           HN       THR  22  63.386   7.341  -9.589
  157    HA   THR  22           HA       THR  22  61.258   6.602 -11.271
  158    HB   THR  22           HB       THR  22  62.540   7.961 -12.562
  159    HG1  THR  22           HG1      THR  22  64.248   5.716 -12.818
  160   HG21  THR  22          HG21      THR  22  63.994   8.561 -10.749
  161   HG22  THR  22          HG22      THR  22  65.029   8.198 -12.129
  162   HG23  THR  22          HG23      THR  22  64.838   7.015 -10.835
  163    HA   PRO  23           HA       PRO  23  61.616   2.282 -12.004
  164    HB2  PRO  23           HB2      PRO  23  61.293   2.108 -14.748
  165    HB3  PRO  23           HB1      PRO  23  59.966   2.371 -13.602
  166    HG2  PRO  23           HG2      PRO  23  61.417   4.341 -15.292
  167    HG3  PRO  23           HG1      PRO  23  59.694   4.248 -14.887
  168    HD2  PRO  23           HD2      PRO  23  61.372   6.010 -13.669
  169    HD3  PRO  23           HD1      PRO  23  59.981   5.289 -12.827
  170    H    ARG  24           HN       ARG  24  64.075   2.852 -11.482
  171    HA   ARG  24           HA       ARG  24  66.331   2.410 -11.931
  172    HE   ARG  24           HE       ARG  24  68.299  -0.492 -11.975
  173    HB2  ARG  24           HB2      ARG  24  65.147   0.577 -14.041
  174    HB3  ARG  24           HB1      ARG  24  66.780   0.487 -13.386
  175    HG2  ARG  24           HG2      ARG  24  64.427   0.387 -11.518
  176    HG3  ARG  24           HG1      ARG  24  64.911  -1.067 -12.391
  177    HD2  ARG  24           HD2      ARG  24  66.707   0.606 -10.609
  178    HD3  ARG  24           HD1      ARG  24  66.026  -0.969 -10.199
  179   HH11  ARG  24          HH21      ARG  24  65.684  -2.549 -11.070
  180   HH12  ARG  24          HH22      ARG  24  66.422  -3.985 -11.696
  181   HH21  ARG  24          HH11      ARG  24  69.278  -2.355 -12.798
  182   HH22  ARG  24          HH12      ARG  24  68.457  -3.875 -12.675
  183    H    LYS  25           HN       LYS  25  68.044   2.691 -13.611
  184    HA   LYS  25           HA       LYS  25  67.194   4.762 -15.563
  185    HB2  LYS  25           HB2      LYS  25  69.373   4.571 -13.837
  186    HB3  LYS  25           HB1      LYS  25  70.069   4.168 -15.404
  187    HG2  LYS  25           HG2      LYS  25  70.241   6.510 -15.360
  188    HG3  LYS  25           HG1      LYS  25  68.744   6.255 -16.256
  189    HD2  LYS  25           HD2      LYS  25  67.415   6.658 -14.271
  190    HD3  LYS  25           HD1      LYS  25  68.862   6.728 -13.265
  191    HE2  LYS  25           HE2      LYS  25  68.057   8.998 -13.785
  192    HE3  LYS  25           HE1      LYS  25  69.635   8.713 -14.518
  193    HZ1  LYS  25           HZ1      LYS  25  67.917   7.847 -16.416
  194    HZ2  LYS  25           HZ2      LYS  25  68.656   9.377 -16.391
  195    HZ3  LYS  25           HZ3      LYS  25  67.088   9.179 -15.769
  196    H    GLY  26           HN       GLY  26  69.434   4.380 -17.341
  197    HA2  GLY  26           HA2      GLY  26  69.042   1.650 -18.436
  198    HA3  GLY  26           HA1      GLY  26  68.607   3.012 -19.469
  199    HA   PRO  27           HA       PRO  27  72.681   3.865 -20.886
  200    HB2  PRO  27           HB2      PRO  27  72.892   6.282 -19.135
  201    HB3  PRO  27           HB1      PRO  27  73.139   6.136 -20.885
  202    HG2  PRO  27           HG2      PRO  27  70.931   7.229 -19.861
  203    HG3  PRO  27           HG1      PRO  27  70.902   6.272 -21.351
  204    HD2  PRO  27           HD2      PRO  27  69.908   5.551 -18.639
  205    HD3  PRO  27           HD1      PRO  27  69.361   4.982 -20.231
  206    HA   PRO  28           HA       PRO  28  75.815   2.141 -18.281
  207    HB2  PRO  28           HB2      PRO  28  77.372   4.665 -18.755
  208    HB3  PRO  28           HB1      PRO  28  77.906   2.976 -18.871
  209    HG2  PRO  28           HG2      PRO  28  77.315   4.430 -21.039
  210    HG3  PRO  28           HG1      PRO  28  76.996   2.691 -20.954
  211    HD2  PRO  28           HD2      PRO  28  75.072   4.936 -20.942
  212    HD3  PRO  28           HD1      PRO  28  74.803   3.225 -21.337
  213    H    LYS  29           HN       LYS  29  76.638   2.336 -16.106
  214    HA   LYS  29           HA       LYS  29  75.924   4.840 -14.650
  215    HB2  LYS  29           HB2      LYS  29  74.293   2.670 -14.509
  216    HB3  LYS  29           HB1      LYS  29  75.422   2.283 -13.212
  217    HG2  LYS  29           HG2      LYS  29  75.032   4.528 -12.226
  218    HG3  LYS  29           HG1      LYS  29  73.860   4.869 -13.499
  219    HD2  LYS  29           HD2      LYS  29  72.353   3.227 -12.715
  220    HD3  LYS  29           HD1      LYS  29  73.591   2.430 -11.744
  221    HE2  LYS  29           HE2      LYS  29  71.824   4.013 -10.586
  222    HE3  LYS  29           HE1      LYS  29  73.510   4.044 -10.069
  223    HZ1  LYS  29           HZ1      LYS  29  72.722   5.795 -12.274
  224    HZ2  LYS  29           HZ2      LYS  29  73.879   6.039 -11.054
  225    HZ3  LYS  29           HZ3      LYS  29  72.226   6.229 -10.711
  226    H1U  RCY  30           H1U      RCY  30  75.902   5.551 -13.961
  227    H1S  RCY  30           H1S      RCY  30  80.041   3.426 -14.306
  228    HB1  RCY  30           HB1      RCY  30  78.134   1.511 -11.559
  229    HB2  RCY  30           HB2      RCY  30  79.691   1.888 -10.824
  230    HA   RCY  30           HA       RCY  30  78.647   3.978 -10.829
  231    HN1  RCY  30           HN1      RCY  30  76.669   3.988 -12.105
  232    H    LYS  31           HN       LYS  31  81.267   3.429 -11.354
  233    HA   LYS  31           HA       LYS  31  83.158   4.575 -12.169
  234    HB2  LYS  31           HB2      LYS  31  81.575   3.856 -14.639
  235    HB3  LYS  31           HB1      LYS  31  83.133   4.673 -14.757
  236    HG2  LYS  31           HG2      LYS  31  82.903   2.231 -13.030
  237    HG3  LYS  31           HG1      LYS  31  83.023   2.034 -14.779
  238    HD2  LYS  31           HD2      LYS  31  84.942   3.881 -13.406
  239    HD3  LYS  31           HD1      LYS  31  85.211   2.142 -13.291
  240    HE2  LYS  31           HE2      LYS  31  85.394   1.906 -15.649
  241    HE3  LYS  31           HE1      LYS  31  84.710   3.505 -15.940
  242    HZ1  LYS  31           HZ1      LYS  31  87.406   2.784 -15.503
  243    HZ2  LYS  31           HZ2      LYS  31  86.907   3.875 -14.300
  244    HZ3  LYS  31           HZ3      LYS  31  86.764   4.292 -15.941
  245    H    GLN  32           HN       GLN  32  81.565   6.425 -11.060
  246    HA   GLN  32           HA       GLN  32  81.880   8.732 -12.889
  247    HB2  GLN  32           HB2      GLN  32  79.555   9.535 -12.161
  248    HB3  GLN  32           HB1      GLN  32  79.594   8.221 -13.338
  249    HG2  GLN  32           HG2      GLN  32  79.219   6.575 -11.587
  250    HG3  GLN  32           HG1      GLN  32  79.326   7.822 -10.344
  251   HE21  GLN  32          HE21      GLN  32  77.203   8.009  -9.562
  252   HE22  GLN  32          HE22      GLN  32  75.839   8.254 -10.542
  253    H    ARG  33           HN       ARG  33  83.633   8.630 -11.031
  254    HA   ARG  33           HA       ARG  33  83.036   9.210  -8.345
  255    HE   ARG  33           HE       ARG  33  86.863   8.105  -8.353
  256    HB2  ARG  33           HB2      ARG  33  85.334   8.825  -9.445
  257    HB3  ARG  33           HB1      ARG  33  85.305  10.546  -9.828
  258    HG2  ARG  33           HG2      ARG  33  85.004  11.077  -7.438
  259    HG3  ARG  33           HG1      ARG  33  85.034   9.356  -7.051
  260    HD2  ARG  33           HD2      ARG  33  87.288  10.954  -8.299
  261    HD3  ARG  33           HD1      ARG  33  87.248  10.308  -6.659
  262   HH11  ARG  33          HH21      ARG  33  89.194  10.584  -7.800
  263   HH12  ARG  33          HH22      ARG  33  90.542   9.610  -8.285
  264   HH21  ARG  33          HH11      ARG  33  88.610   6.818  -8.990
  265   HH22  ARG  33          HH12      ARG  33  90.211   7.478  -8.959
  266    H    GLN  34           HN       GLN  34  83.113  11.326  -7.224
  267    HA   GLN  34           HA       GLN  34  82.589  13.731  -8.823
  268    HB2  GLN  34           HB2      GLN  34  80.412  13.910  -7.163
  269    HB3  GLN  34           HB1      GLN  34  80.335  13.359  -8.834
  270    HG2  GLN  34           HG2      GLN  34  79.223  11.802  -7.196
  271    HG3  GLN  34           HG1      GLN  34  80.500  11.044  -8.148
  272   HE21  GLN  34          HE21      GLN  34  82.136  10.009  -6.977
  273   HE22  GLN  34          HE22      GLN  34  82.412  10.218  -5.315
  274    H    THR  35           HN       THR  35  81.310  13.353  -5.585
  275    HA   THR  35           HA       THR  35  83.714  14.126  -4.185
  276    HB   THR  35           HB       THR  35  83.531  16.291  -5.085
  277    HG1  THR  35           HG1      THR  35  81.787  16.668  -2.931
  278   HG21  THR  35          HG21      THR  35  80.551  15.862  -4.839
  279   HG22  THR  35          HG22      THR  35  81.492  16.135  -6.305
  280   HG23  THR  35          HG23      THR  35  81.250  17.450  -5.156
  281    H    ARG  36           HN       ARG  36  80.254  13.718  -4.334
  282    HA   ARG  36           HA       ARG  36  79.817  13.992  -1.470
  283    HE   ARG  36           HE       ARG  36  79.533  16.578  -0.985
  284    HB2  ARG  36           HB2      ARG  36  78.216  13.504  -3.851
  285    HB3  ARG  36           HB1      ARG  36  77.746  12.408  -2.553
  286    HG2  ARG  36           HG2      ARG  36  76.458  14.492  -2.402
  287    HG3  ARG  36           HG1      ARG  36  77.536  14.345  -1.014
  288    HD2  ARG  36           HD2      ARG  36  79.003  15.639  -3.079
  289    HD3  ARG  36           HD1      ARG  36  77.434  16.438  -2.977
  290   HH11  ARG  36          HH21      ARG  36  76.130  16.495  -1.535
  291   HH12  ARG  36          HH22      ARG  36  75.741  17.367  -0.090
  292   HH21  ARG  36          HH11      ARG  36  79.045  17.717   0.905
  293   HH22  ARG  36          HH12      ARG  36  77.391  18.059   1.292
  294    H    GLN  37           HN       GLN  37  81.864  12.011  -2.638
  295    HA   GLN  37           HA       GLN  37  80.822   9.394  -1.855
  296    HB2  GLN  37           HB2      GLN  37  82.574   9.709  -3.624
  297    HB3  GLN  37           HB1      GLN  37  83.694  10.227  -2.365
  298    HG2  GLN  37           HG2      GLN  37  82.238   7.598  -2.137
  299    HG3  GLN  37           HG1      GLN  37  83.725   7.725  -3.077
  300   HE21  GLN  37          HE21      GLN  37  85.157   9.598  -1.475
  301   HE22  GLN  37          HE22      GLN  37  85.490   8.885   0.029
  302    H1U  RCY  38           H1U      RCY  38  85.837   3.859   2.283
  303    H1S  RCY  38           H1S      RCY  38  83.486   6.505   4.490
  304    HB1  RCY  38           HB1      RCY  38  83.368   8.887   2.525
  305    HB2  RCY  38           HB2      RCY  38  82.249   7.884   1.604
  306    HA   RCY  38           HA       RCY  38  80.575   9.807   2.672
  307    HN1  RCY  38           HN1      RCY  38  80.227   9.641   0.351
  308    H    LYS  39           HN       LYS  39  82.557  10.513   4.306
  309    HA   LYS  39           HA       LYS  39  83.259  13.251   3.379
  310    HB2  LYS  39           HB2      LYS  39  82.063  12.821   5.596
  311    HB3  LYS  39           HB1      LYS  39  83.576  12.117   6.167
  312    HG2  LYS  39           HG2      LYS  39  83.848  14.325   6.844
  313    HG3  LYS  39           HG1      LYS  39  84.609  14.373   5.253
  314    HD2  LYS  39           HD2      LYS  39  83.183  16.179   5.043
  315    HD3  LYS  39           HD1      LYS  39  82.111  14.897   4.478
  316    HE2  LYS  39           HE2      LYS  39  80.891  16.203   6.103
  317    HE3  LYS  39           HE1      LYS  39  81.285  14.654   6.849
  318    HZ1  LYS  39           HZ1      LYS  39  81.869  17.119   7.858
  319    HZ2  LYS  39           HZ2      LYS  39  83.351  16.594   7.214
  320    HZ3  LYS  39           HZ3      LYS  39  82.541  15.647   8.369
  321    H    SER  40           HN       SER  40  84.830  11.472   2.098
  322    HA   SER  40           HA       SER  40  87.065  10.889   1.711
  323    HG   SER  40           HG       SER  40  87.121  13.451   4.468
  324    HB2  SER  40           HB2      SER  40  88.693  12.454   2.384
  325    HB3  SER  40           HB1      SER  40  87.215  13.408   2.311
  326    H    LYS  41           HN       LYS  41  87.268  11.685   5.191
  327    HA   LYS  41           HA       LYS  41  88.909   9.586   5.964
  328    HB2  LYS  41           HB2      LYS  41  86.599  10.825   7.478
  329    HB3  LYS  41           HB1      LYS  41  87.796   9.760   8.215
  330    HG2  LYS  41           HG2      LYS  41  89.577  11.353   7.326
  331    HG3  LYS  41           HG1      LYS  41  88.263  12.467   6.948
  332    HD2  LYS  41           HD2      LYS  41  87.531  12.210   9.385
  333    HD3  LYS  41           HD1      LYS  41  89.085  11.423   9.664
  334    HE2  LYS  41           HE2      LYS  41  88.569  14.260   8.761
  335    HE3  LYS  41           HE1      LYS  41  89.458  13.713  10.183
  336    HZ1  LYS  41           HZ1      LYS  41  91.214  12.931   8.857
  337    HZ2  LYS  41           HZ2      LYS  41  90.833  14.465   8.234
  338    HZ3  LYS  41           HZ3      LYS  41  90.315  13.064   7.424
  339    HA   PRO  42           HA       PRO  42  86.055   6.193   5.043
  340    HB2  PRO  42           HB2      PRO  42  87.847   4.163   5.263
  341    HB3  PRO  42           HB1      PRO  42  87.809   5.245   3.857
  342    HG2  PRO  42           HG2      PRO  42  89.650   5.251   6.190
  343    HG3  PRO  42           HG1      PRO  42  89.987   5.581   4.484
  344    HD2  PRO  42           HD2      PRO  42  89.653   7.543   6.419
  345    HD3  PRO  42           HD1      PRO  42  89.425   7.803   4.676
  346    HA   PRO  43           HA       PRO  43  84.848   4.718   9.035
  347    HB2  PRO  43           HB2      PRO  43  84.159   2.089   8.475
  348    HB3  PRO  43           HB1      PRO  43  83.129   3.492   8.136
  349    HG2  PRO  43           HG2      PRO  43  84.884   1.952   6.300
  350    HG3  PRO  43           HG1      PRO  43  83.293   2.672   6.006
  351    HD2  PRO  43           HD2      PRO  43  85.589   3.828   5.115
  352    HD3  PRO  43           HD1      PRO  43  84.172   4.786   5.600
  353    H    LYS  44           HN       LYS  44  86.143   4.165  10.733
  354    HA   LYS  44           HA       LYS  44  88.664   2.861  10.412
  355    HB2  LYS  44           HB2      LYS  44  87.083   3.005  12.988
  356    HB3  LYS  44           HB1      LYS  44  88.836   2.946  12.798
  357    HG2  LYS  44           HG2      LYS  44  88.627   5.144  11.507
  358    HG3  LYS  44           HG1      LYS  44  86.971   5.223  12.108
  359    HD2  LYS  44           HD2      LYS  44  89.285   4.788  13.992
  360    HD3  LYS  44           HD1      LYS  44  88.810   6.412  13.493
  361    HE2  LYS  44           HE2      LYS  44  87.004   4.367  14.818
  362    HE3  LYS  44           HE1      LYS  44  87.684   5.798  15.592
  363    HZ1  LYS  44           HZ1      LYS  44  86.100   7.061  14.724
  364    HZ2  LYS  44           HZ2      LYS  44  85.316   5.644  14.211
  365    HZ3  LYS  44           HZ3      LYS  44  86.370   6.462  13.160
  366    H    LYS  45           HN       LYS  45  87.865   1.180  12.980
  367    HA   LYS  45           HA       LYS  45  87.521  -1.116  13.338
  368    HB2  LYS  45           HB2      LYS  45  85.401  -0.654  11.217
  369    HB3  LYS  45           HB1      LYS  45  85.469  -2.028  12.320
  370    HG2  LYS  45           HG2      LYS  45  85.271  -0.497  14.246
  371    HG3  LYS  45           HG1      LYS  45  85.199   0.878  13.144
  372    HD2  LYS  45           HD2      LYS  45  83.266  -1.370  12.735
  373    HD3  LYS  45           HD1      LYS  45  82.972  -0.243  14.059
  374    HE2  LYS  45           HE2      LYS  45  82.851   1.621  12.587
  375    HE3  LYS  45           HE1      LYS  45  83.557   0.710  11.252
  376    HZ1  LYS  45           HZ1      LYS  45  81.579  -0.092  10.689
  377    HZ2  LYS  45           HZ2      LYS  45  80.894   1.048  11.746
  378    HZ3  LYS  45           HZ3      LYS  45  81.203  -0.535  12.282
  379    H    GLY  46           HN       GLY  46  86.489  -1.334   9.974
  380    HA2  GLY  46           HA2      GLY  46  87.495  -2.378   8.126
  381    HA3  GLY  46           HA1      GLY  46  89.052  -2.126   8.915
  382    H    VAL  47           HN       VAL  47  89.870  -3.760  10.299
  383    HA   VAL  47           HA       VAL  47  90.340  -6.070  10.575
  384    HB   VAL  47           HB       VAL  47  88.685  -7.097  12.106
  385   HG11  VAL  47          HG11      VAL  47  88.860  -5.435  13.867
  386   HG12  VAL  47          HG12      VAL  47  89.081  -4.147  12.684
  387   HG13  VAL  47          HG13      VAL  47  90.332  -5.372  12.897
  388   HG21  VAL  47          HG21      VAL  47  86.598  -5.994  12.602
  389   HG22  VAL  47          HG22      VAL  47  86.693  -6.156  10.848
  390   HG23  VAL  47          HG23      VAL  47  87.035  -4.603  11.610
  391    H    GLN  48           HN       GLN  48  88.045  -8.044  10.770
  392    HA   GLN  48           HA       GLN  48  88.193  -9.037   8.088
  393    HB2  GLN  48           HB2      GLN  48  86.288 -10.547   8.866
  394    HB3  GLN  48           HB1      GLN  48  87.758 -10.612   9.838
  395    HG2  GLN  48           HG2      GLN  48  86.798  -9.118  11.492
  396    HG3  GLN  48           HG1      GLN  48  85.370  -8.862  10.488
  397   HE21  GLN  48          HE21      GLN  48  87.194 -11.683  11.838
  398   HE22  GLN  48          HE22      GLN  48  85.803 -12.550  12.278
  399    H    GLY  49           HN       GLY  49  86.661  -6.334   9.087
  400    HA2  GLY  49           HA2      GLY  49  84.140  -6.692   7.617
  401    HA3  GLY  49           HA1      GLY  49  84.668  -5.215   8.423
  402    H1U  RCY  50           H1U      RCY  50  86.184  -1.108  -1.175
  403    H1S  RCY  50           H1S      RCY  50  85.730  -5.066  -0.053
  404    HB1  RCY  50           HB1      RCY  50  85.306  -4.688   3.585
  405    HB2  RCY  50           HB2      RCY  50  85.292  -6.442   3.749
  406    HA   RCY  50           HA       RCY  50  87.861  -6.097   4.283
  407    HN1  RCY  50           HN1      RCY  50  86.965  -6.743   6.353
  408    H    GLY  51           HN       GLY  51  89.388  -4.543   4.672
  409    HA2  GLY  51           HA2      GLY  51  88.674  -1.901   5.680
  410    HA3  GLY  51           HA1      GLY  51  90.291  -2.427   5.211
  411    H    ASP  52           HN       ASP  52  91.035  -1.158   3.587
  412    HA   ASP  52           HA       ASP  52  89.388  -0.820   1.166
  413    HB2  ASP  52           HB2      ASP  52  90.540   1.652   2.467
  414    HB3  ASP  52           HB1      ASP  52  89.354   1.550   1.164
  415    H    ASP  53           HN       ASP  53  90.838  -1.551  -0.317
  416    HA   ASP  53           HA       ASP  53  93.716  -0.853   0.009
  417    HB2  ASP  53           HB2      ASP  53  93.004  -3.249  -0.389
  418    HB3  ASP  53           HB1      ASP  53  92.459  -2.751  -1.991
  419    H    ILE  54           HN       ILE  54  90.920  -0.034  -1.825
  420    HA   ILE  54           HA       ILE  54  92.553   1.828  -3.447
  421    HB   ILE  54           HB       ILE  54  90.863   0.998  -5.402
  422   HG12  ILE  54          HG12      ILE  54  90.850  -1.499  -5.351
  423   HG13  ILE  54          HG11      ILE  54  91.492  -1.442  -3.709
  424   HG21  ILE  54          HG21      ILE  54  93.547  -0.208  -4.665
  425   HG22  ILE  54          HG22      ILE  54  93.277   1.225  -5.657
  426   HG23  ILE  54          HG23      ILE  54  92.785  -0.363  -6.248
  427   HD11  ILE  54          HD11      ILE  54  88.887  -0.162  -4.585
  428   HD12  ILE  54          HD12      ILE  54  89.519  -0.225  -2.940
  429   HD13  ILE  54          HD13      ILE  54  89.014  -1.709  -3.748
  430    HA   PRO  55           HA       PRO  55  88.536   3.605  -2.027
  431    HB2  PRO  55           HB2      PRO  55  89.527   5.718  -0.659
  432    HB3  PRO  55           HB1      PRO  55  89.454   4.092   0.049
  433    HG2  PRO  55           HG2      PRO  55  91.777   5.559  -1.072
  434    HG3  PRO  55           HG1      PRO  55  91.697   4.445   0.301
  435    HD2  PRO  55           HD2      PRO  55  92.588   3.778  -2.269
  436    HD3  PRO  55           HD1      PRO  55  92.087   2.617  -1.021
  437    H    GLY  56           HN       GLY  56  87.975   4.280  -4.168
  438    HA2  GLY  56           HA2      GLY  56  87.733   6.888  -4.860
  439    HA3  GLY  56           HA1      GLY  56  89.392   6.568  -5.367
  440    H    MET  57           HN       MET  57  89.462   4.259  -6.591
  441    HA   MET  57           HA       MET  57  88.246   4.603  -9.095
  442    HB2  MET  57           HB2      MET  57  90.102   2.945  -8.390
  443    HB3  MET  57           HB1      MET  57  88.783   1.861  -7.949
  444    HG2  MET  57           HG2      MET  57  89.307   1.290 -10.194
  445    HG3  MET  57           HG1      MET  57  87.860   2.292 -10.311
  446    HE1  MET  57           HE1      MET  57  88.321   3.009 -12.929
  447    HE2  MET  57           HE2      MET  57  89.409   1.655 -12.636
  448    HE3  MET  57           HE3      MET  57  90.005   3.094 -13.460
  449    H    GLU  58           HN       GLU  58  87.039   2.871  -6.247
  450    HA   GLU  58           HA       GLU  58  84.530   2.207  -7.695
  451    HB2  GLU  58           HB2      GLU  58  85.810   1.330  -5.125
  452    HB3  GLU  58           HB1      GLU  58  84.060   1.182  -5.290
  453    HG2  GLU  58           HG2      GLU  58  85.368  -0.865  -6.016
  454    HG3  GLU  58           HG1      GLU  58  84.283  -0.210  -7.243
  455    H    GLY  59           HN       GLY  59  85.607   4.924  -6.428
  456    HA2  GLY  59           HA2      GLY  59  83.931   5.772  -4.360
  457    HA3  GLY  59           HA1      GLY  59  84.482   6.840  -5.652
  458    H1U  RCY  60           H1U      RCY  60  75.688   4.250 -10.720
  459    H1S  RCY  60           H1S      RCY  60  79.154   5.366  -7.921
  460    HB1  RCY  60           HB1      RCY  60  78.445   5.393  -5.650
  461    HB2  RCY  60           HB2      RCY  60  79.637   5.027  -4.402
  462    HA   RCY  60           HA       RCY  60  80.231   6.755  -6.820
  463    HN1  RCY  60           HN1      RCY  60  81.854   6.861  -4.368
  464    H    GLY  61           HN       GLY  61  78.698   8.365  -6.766
  465    HA2  GLY  61           HA2      GLY  61  78.640  10.106  -4.403
  466    HA3  GLY  61           HA1      GLY  61  77.825  10.415  -5.938
  467    H    THR  62           HN       THR  62  77.407   9.309  -2.737
  468    HA   THR  62           HA       THR  62  74.529   8.964  -3.192
  469    HB   THR  62           HB       THR  62  75.143   6.718  -3.714
  470    HG1  THR  62           HG1      THR  62  73.852   5.879  -2.292
  471   HG21  THR  62          HG21      THR  62  77.023   6.973  -1.359
  472   HG22  THR  62          HG22      THR  62  77.442   6.680  -3.047
  473   HG23  THR  62          HG23      THR  62  76.632   5.426  -2.109
  474    H    ASP  63           HN       ASP  63  75.371  10.953  -1.725
  475    HA   ASP  63           HA       ASP  63  76.058  10.383   1.008
  476    HB2  ASP  63           HB2      ASP  63  75.197  12.727   1.419
  477    HB3  ASP  63           HB1      ASP  63  76.416  12.618   0.149
  478    H    ILE  64           HN       ILE  64  74.410   8.518   1.041
  479    HA   ILE  64           HA       ILE  64  72.381   7.630   1.797
  480    HB   ILE  64           HB       ILE  64  72.192  10.296   3.221
  481   HG12  ILE  64          HG12      ILE  64  73.398   7.658   4.118
  482   HG13  ILE  64          HG11      ILE  64  74.316   9.099   3.680
  483   HG21  ILE  64          HG21      ILE  64  70.081   9.049   3.209
  484   HG22  ILE  64          HG22      ILE  64  70.799   8.996   4.819
  485   HG23  ILE  64          HG23      ILE  64  70.917   7.595   3.755
  486   HD11  ILE  64          HD11      ILE  64  74.151   9.170   6.053
  487   HD12  ILE  64          HD12      ILE  64  72.445   8.724   6.023
  488   HD13  ILE  64          HD13      ILE  64  72.949  10.323   5.474
  489    H    THR  65           HN       THR  65  71.173   7.588  -0.138
  490    HA   THR  65           HA       THR  65  70.039   9.736  -1.493
  491    HB   THR  65           HB       THR  65  68.164   8.128  -2.099
  492    HG1  THR  65           HG1      THR  65  68.557   7.060   0.073
  493   HG21  THR  65          HG21      THR  65  70.240   8.226  -3.403
  494   HG22  THR  65          HG22      THR  65  69.677   6.559  -3.278
  495   HG23  THR  65          HG23      THR  65  71.016   7.115  -2.275
  496    H    VAL  66           HN       VAL  66  68.742   8.041   1.353
  497    HA   VAL  66           HA       VAL  66  67.468  10.456   2.306
  498    HB   VAL  66           HB       VAL  66  65.121   9.239   2.252
  499   HG11  VAL  66          HG11      VAL  66  64.532  10.704   0.574
  500   HG12  VAL  66          HG12      VAL  66  65.905  10.261  -0.439
  501   HG13  VAL  66          HG13      VAL  66  66.136  11.341   0.935
  502   HG21  VAL  66          HG21      VAL  66  66.293   8.163  -0.313
  503   HG22  VAL  66          HG22      VAL  66  64.775   7.724   0.469
  504   HG23  VAL  66          HG23      VAL  66  66.309   7.202   1.165
  505    H    ILE  67           HN       ILE  67  67.395   6.887   2.463
  506    HA   ILE  67           HA       ILE  67  67.678   7.124   5.424
  507    HB   ILE  67           HB       ILE  67  65.751   5.272   3.987
  508   HG12  ILE  67          HG12      ILE  67  64.364   6.731   5.879
  509   HG13  ILE  67          HG11      ILE  67  65.515   7.914   5.258
  510   HG21  ILE  67          HG21      ILE  67  66.634   4.085   5.863
  511   HG22  ILE  67          HG22      ILE  67  65.090   4.747   6.402
  512   HG23  ILE  67          HG23      ILE  67  66.598   5.526   6.880
  513   HD11  ILE  67          HD11      ILE  67  63.392   6.387   3.763
  514   HD12  ILE  67          HD12      ILE  67  64.792   7.040   2.912
  515   HD13  ILE  67          HD13      ILE  67  63.702   8.124   3.776
  516    H1U  RCY  68           H1U      RCY  68  74.623   0.810   0.871
  517    H1S  RCY  68           H1S      RCY  68  73.122   5.095   0.996
  518    HB1  RCY  68           HB1      RCY  68  72.697   4.319   4.582
  519    HB2  RCY  68           HB2      RCY  68  72.117   5.948   4.919
  520    HA   RCY  68           HA       RCY  68  70.248   3.609   4.466
  521    HN1  RCY  68           HN1      RCY  68  69.700   6.284   5.696
  522    HA   PRO  69           HA       PRO  69  70.831   1.703   8.400
  523    HB2  PRO  69           HB2      PRO  69  73.728   1.492   7.607
  524    HB3  PRO  69           HB1      PRO  69  72.681   0.271   8.361
  525    HG2  PRO  69           HG2      PRO  69  73.201   0.234   5.747
  526    HG3  PRO  69           HG1      PRO  69  71.607  -0.214   6.377
  527    HD2  PRO  69           HD2      PRO  69  72.397   2.201   4.851
  528    HD3  PRO  69           HD1      PRO  69  70.788   1.473   5.054
  529    H    TRP  70           HN       TRP  70  72.939   4.326   7.422
  530    HA   TRP  70           HA       TRP  70  74.216   4.849   9.916
  531    HD1  TRP  70           HD1      TRP  70  75.252   3.788   8.144
  532    HE1  TRP  70           HE1      TRP  70  77.654   3.804   7.214
  533    HE3  TRP  70           HE3      TRP  70  75.931   8.813   7.542
  534    HZ2  TRP  70           HZ2      TRP  70  79.611   5.700   6.329
  535    HZ3  TRP  70           HZ3      TRP  70  78.068   9.695   6.656
  536    HH2  TRP  70           HH2      TRP  70  79.907   8.150   6.049
  537    HB2  TRP  70           HB2      TRP  70  73.448   6.593   7.573
  538    HB3  TRP  70           HB1      TRP  70  74.203   7.285   9.008
  539    H    GLU  71           HN       GLU  71  70.970   4.774   9.227
  540    HA   GLU  71           HA       GLU  71  70.345   6.309  11.685
  541    HB2  GLU  71           HB2      GLU  71  69.127   6.853   8.962
  542    HB3  GLU  71           HB1      GLU  71  68.421   7.420  10.476
  543    HG2  GLU  71           HG2      GLU  71  70.578   8.576  10.995
  544    HG3  GLU  71           HG1      GLU  71  71.175   8.101   9.405
  545    H    ALA  72           HN       ALA  72  69.203   4.203   9.060
  546    HA   ALA  72           HA       ALA  72  66.853   3.332  10.550
  547    HB1  ALA  72           HB1      ALA  72  68.210   2.139   8.111
  548    HB2  ALA  72           HB2      ALA  72  66.868   3.283   8.090
  549    HB3  ALA  72           HB3      ALA  72  66.631   1.658   8.733
  550    H1U  RCY  73           H1U      RCY  73  70.999   2.127   4.538
  551    H1S  RCY  73           H1S      RCY  73  68.337  -0.841   6.726
  552    HB1  RCY  73           HB1      RCY  73  70.416  -2.173  10.388
  553    HB2  RCY  73           HB2      RCY  73  70.899  -0.900   9.269
  554    HA   RCY  73           HA       RCY  73  68.923  -0.664  11.556
  555    HN1  RCY  73           HN1      RCY  73  69.108   0.992   9.184
  556    H    ASN  74           HN       ASN  74  72.078  -0.045  10.131
  557    HA   ASN  74           HA       ASN  74  73.178   1.808  11.909
  558    HB2  ASN  74           HB2      ASN  74  72.724  -0.847  13.131
  559    HB3  ASN  74           HB1      ASN  74  74.366  -0.237  13.325
  560   HD21  ASN  74          HD21      ASN  74  74.094   2.453  13.705
  561   HD22  ASN  74          HD22      ASN  74  73.091   2.794  15.031
  562    H    HIS  75           HN       HIS  75  74.652  -1.386  11.759
  563    HA   HIS  75           HA       HIS  75  75.960  -1.218   9.263
  564    HD1  HIS  75           HD1      HIS  75  76.149   2.188  11.619
  565    HD2  HIS  75           HD2      HIS  75  78.405  -0.962  13.164
  566    HE1  HIS  75           HE1      HIS  75  76.386   2.628  14.102
  567    HE2  HIS  75           HE2      HIS  75  77.757   0.718  15.055
  568    HB2  HIS  75           HB2      HIS  75  78.289  -0.543  10.292
  569    HB3  HIS  75           HB1      HIS  75  77.160   0.717   9.798
  570    H1U  RCY  76           H1U      RCY  76  76.317  -3.462   6.059
  571    H1S  RCY  76           H1S      RCY  76  79.194  -4.212   7.544
  572    HB1  RCY  76           HB1      RCY  76  78.863  -5.523  11.143
  573    HB2  RCY  76           HB2      RCY  76  78.841  -4.011  10.237
  574    HA   RCY  76           HA       RCY  76  76.421  -5.660   9.888
  575    HN1  RCY  76           HN1      RCY  76  75.913  -3.454   9.250
  576    H    GLU  77           HN       GLU  77  75.250  -3.635  11.955
  577    HA   GLU  77           HA       GLU  77  76.164  -4.559  14.536
  578    HB2  GLU  77           HB2      GLU  77  74.870  -2.405  14.025
  579    HB3  GLU  77           HB1      GLU  77  73.428  -3.417  13.931
  580    HG2  GLU  77           HG2      GLU  77  73.492  -2.660  16.183
  581    HG3  GLU  77           HG1      GLU  77  74.107  -4.312  16.243
  582    H    LEU  78           HN       LEU  78  73.302  -5.346  12.540
  583    HA   LEU  78           HA       LEU  78  72.504  -7.490  14.360
  584    HG   LEU  78           HG       LEU  78  71.557  -4.952  12.860
  585    HB2  LEU  78           HB2      LEU  78  71.281  -7.753  11.757
  586    HB3  LEU  78           HB1      LEU  78  70.530  -7.278  13.277
  587   HD11  LEU  78          HD11      LEU  78  72.344  -4.408  10.724
  588   HD12  LEU  78          HD12      LEU  78  71.556  -5.797   9.974
  589   HD13  LEU  78          HD13      LEU  78  73.004  -6.028  10.955
  590   HD21  LEU  78          HD21      LEU  78  69.175  -5.307  12.639
  591   HD22  LEU  78          HD22      LEU  78  69.389  -6.100  11.078
  592   HD23  LEU  78          HD23      LEU  78  69.705  -4.372  11.240
  593    H    HIS  79           HN       HIS  79  72.019  -9.712  13.079
  594    HA   HIS  79           HA       HIS  79  74.672 -10.665  12.248
  595    HD1  HIS  79           HD1      HIS  79  71.586 -12.147  15.041
  596    HD2  HIS  79           HD2      HIS  79  75.673 -12.170  14.207
  597    HE1  HIS  79           HE1      HIS  79  72.771 -12.279  17.275
  598    HE2  HIS  79           HE2      HIS  79  75.260 -12.294  16.782
  599    HB2  HIS  79           HB2      HIS  79  72.009 -12.074  12.593
  600    HB3  HIS  79           HB1      HIS  79  73.502 -12.891  12.131
  601    H    GLU  80           HN       GLU  80  73.889  -8.850  10.375
  602    HA   GLU  80           HA       GLU  80  72.535 -10.259   8.163
  603    HB2  GLU  80           HB2      GLU  80  72.313  -7.737   8.762
  604    HB3  GLU  80           HB1      GLU  80  73.875  -7.562   7.962
  605    HG2  GLU  80           HG2      GLU  80  72.252  -7.171   6.262
  606    HG3  GLU  80           HG1      GLU  80  72.833  -8.813   5.983
  607    H    LEU  81           HN       LEU  81  75.679  -9.987   9.376
  608    HA   LEU  81           HA       LEU  81  77.131  -9.991   6.870
  609    HG   LEU  81           HG       LEU  81  77.995 -12.365   9.491
  610    HB2  LEU  81           HB2      LEU  81  79.076 -10.508   8.197
  611    HB3  LEU  81           HB1      LEU  81  78.109  -9.358   9.114
  612   HD11  LEU  81          HD11      LEU  81  79.282 -10.280  11.275
  613   HD12  LEU  81          HD12      LEU  81  80.183 -11.304  10.157
  614   HD13  LEU  81          HD13      LEU  81  79.300 -12.029  11.500
  615   HD21  LEU  81          HD21      LEU  81  76.664  -9.992  10.780
  616   HD22  LEU  81          HD22      LEU  81  76.927 -11.468  11.709
  617   HD23  LEU  81          HD23      LEU  81  75.943 -11.510  10.246
  618    H    ALA  82           HN       ALA  82  75.545 -12.426   8.794
  619    HA   ALA  82           HA       ALA  82  76.922 -14.718   7.735
  620    HB1  ALA  82           HB1      ALA  82  75.542 -14.828   9.778
  621    HB2  ALA  82           HB2      ALA  82  74.981 -15.994   8.580
  622    HB3  ALA  82           HB3      ALA  82  74.098 -14.486   8.823
  623    H    GLN  83           HN       GLN  83  76.851 -13.639   5.442
  624    HA   GLN  83           HA       GLN  83  74.304 -14.238   4.025
  625    HB2  GLN  83           HB2      GLN  83  76.845 -12.843   3.130
  626    HB3  GLN  83           HB1      GLN  83  75.446 -13.117   2.094
  627    HG2  GLN  83           HG2      GLN  83  74.045 -11.741   3.470
  628    HG3  GLN  83           HG1      GLN  83  75.266 -11.662   4.741
  629   HE21  GLN  83          HE21      GLN  83  76.618 -11.499   1.581
  630   HE22  GLN  83          HE22      GLN  83  76.849  -9.818   1.523
  631    H    TYR  84           HN       TYR  84  77.394 -14.440   2.421
  632    HA   TYR  84           HA       TYR  84  77.555 -17.354   2.569
  633    HD1  TYR  84           HD1      TYR  84  75.767 -14.369   0.176
  634    HD2  TYR  84           HD2      TYR  84  78.542 -17.256  -1.378
  635    HE1  TYR  84           HE1      TYR  84  76.361 -12.810  -1.659
  636    HE2  TYR  84           HE2      TYR  84  79.136 -15.697  -3.213
  637    HH   TYR  84           HH       TYR  84  78.671 -13.760  -4.200
  638    HB2  TYR  84           HB2      TYR  84  76.970 -17.876   0.332
  639    HB3  TYR  84           HB1      TYR  84  75.702 -16.770   0.859
  640    H    GLY  85           HN       GLY  85  79.068 -14.594   2.640
  641    HA2  GLY  85           HA2      GLY  85  81.486 -15.655   1.254
  642    HA3  GLY  85           HA1      GLY  85  80.996 -13.982   0.977
  643    H    ILE  86           HN       ILE  86  80.704 -15.661   4.065
  644    HA   ILE  86           HA       ILE  86  81.723 -15.272   6.137
  645    HB   ILE  86           HB       ILE  86  83.965 -13.911   4.631
  646   HG12  ILE  86          HG12      ILE  86  83.655 -16.878   5.181
  647   HG13  ILE  86          HG11      ILE  86  83.375 -16.133   3.607
  648   HG21  ILE  86          HG21      ILE  86  85.305 -14.767   6.508
  649   HG22  ILE  86          HG22      ILE  86  83.873 -15.538   7.190
  650   HG23  ILE  86          HG23      ILE  86  83.972 -13.779   7.105
  651   HD11  ILE  86          HD11      ILE  86  85.977 -16.055   5.164
  652   HD12  ILE  86          HD12      ILE  86  85.698 -15.279   3.605
  653   HD13  ILE  86          HD13      ILE  86  85.660 -17.037   3.734
  654    H1U  RCY  87           H1U      RCY  87  76.634  -6.988   0.481
  655    H1S  RCY  87           H1S      RCY  87  78.451  -9.905   2.790
  656    HB1  RCY  87           HB1      RCY  87  82.755 -10.195   3.692
  657    HB2  RCY  87           HB2      RCY  87  81.655  -8.935   4.250
  658    HA   RCY  87           HA       RCY  87  81.799 -10.571   6.010
  659    HN1  RCY  87           HN1      RCY  87  81.777 -12.552   3.858
  Start of MODEL   11
    1    HA   MET   1           HA       MET   1  62.204 -13.767  11.286
    2    HB2  MET   1           HB2      MET   1  63.160 -11.154  12.403
    3    HB3  MET   1           HB1      MET   1  63.621 -12.797  12.848
    4    HG2  MET   1           HG2      MET   1  65.519 -12.074  11.695
    5    HG3  MET   1           HG1      MET   1  64.612 -12.882  10.417
    6    HE1  MET   1           HE1      MET   1  65.333 -10.332   7.908
    7    HE2  MET   1           HE2      MET   1  64.632 -11.915   8.235
    8    HE3  MET   1           HE3      MET   1  66.248 -11.534   8.826
    9    H    ASN   2           HN       ASN   2  60.099 -11.873  10.046
   10    HA   ASN   2           HA       ASN   2  58.859 -10.619  12.379
   11    HB2  ASN   2           HB2      ASN   2  56.935 -10.286  10.728
   12    HB3  ASN   2           HB1      ASN   2  58.466  -9.527  10.290
   13   HD21  ASN   2          HD21      ASN   2  59.954 -11.135   8.923
   14   HD22  ASN   2          HD22      ASN   2  59.151 -11.992   7.698
   15    H    LEU   3           HN       LEU   3  56.638 -12.270  10.357
   16    HA   LEU   3           HA       LEU   3  55.683 -13.837  12.630
   17    HG   LEU   3           HG       LEU   3  53.325 -13.780  12.539
   18    HB2  LEU   3           HB2      LEU   3  54.370 -12.727  10.579
   19    HB3  LEU   3           HB1      LEU   3  54.646 -14.313   9.861
   20   HD11  LEU   3          HD11      LEU   3  51.309 -14.642  11.438
   21   HD12  LEU   3          HD12      LEU   3  52.208 -14.872   9.938
   22   HD13  LEU   3          HD13      LEU   3  51.927 -13.245  10.557
   23   HD21  LEU   3          HD21      LEU   3  54.056 -16.323  11.068
   24   HD22  LEU   3          HD22      LEU   3  52.843 -16.284  12.348
   25   HD23  LEU   3          HD23      LEU   3  54.515 -15.852  12.705
   26    H    GLU   4           HN       GLU   4  56.298 -14.971   9.291
   27    HA   GLU   4           HA       GLU   4  57.204 -17.553  10.412
   28    HB2  GLU   4           HB2      GLU   4  56.824 -16.707   7.523
   29    HB3  GLU   4           HB1      GLU   4  57.106 -18.351   8.095
   30    HG2  GLU   4           HG2      GLU   4  54.731 -16.632   8.871
   31    HG3  GLU   4           HG1      GLU   4  54.695 -17.916   7.661
   32    HA   PRO   5           HA       PRO   5  61.479 -16.497   9.863
   33    HB2  PRO   5           HB2      PRO   5  62.576 -18.994   9.664
   34    HB3  PRO   5           HB1      PRO   5  61.968 -18.325  11.191
   35    HG2  PRO   5           HG2      PRO   5  60.673 -20.252   9.330
   36    HG3  PRO   5           HG1      PRO   5  60.692 -20.230  11.101
   37    HD2  PRO   5           HD2      PRO   5  58.557 -19.352   9.615
   38    HD3  PRO   5           HD1      PRO   5  58.939 -18.727  11.235
   39    HA   PRO   6           HA       PRO   6  62.240 -16.608   5.477
   40    HB2  PRO   6           HB2      PRO   6  64.903 -16.056   5.400
   41    HB3  PRO   6           HB1      PRO   6  63.691 -14.844   5.864
   42    HG2  PRO   6           HG2      PRO   6  65.479 -16.477   7.597
   43    HG3  PRO   6           HG1      PRO   6  65.014 -14.774   7.741
   44    HD2  PRO   6           HD2      PRO   6  63.867 -16.783   9.230
   45    HD3  PRO   6           HD1      PRO   6  63.033 -15.268   8.822
   46    H    LYS   7           HN       LYS   7  63.098 -17.964   3.822
   47    HA   LYS   7           HA       LYS   7  64.581 -20.388   4.775
   48    HB2  LYS   7           HB2      LYS   7  62.263 -20.123   2.860
   49    HB3  LYS   7           HB1      LYS   7  63.363 -21.496   2.759
   50    HG2  LYS   7           HG2      LYS   7  61.781 -22.350   4.229
   51    HG3  LYS   7           HG1      LYS   7  62.911 -21.626   5.373
   52    HD2  LYS   7           HD2      LYS   7  61.467 -19.480   5.097
   53    HD3  LYS   7           HD1      LYS   7  60.249 -20.572   4.437
   54    HE2  LYS   7           HE2      LYS   7  61.501 -20.653   7.191
   55    HE3  LYS   7           HE1      LYS   7  59.802 -20.406   6.787
   56    HZ1  LYS   7           HZ1      LYS   7  59.918 -22.676   5.722
   57    HZ2  LYS   7           HZ2      LYS   7  59.985 -22.639   7.419
   58    HZ3  LYS   7           HZ3      LYS   7  61.403 -22.880   6.516
   59    H    ALA   8           HN       ALA   8  63.761 -19.978   1.446
   60    HA   ALA   8           HA       ALA   8  66.321 -20.295   0.411
   61    HB1  ALA   8           HB1      ALA   8  64.055 -18.607  -0.689
   62    HB2  ALA   8           HB2      ALA   8  64.383 -20.302  -1.051
   63    HB3  ALA   8           HB3      ALA   8  65.492 -19.050  -1.609
   64    H    GLU   9           HN       GLU   9  65.092 -17.107  -0.308
   65    HA   GLU   9           HA       GLU   9  66.818 -15.643   1.479
   66    HB2  GLU   9           HB2      GLU   9  68.466 -16.732  -0.147
   67    HB3  GLU   9           HB1      GLU   9  67.762 -15.702  -1.395
   68    HG2  GLU   9           HG2      GLU   9  69.662 -14.518  -0.541
   69    HG3  GLU   9           HG1      GLU   9  68.239 -13.725   0.136
   70    H1U  RCY  10           H1U      RCY  10  59.874 -15.463   1.449
   71    H1S  RCY  10           H1S      RCY  10  62.188 -16.468  -1.881
   72    HB1  RCY  10           HB1      RCY  10  65.198 -14.113  -3.880
   73    HB2  RCY  10           HB2      RCY  10  63.845 -12.982  -3.844
   74    HA   RCY  10           HA       RCY  10  65.053 -12.645  -1.802
   75    HN1  RCY  10           HN1      RCY  10  65.664 -15.426  -1.913
   76    H    ARG  11           HN       ARG  11  62.569 -12.001  -2.237
   77    HA   ARG  11           HA       ARG  11  60.687 -13.497  -0.548
   78    HE   ARG  11           HE       ARG  11  62.682 -10.837   3.020
   79    HB2  ARG  11           HB2      ARG  11  60.241 -11.522   0.925
   80    HB3  ARG  11           HB1      ARG  11  61.846 -12.212   1.161
   81    HG2  ARG  11           HG2      ARG  11  62.161 -10.332  -0.904
   82    HG3  ARG  11           HG1      ARG  11  61.119  -9.542   0.280
   83    HD2  ARG  11           HD2      ARG  11  63.763 -10.889   0.907
   84    HD3  ARG  11           HD1      ARG  11  63.516  -9.148   0.773
   85   HH11  ARG  11          HH21      ARG  11  62.309  -7.906   1.244
   86   HH12  ARG  11          HH22      ARG  11  61.632  -7.029   2.575
   87   HH21  ARG  11          HH11      ARG  11  61.799  -9.710   4.769
   88   HH22  ARG  11          HH12      ARG  11  61.343  -8.051   4.571
   89    H    SER  12           HN       SER  12  59.000 -13.514  -1.964
   90    HA   SER  12           HA       SER  12  57.375 -12.734  -3.468
   91    HG   SER  12           HG       SER  12  55.607 -11.370  -3.307
   92    HB2  SER  12           HB2      SER  12  56.925 -11.315  -1.391
   93    HB3  SER  12           HB1      SER  12  57.848 -10.037  -2.177
   94    H    ALA  13           HN       ALA  13  57.095 -10.328  -4.829
   95    HA   ALA  13           HA       ALA  13  59.373 -10.490  -6.677
   96    HB1  ALA  13           HB1      ALA  13  57.113 -10.324  -7.600
   97    HB2  ALA  13           HB2      ALA  13  58.035  -8.885  -8.037
   98    HB3  ALA  13           HB3      ALA  13  56.847  -8.809  -6.736
   99    H    THR  14           HN       THR  14  57.700  -7.657  -5.254
  100    HA   THR  14           HA       THR  14  60.285  -6.557  -4.365
  101    HB   THR  14           HB       THR  14  59.903  -4.422  -5.639
  102    HG1  THR  14           HG1      THR  14  58.277  -5.805  -7.411
  103   HG21  THR  14          HG21      THR  14  60.115  -6.785  -7.509
  104   HG22  THR  14          HG22      THR  14  61.410  -6.353  -6.393
  105   HG23  THR  14          HG23      THR  14  60.908  -5.216  -7.644
  106    H    ARG  15           HN       ARG  15  56.801  -6.029  -4.826
  107    HA   ARG  15           HA       ARG  15  55.331  -4.631  -3.582
  108    HE   ARG  15           HE       ARG  15  55.696  -5.577   0.667
  109    HB2  ARG  15           HB2      ARG  15  55.135  -5.512  -1.258
  110    HB3  ARG  15           HB1      ARG  15  55.213  -6.793  -2.466
  111    HG2  ARG  15           HG2      ARG  15  57.534  -7.216  -1.987
  112    HG3  ARG  15           HG1      ARG  15  57.644  -5.777  -0.972
  113    HD2  ARG  15           HD2      ARG  15  55.942  -8.223  -0.404
  114    HD3  ARG  15           HD1      ARG  15  57.437  -7.789   0.425
  115   HH11  ARG  15          HH21      ARG  15  55.897  -8.905   1.547
  116   HH12  ARG  15          HH22      ARG  15  54.963  -8.716   2.993
  117   HH21  ARG  15          HH11      ARG  15  54.475  -5.312   2.551
  118   HH22  ARG  15          HH12      ARG  15  54.158  -6.682   3.562
  119    H    VAL  16           HN       VAL  16  57.850  -3.280  -4.010
  120    HA   VAL  16           HA       VAL  16  59.103  -1.491  -3.146
  121    HB   VAL  16           HB       VAL  16  56.803  -1.047  -1.242
  122   HG11  VAL  16          HG11      VAL  16  57.369   1.249  -1.488
  123   HG12  VAL  16          HG12      VAL  16  58.333   0.937  -2.932
  124   HG13  VAL  16          HG13      VAL  16  58.917   0.415  -1.351
  125   HG21  VAL  16          HG21      VAL  16  55.684  -1.550  -3.298
  126   HG22  VAL  16          HG22      VAL  16  56.881  -0.665  -4.244
  127   HG23  VAL  16          HG23      VAL  16  55.755   0.210  -3.206
  128    H    MET  17           HN       MET  17  58.230  -0.836  -0.127
  129    HA   MET  17           HA       MET  17  60.437  -2.437   1.007
  130    HB2  MET  17           HB2      MET  17  58.778  -0.119   2.004
  131    HB3  MET  17           HB1      MET  17  59.840  -1.021   3.088
  132    HG2  MET  17           HG2      MET  17  61.779  -0.470   1.789
  133    HG3  MET  17           HG1      MET  17  60.793   0.174   0.476
  134    HE1  MET  17           HE1      MET  17  60.345   2.497   0.140
  135    HE2  MET  17           HE2      MET  17  59.743   3.577   1.396
  136    HE3  MET  17           HE3      MET  17  58.897   2.068   1.060
  137    H    GLY  18           HN       GLY  18  59.883  -3.138   3.443
  138    HA2  GLY  18           HA2      GLY  18  57.750  -5.124   3.182
  139    HA3  GLY  18           HA1      GLY  18  58.837  -4.947   4.560
  140    H    GLY  19           HN       GLY  19  56.274  -3.011   2.966
  141    HA2  GLY  19           HA2      GLY  19  54.269  -2.222   3.991
  142    HA3  GLY  19           HA1      GLY  19  54.862  -2.805   5.546
  143    HA   PRO  20           HA       PRO  20  55.056   1.944   5.200
  144    HB2  PRO  20           HB2      PRO  20  54.257   1.440   8.042
  145    HB3  PRO  20           HB1      PRO  20  53.692   2.691   6.917
  146    HG2  PRO  20           HG2      PRO  20  52.201   0.564   7.495
  147    HG3  PRO  20           HG1      PRO  20  52.216   1.275   5.873
  148    HD2  PRO  20           HD2      PRO  20  53.448  -1.270   6.821
  149    HD3  PRO  20           HD1      PRO  20  52.839  -0.842   5.207
  150    H1U  RCY  21           H1U      RCY  21  63.442   6.414   3.773
  151    H1S  RCY  21           H1S      RCY  21  60.915   4.427   6.194
  152    HB1  RCY  21           HB1      RCY  21  59.576   3.226   5.478
  153    HB2  RCY  21           HB2      RCY  21  59.391   1.484   5.678
  154    HA   RCY  21           HA       RCY  21  58.570   1.939   8.030
  155    HN1  RCY  21           HN1      RCY  21  56.772   3.203   6.016
  156    H    THR  22           HN       THR  22  58.812   3.406   9.642
  157    HA   THR  22           HA       THR  22  57.939   6.077   9.574
  158    HB   THR  22           HB       THR  22  58.630   6.103  11.740
  159    HG1  THR  22           HG1      THR  22  61.082   5.593  10.520
  160   HG21  THR  22          HG21      THR  22  59.115   3.953  12.702
  161   HG22  THR  22          HG22      THR  22  59.769   3.356  11.176
  162   HG23  THR  22          HG23      THR  22  58.041   3.675  11.330
  163    HA   PRO  23           HA       PRO  23  61.029   8.222   7.250
  164    HB2  PRO  23           HB2      PRO  23  61.051  10.668   8.476
  165    HB3  PRO  23           HB1      PRO  23  59.716  10.112   7.447
  166    HG2  PRO  23           HG2      PRO  23  59.911  10.167  10.416
  167    HG3  PRO  23           HG1      PRO  23  58.533  10.541   9.366
  168    HD2  PRO  23           HD2      PRO  23  58.800   8.151  10.686
  169    HD3  PRO  23           HD1      PRO  23  57.923   8.320   9.149
  170    H    ARG  24           HN       ARG  24  63.019   7.191   7.707
  171    HA   ARG  24           HA       ARG  24  64.441   7.891  10.209
  172    HE   ARG  24           HE       ARG  24  65.907   3.353   8.563
  173    HB2  ARG  24           HB2      ARG  24  64.385   5.530   9.265
  174    HB3  ARG  24           HB1      ARG  24  65.412   6.117   7.957
  175    HG2  ARG  24           HG2      ARG  24  66.985   6.988   9.781
  176    HG3  ARG  24           HG1      ARG  24  66.045   6.012  10.910
  177    HD2  ARG  24           HD2      ARG  24  67.571   5.026   8.485
  178    HD3  ARG  24           HD1      ARG  24  67.933   4.686  10.177
  179   HH11  ARG  24          HH21      ARG  24  66.892   4.366  11.707
  180   HH12  ARG  24          HH22      ARG  24  65.990   3.139  12.531
  181   HH21  ARG  24          HH11      ARG  24  64.723   1.744   9.620
  182   HH22  ARG  24          HH12      ARG  24  64.762   1.654  11.350
  183    H    LYS  25           HN       LYS  25  65.451   9.851  10.118
  184    HA   LYS  25           HA       LYS  25  66.581  10.816   7.564
  185    HB2  LYS  25           HB2      LYS  25  67.261  12.777   9.187
  186    HB3  LYS  25           HB1      LYS  25  65.576  12.593   8.702
  187    HG2  LYS  25           HG2      LYS  25  66.484  11.095  11.121
  188    HG3  LYS  25           HG1      LYS  25  66.268  12.840  11.274
  189    HD2  LYS  25           HD2      LYS  25  64.120  11.245   9.926
  190    HD3  LYS  25           HD1      LYS  25  64.232  11.195  11.686
  191    HE2  LYS  25           HE2      LYS  25  64.083  13.631  11.801
  192    HE3  LYS  25           HE1      LYS  25  64.077  13.738  10.041
  193    HZ1  LYS  25           HZ1      LYS  25  62.007  12.580   9.959
  194    HZ2  LYS  25           HZ2      LYS  25  61.844  13.867  11.056
  195    HZ3  LYS  25           HZ3      LYS  25  62.037  12.279  11.628
  196    H    GLY  26           HN       GLY  26  67.651   9.589  10.693
  197    HA2  GLY  26           HA2      GLY  26  69.768   8.862  11.394
  198    HA3  GLY  26           HA1      GLY  26  70.191   8.755   9.686
  199    HA   PRO  27           HA       PRO  27  71.173  13.292  11.108
  200    HB2  PRO  27           HB2      PRO  27  71.208  13.111  14.047
  201    HB3  PRO  27           HB1      PRO  27  70.338  14.254  13.008
  202    HG2  PRO  27           HG2      PRO  27  69.110  12.325  14.435
  203    HG3  PRO  27           HG1      PRO  27  68.484  12.942  12.897
  204    HD2  PRO  27           HD2      PRO  27  69.944  10.377  13.445
  205    HD3  PRO  27           HD1      PRO  27  68.605  10.695  12.317
  206    HA   PRO  28           HA       PRO  28  75.527  12.911  11.747
  207    HB2  PRO  28           HB2      PRO  28  75.344  14.608  14.214
  208    HB3  PRO  28           HB1      PRO  28  76.443  14.752  12.828
  209    HG2  PRO  28           HG2      PRO  28  74.337  16.359  13.112
  210    HG3  PRO  28           HG1      PRO  28  74.870  15.797  11.520
  211    HD2  PRO  28           HD2      PRO  28  72.469  14.999  13.080
  212    HD3  PRO  28           HD1      PRO  28  72.738  14.960  11.324
  213    H    LYS  29           HN       LYS  29  76.607  11.176  12.593
  214    HA   LYS  29           HA       LYS  29  76.663  10.569  15.413
  215    HB2  LYS  29           HB2      LYS  29  74.379   9.761  14.918
  216    HB3  LYS  29           HB1      LYS  29  75.025   8.723  13.647
  217    HG2  LYS  29           HG2      LYS  29  76.185   7.354  15.195
  218    HG3  LYS  29           HG1      LYS  29  76.033   8.545  16.487
  219    HD2  LYS  29           HD2      LYS  29  73.527   7.454  15.271
  220    HD3  LYS  29           HD1      LYS  29  74.426   6.429  16.390
  221    HE2  LYS  29           HE2      LYS  29  73.711   9.286  17.065
  222    HE3  LYS  29           HE1      LYS  29  72.625   7.942  17.420
  223    HZ1  LYS  29           HZ1      LYS  29  75.206   8.612  18.606
  224    HZ2  LYS  29           HZ2      LYS  29  74.844   6.963  18.421
  225    HZ3  LYS  29           HZ3      LYS  29  73.815   7.964  19.330
  226    H1U  RCY  30           H1U      RCY  30  77.053   9.291   5.450
  227    H1S  RCY  30           H1S      RCY  30  79.199   9.087   8.901
  228    HB1  RCY  30           HB1      RCY  30  77.987   8.410  10.361
  229    HB2  RCY  30           HB2      RCY  30  77.920   6.694  10.756
  230    HA   RCY  30           HA       RCY  30  78.817   7.011  12.882
  231    HN1  RCY  30           HN1      RCY  30  76.778   8.823  12.279
  232    H    LYS  31           HN       LYS  31  81.152   7.104  12.351
  233    HA   LYS  31           HA       LYS  31  82.294   9.706  13.183
  234    HB2  LYS  31           HB2      LYS  31  83.821   7.154  12.640
  235    HB3  LYS  31           HB1      LYS  31  84.286   8.504  13.676
  236    HG2  LYS  31           HG2      LYS  31  81.975   6.601  14.165
  237    HG3  LYS  31           HG1      LYS  31  83.502   6.626  15.048
  238    HD2  LYS  31           HD2      LYS  31  82.957   9.075  15.601
  239    HD3  LYS  31           HD1      LYS  31  81.323   8.718  15.037
  240    HE2  LYS  31           HE2      LYS  31  81.525   8.418  17.490
  241    HE3  LYS  31           HE1      LYS  31  81.133   6.901  16.680
  242    HZ1  LYS  31           HZ1      LYS  31  83.324   7.460  18.311
  243    HZ2  LYS  31           HZ2      LYS  31  83.921   7.204  16.742
  244    HZ3  LYS  31           HZ3      LYS  31  82.971   6.015  17.496
  245    H    GLN  32           HN       GLN  32  81.385  10.266  10.803
  246    HA   GLN  32           HA       GLN  32  82.728   9.471   8.471
  247    HB2  GLN  32           HB2      GLN  32  81.744  12.248   9.204
  248    HB3  GLN  32           HB1      GLN  32  82.160  11.722   7.574
  249    HG2  GLN  32           HG2      GLN  32  79.868  11.334   7.571
  250    HG3  GLN  32           HG1      GLN  32  80.461   9.764   8.113
  251   HE21  GLN  32          HE21      GLN  32  77.884  10.363   8.877
  252   HE22  GLN  32          HE22      GLN  32  77.820  10.770  10.524
  253    H    ARG  33           HN       ARG  33  84.782   9.776   7.713
  254    HA   ARG  33           HA       ARG  33  86.842  10.812   9.401
  255    HE   ARG  33           HE       ARG  33  85.631   8.693   7.933
  256    HB2  ARG  33           HB2      ARG  33  88.214  10.777   7.243
  257    HB3  ARG  33           HB1      ARG  33  87.493   9.242   7.722
  258    HG2  ARG  33           HG2      ARG  33  85.694  10.860   6.071
  259    HG3  ARG  33           HG1      ARG  33  87.197  10.454   5.241
  260    HD2  ARG  33           HD2      ARG  33  85.230   8.768   5.082
  261    HD3  ARG  33           HD1      ARG  33  86.833   8.135   5.457
  262   HH11  ARG  33          HH21      ARG  33  85.054   6.767   5.132
  263   HH12  ARG  33          HH22      ARG  33  84.225   5.518   5.999
  264   HH21  ARG  33          HH11      ARG  33  84.552   7.073   9.081
  265   HH22  ARG  33          HH12      ARG  33  83.941   5.691   8.235
  266    H    GLN  34           HN       GLN  34  87.428  12.200   6.414
  267    HA   GLN  34           HA       GLN  34  86.067  14.741   6.826
  268    HB2  GLN  34           HB2      GLN  34  88.669  14.290   8.047
  269    HB3  GLN  34           HB1      GLN  34  88.761  15.589   6.859
  270    HG2  GLN  34           HG2      GLN  34  86.838  16.707   7.928
  271    HG3  GLN  34           HG1      GLN  34  86.741  15.408   9.118
  272   HE21  GLN  34          HE21      GLN  34  88.177  15.492  10.906
  273   HE22  GLN  34          HE22      GLN  34  89.354  16.698  11.109
  274    H    THR  35           HN       THR  35  85.470  14.454   4.634
  275    HA   THR  35           HA       THR  35  87.566  15.217   2.699
  276    HB   THR  35           HB       THR  35  86.954  13.357   1.154
  277    HG1  THR  35           HG1      THR  35  85.498  12.506   3.431
  278   HG21  THR  35          HG21      THR  35  88.299  11.701   2.221
  279   HG22  THR  35          HG22      THR  35  87.828  12.252   3.828
  280   HG23  THR  35          HG23      THR  35  88.881  13.252   2.827
  281    H    ARG  36           HN       ARG  36  84.170  14.400   3.316
  282    HA   ARG  36           HA       ARG  36  82.196  15.300   2.429
  283    HE   ARG  36           HE       ARG  36  85.257  19.640   4.354
  284    HB2  ARG  36           HB2      ARG  36  83.937  17.696   1.783
  285    HB3  ARG  36           HB1      ARG  36  82.192  17.683   2.047
  286    HG2  ARG  36           HG2      ARG  36  82.610  16.867   4.381
  287    HG3  ARG  36           HG1      ARG  36  84.339  17.072   4.099
  288    HD2  ARG  36           HD2      ARG  36  82.389  19.335   3.660
  289    HD3  ARG  36           HD1      ARG  36  83.102  19.023   5.243
  290   HH11  ARG  36          HH21      ARG  36  82.665  19.701   2.080
  291   HH12  ARG  36          HH22      ARG  36  83.540  20.626   0.906
  292   HH21  ARG  36          HH11      ARG  36  86.414  20.848   2.834
  293   HH22  ARG  36          HH12      ARG  36  85.663  21.276   1.333
  294    H    GLN  37           HN       GLN  37  84.671  14.324   0.565
  295    HA   GLN  37           HA       GLN  37  83.047  14.486  -1.881
  296    HB2  GLN  37           HB2      GLN  37  85.742  15.839  -1.629
  297    HB3  GLN  37           HB1      GLN  37  85.054  15.381  -3.186
  298    HG2  GLN  37           HG2      GLN  37  82.966  16.685  -2.487
  299    HG3  GLN  37           HG1      GLN  37  83.939  17.340  -1.170
  300   HE21  GLN  37          HE21      GLN  37  83.074  17.853  -4.415
  301   HE22  GLN  37          HE22      GLN  37  84.319  18.929  -4.833
  302    H1U  RCY  38           H1U      RCY  38  83.203   4.010  -1.077
  303    H1S  RCY  38           H1S      RCY  38  84.015   7.942  -1.450
  304    HB1  RCY  38           HB1      RCY  38  84.419  10.600  -1.955
  305    HB2  RCY  38           HB2      RCY  38  84.752   9.987  -0.337
  306    HA   RCY  38           HA       RCY  38  86.817  11.155  -0.201
  307    HN1  RCY  38           HN1      RCY  38  85.582  13.136   0.017
  308    H    LYS  39           HN       LYS  39  88.237   9.972  -1.714
  309    HA   LYS  39           HA       LYS  39  88.924  11.666  -4.075
  310    HB2  LYS  39           HB2      LYS  39  90.598   9.547  -2.693
  311    HB3  LYS  39           HB1      LYS  39  91.142  10.668  -3.939
  312    HG2  LYS  39           HG2      LYS  39  91.816  11.905  -2.132
  313    HG3  LYS  39           HG1      LYS  39  90.132  12.430  -2.144
  314    HD2  LYS  39           HD2      LYS  39  89.620  10.485  -0.601
  315    HD3  LYS  39           HD1      LYS  39  91.361  10.240  -0.453
  316    HE2  LYS  39           HE2      LYS  39  90.493  11.636   1.396
  317    HE3  LYS  39           HE1      LYS  39  91.625  12.538   0.389
  318    HZ1  LYS  39           HZ1      LYS  39  89.087  12.831  -0.720
  319    HZ2  LYS  39           HZ2      LYS  39  90.044  14.019   0.028
  320    HZ3  LYS  39           HZ3      LYS  39  88.933  13.117   0.945
  321    H    SER  40           HN       SER  40  90.088  10.180  -5.835
  322    HA   SER  40           HA       SER  40  88.048   8.221  -6.661
  323    HG   SER  40           HG       SER  40  91.320   9.056  -8.773
  324    HB2  SER  40           HB2      SER  40  89.452   8.118  -8.754
  325    HB3  SER  40           HB1      SER  40  88.856   9.730  -8.370
  326    H    LYS  41           HN       LYS  41  91.534   8.261  -5.911
  327    HA   LYS  41           HA       LYS  41  91.690   5.338  -6.180
  328    HB2  LYS  41           HB2      LYS  41  93.558   7.567  -6.051
  329    HB3  LYS  41           HB1      LYS  41  94.045   6.279  -4.951
  330    HG2  LYS  41           HG2      LYS  41  95.053   5.769  -7.066
  331    HG3  LYS  41           HG1      LYS  41  93.695   4.658  -6.887
  332    HD2  LYS  41           HD2      LYS  41  92.289   6.243  -8.222
  333    HD3  LYS  41           HD1      LYS  41  93.726   7.230  -8.493
  334    HE2  LYS  41           HE2      LYS  41  93.142   4.446  -9.488
  335    HE3  LYS  41           HE1      LYS  41  93.650   5.862 -10.408
  336    HZ1  LYS  41           HZ1      LYS  41  95.551   4.546 -10.224
  337    HZ2  LYS  41           HZ2      LYS  41  95.264   4.180  -8.591
  338    HZ3  LYS  41           HZ3      LYS  41  95.762   5.741  -9.038
  339    HA   PRO  42           HA       PRO  42  90.589   5.119  -1.793
  340    HB2  PRO  42           HB2      PRO  42  90.090   2.456  -1.686
  341    HB3  PRO  42           HB1      PRO  42  88.961   3.598  -2.441
  342    HG2  PRO  42           HG2      PRO  42  90.915   1.759  -3.719
  343    HG3  PRO  42           HG1      PRO  42  89.280   2.205  -4.232
  344    HD2  PRO  42           HD2      PRO  42  91.609   3.291  -5.292
  345    HD3  PRO  42           HD1      PRO  42  90.013   4.068  -5.361
  346    HA   PRO  43           HA       PRO  43  94.391   3.763   0.049
  347    HB2  PRO  43           HB2      PRO  43  93.557   2.954   2.528
  348    HB3  PRO  43           HB1      PRO  43  93.634   4.658   2.039
  349    HG2  PRO  43           HG2      PRO  43  91.282   2.842   2.181
  350    HG3  PRO  43           HG1      PRO  43  91.417   4.554   2.619
  351    HD2  PRO  43           HD2      PRO  43  90.300   3.699   0.264
  352    HD3  PRO  43           HD1      PRO  43  91.104   5.274   0.443
  353    H    LYS  44           HN       LYS  44  95.532   1.908  -0.329
  354    HA   LYS  44           HA       LYS  44  95.975  -0.371  -0.689
  355    HB2  LYS  44           HB2      LYS  44  94.134  -0.505   1.716
  356    HB3  LYS  44           HB1      LYS  44  95.055  -1.880   1.105
  357    HG2  LYS  44           HG2      LYS  44  97.129  -0.377   1.320
  358    HG3  LYS  44           HG1      LYS  44  96.111   0.695   2.281
  359    HD2  LYS  44           HD2      LYS  44  96.408  -2.253   2.892
  360    HD3  LYS  44           HD1      LYS  44  97.451  -1.022   3.606
  361    HE2  LYS  44           HE2      LYS  44  94.437  -1.217   3.860
  362    HE3  LYS  44           HE1      LYS  44  95.625  -1.448   5.143
  363    HZ1  LYS  44           HZ1      LYS  44  94.880   1.047   3.751
  364    HZ2  LYS  44           HZ2      LYS  44  96.362   0.907   4.570
  365    HZ3  LYS  44           HZ3      LYS  44  94.900   0.728   5.417
  366    H    LYS  45           HN       LYS  45  95.024  -0.831  -2.679
  367    HA   LYS  45           HA       LYS  45  92.164  -1.121  -3.022
  368    HB2  LYS  45           HB2      LYS  45  94.520  -1.969  -4.730
  369    HB3  LYS  45           HB1      LYS  45  92.839  -2.157  -5.229
  370    HG2  LYS  45           HG2      LYS  45  92.480   0.260  -5.022
  371    HG3  LYS  45           HG1      LYS  45  94.138   0.473  -4.457
  372    HD2  LYS  45           HD2      LYS  45  94.413   0.940  -6.711
  373    HD3  LYS  45           HD1      LYS  45  94.716  -0.797  -6.714
  374    HE2  LYS  45           HE2      LYS  45  93.161  -0.417  -8.484
  375    HE3  LYS  45           HE1      LYS  45  92.213  -1.089  -7.157
  376    HZ1  LYS  45           HZ1      LYS  45  91.567   1.142  -6.523
  377    HZ2  LYS  45           HZ2      LYS  45  91.141   0.845  -8.140
  378    HZ3  LYS  45           HZ3      LYS  45  92.498   1.802  -7.778
  379    H    GLY  46           HN       GLY  46  90.922  -2.951  -2.797
  380    HA2  GLY  46           HA2      GLY  46  92.118  -5.264  -1.478
  381    HA3  GLY  46           HA1      GLY  46  90.413  -5.074  -1.888
  382    H    VAL  47           HN       VAL  47  93.468  -6.328  -2.934
  383    HA   VAL  47           HA       VAL  47  94.089  -7.250  -5.053
  384    HB   VAL  47           HB       VAL  47  93.196  -8.960  -3.317
  385   HG11  VAL  47          HG11      VAL  47  91.097  -9.856  -3.590
  386   HG12  VAL  47          HG12      VAL  47  91.094  -9.585  -5.333
  387   HG13  VAL  47          HG13      VAL  47  90.768  -8.247  -4.232
  388   HG21  VAL  47          HG21      VAL  47  93.309 -10.787  -5.062
  389   HG22  VAL  47          HG22      VAL  47  94.650  -9.644  -5.124
  390   HG23  VAL  47          HG23      VAL  47  93.335  -9.524  -6.293
  391    H    GLN  48           HN       GLN  48  92.497  -5.081  -5.733
  392    HA   GLN  48           HA       GLN  48  91.162  -4.276  -7.486
  393    HB2  GLN  48           HB2      GLN  48  91.495  -6.990  -8.771
  394    HB3  GLN  48           HB1      GLN  48  91.337  -5.418  -9.555
  395    HG2  GLN  48           HG2      GLN  48  93.531  -4.769  -8.457
  396    HG3  GLN  48           HG1      GLN  48  93.705  -6.459  -7.982
  397   HE21  GLN  48          HE21      GLN  48  92.489  -7.560 -10.428
  398   HE22  GLN  48          HE22      GLN  48  93.598  -7.294 -11.686
  399    H    GLY  49           HN       GLY  49  89.086  -4.910  -8.807
  400    HA2  GLY  49           HA2      GLY  49  86.971  -6.030  -8.884
  401    HA3  GLY  49           HA1      GLY  49  87.430  -6.945  -7.448
  402    H1U  RCY  50           H1U      RCY  50  79.346  -7.244  -3.259
  403    H1S  RCY  50           H1S      RCY  50  81.965  -4.780  -5.602
  404    HB1  RCY  50           HB1      RCY  50  85.403  -4.116  -3.335
  405    HB2  RCY  50           HB2      RCY  50  85.416  -5.334  -4.609
  406    HA   RCY  50           HA       RCY  50  86.198  -2.733  -5.650
  407    HN1  RCY  50           HN1      RCY  50  88.172  -4.816  -5.756
  408    H    GLY  51           HN       GLY  51  87.277  -1.179  -4.548
  409    HA2  GLY  51           HA2      GLY  51  89.438  -1.960  -2.690
  410    HA3  GLY  51           HA1      GLY  51  89.123  -0.327  -3.280
  411    H    ASP  52           HN       ASP  52  88.808   0.836  -1.415
  412    HA   ASP  52           HA       ASP  52  87.874   1.468   0.649
  413    HB2  ASP  52           HB2      ASP  52  85.901   1.641  -0.881
  414    HB3  ASP  52           HB1      ASP  52  85.476  -0.019  -0.464
  415    H    ASP  53           HN       ASP  53  89.447  -0.307   1.479
  416    HA   ASP  53           HA       ASP  53  89.846  -2.086   2.957
  417    HB2  ASP  53           HB2      ASP  53  88.222  -0.629   4.284
  418    HB3  ASP  53           HB1      ASP  53  86.950  -1.733   3.760
  419    H    ILE  54           HN       ILE  54  88.999  -4.358   3.554
  420    HA   ILE  54           HA       ILE  54  88.169  -5.665   1.084
  421    HB   ILE  54           HB       ILE  54  88.800  -6.680   3.864
  422   HG12  ILE  54          HG12      ILE  54  90.738  -7.681   2.665
  423   HG13  ILE  54          HG11      ILE  54  90.183  -6.925   1.172
  424   HG21  ILE  54          HG21      ILE  54  87.185  -8.230   3.048
  425   HG22  ILE  54          HG22      ILE  54  88.750  -8.958   2.683
  426   HG23  ILE  54          HG23      ILE  54  87.832  -8.155   1.409
  427   HD11  ILE  54          HD11      ILE  54  90.701  -4.776   1.906
  428   HD12  ILE  54          HD12      ILE  54  91.989  -5.714   2.663
  429   HD13  ILE  54          HD13      ILE  54  90.585  -5.220   3.608
  430    HA   PRO  55           HA       PRO  55  83.846  -5.350   2.336
  431    HB2  PRO  55           HB2      PRO  55  82.736  -6.446   0.108
  432    HB3  PRO  55           HB1      PRO  55  83.413  -4.806   0.126
  433    HG2  PRO  55           HG2      PRO  55  84.605  -7.323  -0.920
  434    HG3  PRO  55           HG1      PRO  55  84.666  -5.683  -1.584
  435    HD2  PRO  55           HD2      PRO  55  86.728  -6.840  -0.151
  436    HD3  PRO  55           HD1      PRO  55  86.474  -5.087  -0.286
  437    H    GLY  56           HN       GLY  56  85.384  -7.563   3.392
  438    HA2  GLY  56           HA2      GLY  56  84.751  -9.529   4.560
  439    HA3  GLY  56           HA1      GLY  56  83.210  -9.506   3.701
  440    H    MET  57           HN       MET  57  84.887  -9.168   1.128
  441    HA   MET  57           HA       MET  57  85.492 -10.665  -0.583
  442    HB2  MET  57           HB2      MET  57  87.564 -10.537   0.881
  443    HB3  MET  57           HB1      MET  57  87.029 -12.039   1.635
  444    HG2  MET  57           HG2      MET  57  86.984 -13.108  -0.621
  445    HG3  MET  57           HG1      MET  57  87.643 -11.621  -1.304
  446    HE1  MET  57           HE1      MET  57  89.330 -12.920  -2.370
  447    HE2  MET  57           HE2      MET  57  89.230 -14.517  -1.631
  448    HE3  MET  57           HE3      MET  57  90.764 -13.650  -1.637
  449    H    GLU  58           HN       GLU  58  83.081 -11.388  -0.193
  450    HA   GLU  58           HA       GLU  58  83.050 -14.281  -0.333
  451    HB2  GLU  58           HB2      GLU  58  83.135 -13.748   2.184
  452    HB3  GLU  58           HB1      GLU  58  81.503 -13.109   1.984
  453    HG2  GLU  58           HG2      GLU  58  80.737 -15.267   1.108
  454    HG3  GLU  58           HG1      GLU  58  82.373 -15.915   1.231
  455    H    GLY  59           HN       GLY  59  80.761 -11.704   0.667
  456    HA2  GLY  59           HA2      GLY  59  79.407 -11.138  -1.614
  457    HA3  GLY  59           HA1      GLY  59  78.774 -12.742  -1.241
  458    H1U  RCY  60           H1U      RCY  60  77.577  -3.674  -1.544
  459    H1S  RCY  60           H1S      RCY  60  79.572  -6.891  -0.034
  460    HB1  RCY  60           HB1      RCY  60  79.064  -9.536   3.456
  461    HB2  RCY  60           HB2      RCY  60  77.905  -8.207   3.497
  462    HA   RCY  60           HA       RCY  60  77.088 -10.247   2.256
  463    HN1  RCY  60           HN1      RCY  60  79.484  -9.742   0.595
  464    H    GLY  61           HN       GLY  61  78.251  -8.010  -0.213
  465    HA2  GLY  61           HA2      GLY  61  75.488  -7.132  -0.691
  466    HA3  GLY  61           HA1      GLY  61  76.579  -5.861  -0.136
  467    H    THR  62           HN       THR  62  77.371  -8.592  -2.264
  468    HA   THR  62           HA       THR  62  77.531  -6.768  -4.590
  469    HB   THR  62           HB       THR  62  79.912  -7.786  -4.995
  470    HG1  THR  62           HG1      THR  62  80.553  -8.967  -3.404
  471   HG21  THR  62          HG21      THR  62  79.408  -5.390  -4.567
  472   HG22  THR  62          HG22      THR  62  80.927  -5.892  -3.826
  473   HG23  THR  62          HG23      THR  62  79.481  -5.705  -2.834
  474    H    ASP  63           HN       ASP  63  75.702  -8.796  -4.272
  475    HA   ASP  63           HA       ASP  63  76.451 -11.383  -5.113
  476    HB2  ASP  63           HB2      ASP  63  74.115 -10.446  -4.401
  477    HB3  ASP  63           HB1      ASP  63  73.919 -10.092  -6.118
  478    H    ILE  64           HN       ILE  64  75.977  -8.422  -6.977
  479    HA   ILE  64           HA       ILE  64  76.634  -9.913  -9.464
  480    HB   ILE  64           HB       ILE  64  75.351  -7.234  -8.977
  481   HG12  ILE  64          HG12      ILE  64  73.949  -9.303  -8.987
  482   HG13  ILE  64          HG11      ILE  64  73.548  -8.209 -10.311
  483   HG21  ILE  64          HG21      ILE  64  76.670  -6.607 -10.769
  484   HG22  ILE  64          HG22      ILE  64  75.332  -7.353 -11.642
  485   HG23  ILE  64          HG23      ILE  64  76.821  -8.258 -11.371
  486   HD11  ILE  64          HD11      ILE  64  74.734 -10.910 -10.399
  487   HD12  ILE  64          HD12      ILE  64  75.514  -9.732 -11.455
  488   HD13  ILE  64          HD13      ILE  64  73.788 -10.055 -11.618
  489    H    THR  65           HN       THR  65  77.230  -6.529  -8.796
  490    HA   THR  65           HA       THR  65  79.864  -6.357  -8.053
  491    HB   THR  65           HB       THR  65  80.737  -6.098 -10.652
  492    HG1  THR  65           HG1      THR  65  80.004  -8.274 -11.470
  493   HG21  THR  65          HG21      THR  65  80.942  -8.183  -8.547
  494   HG22  THR  65          HG22      THR  65  82.215  -7.258  -9.344
  495   HG23  THR  65          HG23      THR  65  81.491  -8.645 -10.159
  496    H    VAL  66           HN       VAL  66  77.906  -5.402 -10.862
  497    HA   VAL  66           HA       VAL  66  78.541  -2.548 -10.296
  498    HB   VAL  66           HB       VAL  66  77.058  -3.684 -12.681
  499   HG11  VAL  66          HG11      VAL  66  77.474  -1.575 -13.685
  500   HG12  VAL  66          HG12      VAL  66  78.687  -1.149 -12.477
  501   HG13  VAL  66          HG13      VAL  66  76.980  -1.190 -12.037
  502   HG21  VAL  66          HG21      VAL  66  79.322  -3.376 -13.829
  503   HG22  VAL  66          HG22      VAL  66  79.200  -4.751 -12.732
  504   HG23  VAL  66          HG23      VAL  66  80.021  -3.280 -12.212
  505    H    ILE  67           HN       ILE  67  75.759  -4.706 -10.992
  506    HA   ILE  67           HA       ILE  67  74.115  -2.946  -9.225
  507    HB   ILE  67           HB       ILE  67  73.230  -4.055 -11.906
  508   HG12  ILE  67          HG12      ILE  67  73.709  -1.187 -11.036
  509   HG13  ILE  67          HG11      ILE  67  74.828  -2.126 -12.026
  510   HG21  ILE  67          HG21      ILE  67  71.829  -2.293  -9.872
  511   HG22  ILE  67          HG22      ILE  67  71.411  -3.961 -10.262
  512   HG23  ILE  67          HG23      ILE  67  71.199  -2.694 -11.470
  513   HD11  ILE  67          HD11      ILE  67  73.442  -0.773 -13.496
  514   HD12  ILE  67          HD12      ILE  67  71.974  -1.383 -12.732
  515   HD13  ILE  67          HD13      ILE  67  72.985  -2.465 -13.691
  516    H1U  RCY  68           H1U      RCY  68  76.683  -1.902  -2.368
  517    H1S  RCY  68           H1S      RCY  68  75.780  -3.633  -5.904
  518    HB1  RCY  68           HB1      RCY  68  74.261  -7.834  -6.133
  519    HB2  RCY  68           HB2      RCY  68  73.480  -6.466  -5.343
  520    HA   RCY  68           HA       RCY  68  73.369  -7.317  -8.164
  521    HN1  RCY  68           HN1      RCY  68  74.301  -4.611  -7.595
  522    HA   PRO  69           HA       PRO  69  68.978  -6.797  -7.793
  523    HB2  PRO  69           HB2      PRO  69  69.254  -9.059  -5.836
  524    HB3  PRO  69           HB1      PRO  69  68.111  -8.870  -7.180
  525    HG2  PRO  69           HG2      PRO  69  70.271 -10.441  -7.363
  526    HG3  PRO  69           HG1      PRO  69  69.637  -9.542  -8.751
  527    HD2  PRO  69           HD2      PRO  69  72.126  -9.086  -7.219
  528    HD3  PRO  69           HD1      PRO  69  71.698  -8.549  -8.857
  529    H    TRP  70           HN       TRP  70  70.807  -7.398  -4.788
  530    HA   TRP  70           HA       TRP  70  68.839  -6.115  -3.086
  531    HD1  TRP  70           HD1      TRP  70  69.772  -5.279  -0.060
  532    HE1  TRP  70           HE1      TRP  70  68.310  -6.646   1.562
  533    HE3  TRP  70           HE3      TRP  70  69.861  -9.815  -2.403
  534    HZ2  TRP  70           HZ2      TRP  70  67.308  -9.316   1.832
  535    HZ3  TRP  70           HZ3      TRP  70  68.648 -11.748  -1.446
  536    HH2  TRP  70           HH2      TRP  70  67.373 -11.508   0.666
  537    HB2  TRP  70           HB2      TRP  70  71.186  -7.657  -2.726
  538    HB3  TRP  70           HB1      TRP  70  71.523  -6.106  -1.964
  539    H    GLU  71           HN       GLU  71  69.661  -4.526  -5.382
  540    HA   GLU  71           HA       GLU  71  70.642  -2.128  -3.910
  541    HB2  GLU  71           HB2      GLU  71  72.373  -1.705  -5.390
  542    HB3  GLU  71           HB1      GLU  71  72.376  -3.463  -5.436
  543    HG2  GLU  71           HG2      GLU  71  72.336  -2.939  -7.714
  544    HG3  GLU  71           HG1      GLU  71  70.618  -3.138  -7.368
  545    H    ALA  72           HN       ALA  72  68.443  -3.566  -6.056
  546    HA   ALA  72           HA       ALA  72  67.738  -1.208  -7.593
  547    HB1  ALA  72           HB1      ALA  72  67.165  -3.375  -8.490
  548    HB2  ALA  72           HB2      ALA  72  65.656  -2.543  -8.114
  549    HB3  ALA  72           HB3      ALA  72  66.265  -3.797  -7.033
  550    H1U  RCY  73           H1U      RCY  73  71.843  -3.520  -1.536
  551    H1S  RCY  73           H1S      RCY  73  68.742  -1.291  -3.419
  552    HB1  RCY  73           HB1      RCY  73  66.305   1.900  -2.665
  553    HB2  RCY  73           HB2      RCY  73  67.730   1.617  -3.666
  554    HA   RCY  73           HA       RCY  73  65.352  -0.244  -3.743
  555    HN1  RCY  73           HN1      RCY  73  67.824  -0.019  -5.294
  556    H    ASN  74           HN       ASN  74  66.114   1.134  -6.686
  557    HA   ASN  74           HA       ASN  74  65.063   2.748  -8.025
  558    HB2  ASN  74           HB2      ASN  74  62.744   2.247  -6.136
  559    HB3  ASN  74           HB1      ASN  74  62.646   2.907  -7.768
  560   HD21  ASN  74          HD21      ASN  74  65.086   0.585  -7.744
  561   HD22  ASN  74          HD22      ASN  74  64.185  -0.743  -8.298
  562    H    HIS  75           HN       HIS  75  62.783   4.042  -5.949
  563    HA   HIS  75           HA       HIS  75  63.838   6.638  -5.922
  564    HD1  HIS  75           HD1      HIS  75  62.487   7.724  -2.243
  565    HD2  HIS  75           HD2      HIS  75  61.573   8.525  -6.233
  566    HE1  HIS  75           HE1      HIS  75  62.081  10.219  -2.397
  567    HE2  HIS  75           HE2      HIS  75  61.523  10.720  -4.821
  568    HB2  HIS  75           HB2      HIS  75  61.489   5.767  -5.199
  569    HB3  HIS  75           HB1      HIS  75  62.213   5.612  -3.598
  570    H1U  RCY  76           H1U      RCY  76  73.242   3.979  -1.453
  571    H1S  RCY  76           H1S      RCY  76  69.768   5.853  -2.262
  572    HB1  RCY  76           HB1      RCY  76  68.298   7.344  -2.727
  573    HB2  RCY  76           HB2      RCY  76  67.522   7.041  -4.282
  574    HA   RCY  76           HA       RCY  76  65.931   6.472  -1.819
  575    HN1  RCY  76           HN1      RCY  76  64.699   7.876  -4.029
  576    H    GLU  77           HN       GLU  77  66.543   7.951  -0.233
  577    HA   GLU  77           HA       GLU  77  65.510  10.567  -0.277
  578    HB2  GLU  77           HB2      GLU  77  67.015  11.004   1.660
  579    HB3  GLU  77           HB1      GLU  77  66.166   9.465   1.809
  580    HG2  GLU  77           HG2      GLU  77  68.162   8.301   0.891
  581    HG3  GLU  77           HG1      GLU  77  69.012   9.845   0.831
  582    H    LEU  78           HN       LEU  78  66.906  12.619  -0.100
  583    HA   LEU  78           HA       LEU  78  68.356  14.130  -1.148
  584    HG   LEU  78           HG       LEU  78  70.482  14.650  -0.632
  585    HB2  LEU  78           HB2      LEU  78  69.912  11.675  -0.730
  586    HB3  LEU  78           HB1      LEU  78  70.487  12.601  -2.114
  587   HD11  LEU  78          HD11      LEU  78  68.885  13.523   1.036
  588   HD12  LEU  78          HD12      LEU  78  70.237  14.422   1.724
  589   HD13  LEU  78          HD13      LEU  78  70.302  12.662   1.637
  590   HD21  LEU  78          HD21      LEU  78  72.214  12.337   0.297
  591   HD22  LEU  78          HD22      LEU  78  72.579  14.051   0.493
  592   HD23  LEU  78          HD23      LEU  78  72.540  13.337  -1.119
  593    H    HIS  79           HN       HIS  79  68.452  14.989  -3.209
  594    HA   HIS  79           HA       HIS  79  68.353  13.199  -5.550
  595    HD1  HIS  79           HD1      HIS  79  65.987  11.971  -6.943
  596    HD2  HIS  79           HD2      HIS  79  65.176  13.001  -2.983
  597    HE1  HIS  79           HE1      HIS  79  64.792   9.987  -5.918
  598    HE2  HIS  79           HE2      HIS  79  64.292  10.601  -3.507
  599    HB2  HIS  79           HB2      HIS  79  66.083  15.031  -4.756
  600    HB3  HIS  79           HB1      HIS  79  66.321  14.504  -6.422
  601    H    GLU  80           HN       GLU  80  70.499  14.453  -5.490
  602    HA   GLU  80           HA       GLU  80  70.146  16.987  -7.040
  603    HB2  GLU  80           HB2      GLU  80  72.299  16.515  -4.955
  604    HB3  GLU  80           HB1      GLU  80  71.996  18.005  -5.849
  605    HG2  GLU  80           HG2      GLU  80  69.688  18.047  -4.816
  606    HG3  GLU  80           HG1      GLU  80  70.197  16.709  -3.785
  607    H    LEU  81           HN       LEU  81  72.481  14.453  -6.083
  608    HA   LEU  81           HA       LEU  81  73.841  14.799  -8.707
  609    HG   LEU  81           HG       LEU  81  74.041  14.774  -5.350
  610    HB2  LEU  81           HB2      LEU  81  75.283  12.874  -7.362
  611    HB3  LEU  81           HB1      LEU  81  75.630  14.600  -7.313
  612   HD11  LEU  81          HD11      LEU  81  72.706  12.818  -5.567
  613   HD12  LEU  81          HD12      LEU  81  73.722  12.517  -4.157
  614   HD13  LEU  81          HD13      LEU  81  74.121  11.774  -5.706
  615   HD21  LEU  81          HD21      LEU  81  76.394  12.889  -4.995
  616   HD22  LEU  81          HD22      LEU  81  75.667  13.893  -3.740
  617   HD23  LEU  81          HD23      LEU  81  76.516  14.645  -5.091
  618    H    ALA  82           HN       ALA  82  71.763  12.624  -6.957
  619    HA   ALA  82           HA       ALA  82  72.297  10.262  -8.526
  620    HB1  ALA  82           HB1      ALA  82  71.143  10.227  -6.313
  621    HB2  ALA  82           HB2      ALA  82  70.223   9.399  -7.569
  622    HB3  ALA  82           HB3      ALA  82  69.755  11.021  -7.057
  623    H    GLN  83           HN       GLN  83  69.220  12.072  -8.533
  624    HA   GLN  83           HA       GLN  83  67.730  12.490 -10.299
  625    HB2  GLN  83           HB2      GLN  83  70.392  12.906 -11.691
  626    HB3  GLN  83           HB1      GLN  83  68.833  13.337 -12.395
  627    HG2  GLN  83           HG2      GLN  83  68.412  14.723 -10.296
  628    HG3  GLN  83           HG1      GLN  83  70.114  14.475  -9.902
  629   HE21  GLN  83          HE21      GLN  83  68.656  14.998 -13.144
  630   HE22  GLN  83          HE22      GLN  83  69.520  16.422 -13.471
  631    H    TYR  84           HN       TYR  84  69.363   9.737 -10.064
  632    HA   TYR  84           HA       TYR  84  69.275   7.667 -11.153
  633    HD1  TYR  84           HD1      TYR  84  67.611   5.530 -11.188
  634    HD2  TYR  84           HD2      TYR  84  66.766   8.028 -14.578
  635    HE1  TYR  84           HE1      TYR  84  67.408   3.516 -12.621
  636    HE2  TYR  84           HE2      TYR  84  66.564   6.015 -16.012
  637    HH   TYR  84           HH       TYR  84  66.314   3.743 -15.963
  638    HB2  TYR  84           HB2      TYR  84  66.862   7.942 -10.961
  639    HB3  TYR  84           HB1      TYR  84  66.830   8.966 -12.397
  640    H    GLY  85           HN       GLY  85  70.697   7.061 -12.692
  641    HA2  GLY  85           HA2      GLY  85  71.013   6.888 -15.198
  642    HA3  GLY  85           HA1      GLY  85  70.778   8.636 -15.239
  643    H    ILE  86           HN       ILE  86  72.336   8.825 -12.629
  644    HA   ILE  86           HA       ILE  86  75.008   7.879 -13.142
  645    HB   ILE  86           HB       ILE  86  74.877   9.563 -14.951
  646   HG12  ILE  86          HG12      ILE  86  76.608  10.611 -12.699
  647   HG13  ILE  86          HG11      ILE  86  76.993   9.136 -13.586
  648   HG21  ILE  86          HG21      ILE  86  74.575  11.630 -12.765
  649   HG22  ILE  86          HG22      ILE  86  73.190  10.985 -13.647
  650   HG23  ILE  86          HG23      ILE  86  74.451  11.867 -14.508
  651   HD11  ILE  86          HD11      ILE  86  78.114  11.224 -14.479
  652   HD12  ILE  86          HD12      ILE  86  76.512  11.805 -14.934
  653   HD13  ILE  86          HD13      ILE  86  77.159  10.337 -15.666
  654    H1U  RCY  87           H1U      RCY  87  78.386   3.757  -5.758
  655    H1S  RCY  87           H1S      RCY  87  78.554   7.311  -7.668
  656    HB1  RCY  87           HB1      RCY  87  78.128   9.222  -9.570
  657    HB2  RCY  87           HB2      RCY  87  77.209   7.779  -9.144
  658    HA   RCY  87           HA       RCY  87  75.156   9.192  -8.964
  659    HN1  RCY  87           HN1      RCY  87  76.520   8.679 -11.485
  Start of MODEL   12
    1    HA   MET   1           HA       MET   1  66.483   7.332  18.256
    2    HB2  MET   1           HB2      MET   1  64.286   6.607  19.558
    3    HB3  MET   1           HB1      MET   1  65.813   6.796  20.418
    4    HG2  MET   1           HG2      MET   1  63.912   7.941  21.567
    5    HG3  MET   1           HG1      MET   1  65.199   9.054  21.103
    6    HE1  MET   1           HE1      MET   1  61.885   7.388  19.900
    7    HE2  MET   1           HE2      MET   1  60.902   8.836  19.699
    8    HE3  MET   1           HE3      MET   1  61.612   8.471  21.270
    9    H    ASN   2           HN       ASN   2  65.904   8.986  16.289
   10    HA   ASN   2           HA       ASN   2  63.162   9.410  15.634
   11    HB2  ASN   2           HB2      ASN   2  65.092  10.487  14.463
   12    HB3  ASN   2           HB1      ASN   2  65.462   8.934  13.714
   13   HD21  ASN   2          HD21      ASN   2  64.332   8.418  11.812
   14   HD22  ASN   2          HD22      ASN   2  62.999   9.290  11.224
   15    H    LEU   3           HN       LEU   3  61.744   8.170  14.299
   16    HA   LEU   3           HA       LEU   3  60.837   6.212  13.379
   17    HG   LEU   3           HG       LEU   3  62.760   4.071  11.245
   18    HB2  LEU   3           HB2      LEU   3  63.353   6.194  12.429
   19    HB3  LEU   3           HB1      LEU   3  63.463   4.781  13.474
   20   HD11  LEU   3          HD11      LEU   3  61.720   3.074  13.368
   21   HD12  LEU   3          HD12      LEU   3  60.839   2.805  11.864
   22   HD13  LEU   3          HD13      LEU   3  60.295   4.043  12.995
   23   HD21  LEU   3          HD21      LEU   3  61.552   6.510  11.069
   24   HD22  LEU   3          HD22      LEU   3  60.156   5.478  11.384
   25   HD23  LEU   3          HD23      LEU   3  61.191   5.161   9.991
   26    H    GLU   4           HN       GLU   4  59.584   5.216  14.886
   27    HA   GLU   4           HA       GLU   4  60.271   4.512  17.494
   28    HB2  GLU   4           HB2      GLU   4  58.357   2.949  15.739
   29    HB3  GLU   4           HB1      GLU   4  58.324   3.064  17.499
   30    HG2  GLU   4           HG2      GLU   4  57.948   5.385  15.582
   31    HG3  GLU   4           HG1      GLU   4  56.659   4.579  16.478
   32    HA   PRO   5           HA       PRO   5  63.174   1.178  17.535
   33    HB2  PRO   5           HB2      PRO   5  61.065  -0.274  19.102
   34    HB3  PRO   5           HB1      PRO   5  62.796  -0.093  19.448
   35    HG2  PRO   5           HG2      PRO   5  60.928   1.366  20.699
   36    HG3  PRO   5           HG1      PRO   5  62.540   1.999  20.333
   37    HD2  PRO   5           HD2      PRO   5  59.942   2.732  19.136
   38    HD3  PRO   5           HD1      PRO   5  61.477   3.627  19.128
   39    HA   PRO   6           HA       PRO   6  61.767  -1.632  14.381
   40    HB2  PRO   6           HB2      PRO   6  63.576  -3.649  14.617
   41    HB3  PRO   6           HB1      PRO   6  64.016  -2.045  13.998
   42    HG2  PRO   6           HG2      PRO   6  64.439  -3.198  16.710
   43    HG3  PRO   6           HG1      PRO   6  65.517  -2.189  15.731
   44    HD2  PRO   6           HD2      PRO   6  63.983  -1.208  17.797
   45    HD3  PRO   6           HD1      PRO   6  64.517  -0.224  16.417
   46    H    LYS   7           HN       LYS   7  60.386  -3.413  14.144
   47    HA   LYS   7           HA       LYS   7  59.636  -4.823  16.663
   48    HB2  LYS   7           HB2      LYS   7  58.176  -4.625  14.010
   49    HB3  LYS   7           HB1      LYS   7  57.559  -5.404  15.467
   50    HG2  LYS   7           HG2      LYS   7  57.544  -3.308  16.666
   51    HG3  LYS   7           HG1      LYS   7  58.379  -2.491  15.344
   52    HD2  LYS   7           HD2      LYS   7  55.790  -3.879  14.758
   53    HD3  LYS   7           HD1      LYS   7  55.744  -2.318  15.579
   54    HE2  LYS   7           HE2      LYS   7  57.150  -1.353  13.766
   55    HE3  LYS   7           HE1      LYS   7  57.097  -2.905  12.929
   56    HZ1  LYS   7           HZ1      LYS   7  54.665  -1.399  13.706
   57    HZ2  LYS   7           HZ2      LYS   7  54.772  -2.732  12.658
   58    HZ3  LYS   7           HZ3      LYS   7  55.413  -1.229  12.192
   59    H    ALA   8           HN       ALA   8  58.315  -6.925  14.941
   60    HA   ALA   8           HA       ALA   8  60.404  -8.869  15.015
   61    HB1  ALA   8           HB1      ALA   8  58.830 -10.284  13.699
   62    HB2  ALA   8           HB2      ALA   8  57.800  -8.873  13.457
   63    HB3  ALA   8           HB3      ALA   8  58.044  -9.519  15.081
   64    H    GLU   9           HN       GLU   9  62.224  -8.344  13.807
   65    HA   GLU   9           HA       GLU   9  61.919  -8.496  10.874
   66    HB2  GLU   9           HB2      GLU   9  61.774  -6.046  11.543
   67    HB3  GLU   9           HB1      GLU   9  63.434  -6.190  12.123
   68    HG2  GLU   9           HG2      GLU   9  63.589  -5.371   9.881
   69    HG3  GLU   9           HG1      GLU   9  64.030  -7.077   9.807
   70    H1U  RCY  10           H1U      RCY  10  61.226 -17.003  12.801
   71    H1S  RCY  10           H1S      RCY  10  64.667 -14.240  11.643
   72    HB1  RCY  10           HB1      RCY  10  65.539 -11.077  12.705
   73    HB2  RCY  10           HB2      RCY  10  66.241 -12.064  11.423
   74    HA   RCY  10           HA       RCY  10  66.331  -9.466  11.188
   75    HN1  RCY  10           HN1      RCY  10  63.729  -9.428   9.921
   76    H    ARG  11           HN       ARG  11  65.390 -12.417   9.672
   77    HA   ARG  11           HA       ARG  11  65.713 -11.599   6.926
   78    HE   ARG  11           HE       ARG  11  69.890 -10.613   6.659
   79    HB2  ARG  11           HB2      ARG  11  68.073 -11.349   7.960
   80    HB3  ARG  11           HB1      ARG  11  68.087 -13.111   8.022
   81    HG2  ARG  11           HG2      ARG  11  69.014 -12.776   5.923
   82    HG3  ARG  11           HG1      ARG  11  67.306 -12.868   5.493
   83    HD2  ARG  11           HD2      ARG  11  68.098 -10.919   4.393
   84    HD3  ARG  11           HD1      ARG  11  67.260 -10.317   5.823
   85   HH11  ARG  11          HH21      ARG  11  68.231  -9.037   4.080
   86   HH12  ARG  11          HH22      ARG  11  69.382  -7.750   3.949
   87   HH21  ARG  11          HH11      ARG  11  71.402  -8.941   6.503
   88   HH22  ARG  11          HH12      ARG  11  71.178  -7.695   5.321
   89    H    SER  12           HN       SER  12  63.879 -13.013   6.771
   90    HA   SER  12           HA       SER  12  64.532 -15.751   6.158
   91    HG   SER  12           HG       SER  12  61.745 -16.157   8.541
   92    HB2  SER  12           HB2      SER  12  63.597 -16.924   7.957
   93    HB3  SER  12           HB1      SER  12  64.418 -15.596   8.772
   94    H    ALA  13           HN       ALA  13  62.302 -13.143   6.542
   95    HA   ALA  13           HA       ALA  13  60.636 -14.209   4.389
   96    HB1  ALA  13           HB1      ALA  13  58.523 -14.064   5.743
   97    HB2  ALA  13           HB2      ALA  13  59.517 -13.885   7.189
   98    HB3  ALA  13           HB3      ALA  13  59.592 -15.373   6.246
   99    H    THR  14           HN       THR  14  59.318 -12.068   6.822
  100    HA   THR  14           HA       THR  14  58.676  -9.816   6.651
  101    HB   THR  14           HB       THR  14  61.239  -9.425   5.099
  102    HG1  THR  14           HG1      THR  14  61.081  -9.492   7.909
  103   HG21  THR  14          HG21      THR  14  61.249  -7.275   6.142
  104   HG22  THR  14          HG22      THR  14  59.992  -7.748   7.285
  105   HG23  THR  14          HG23      THR  14  59.597  -7.532   5.579
  106    H    ARG  15           HN       ARG  15  57.451 -11.360   4.732
  107    HA   ARG  15           HA       ARG  15  56.395 -11.239   2.641
  108    HE   ARG  15           HE       ARG  15  53.573  -9.130   2.982
  109    HB2  ARG  15           HB2      ARG  15  55.717  -9.035   3.602
  110    HB3  ARG  15           HB1      ARG  15  57.141  -8.307   2.861
  111    HG2  ARG  15           HG2      ARG  15  56.343  -8.687   0.670
  112    HG3  ARG  15           HG1      ARG  15  55.159  -9.875   1.215
  113    HD2  ARG  15           HD2      ARG  15  55.043  -6.981   2.080
  114    HD3  ARG  15           HD1      ARG  15  54.243  -7.557   0.617
  115   HH11  ARG  15          HH21      ARG  15  52.927  -6.330   1.077
  116   HH12  ARG  15          HH22      ARG  15  51.282  -6.190   1.600
  117   HH21  ARG  15          HH11      ARG  15  51.428  -8.964   3.677
  118   HH22  ARG  15          HH12      ARG  15  50.433  -7.682   3.072
  119    H    VAL  16           HN       VAL  16  56.800 -10.640   0.284
  120    HA   VAL  16           HA       VAL  16  59.742 -10.527  -0.284
  121    HB   VAL  16           HB       VAL  16  59.228 -12.000  -2.259
  122   HG11  VAL  16          HG11      VAL  16  59.016 -14.072  -0.915
  123   HG12  VAL  16          HG12      VAL  16  58.532 -13.107   0.479
  124   HG13  VAL  16          HG13      VAL  16  60.157 -12.943  -0.185
  125   HG21  VAL  16          HG21      VAL  16  56.806 -11.478  -2.373
  126   HG22  VAL  16          HG22      VAL  16  56.565 -12.302  -0.832
  127   HG23  VAL  16          HG23      VAL  16  57.086 -13.215  -2.249
  128    H    MET  17           HN       MET  17  60.276  -9.532  -2.365
  129    HA   MET  17           HA       MET  17  58.152  -8.166  -3.852
  130    HB2  MET  17           HB2      MET  17  59.269  -5.897  -3.458
  131    HB3  MET  17           HB1      MET  17  58.328  -6.541  -2.112
  132    HG2  MET  17           HG2      MET  17  61.286  -7.085  -2.346
  133    HG3  MET  17           HG1      MET  17  60.687  -5.611  -1.586
  134    HE1  MET  17           HE1      MET  17  61.904  -8.294   1.135
  135    HE2  MET  17           HE2      MET  17  62.158  -6.636   0.594
  136    HE3  MET  17           HE3      MET  17  62.481  -7.974  -0.506
  137    H    GLY  18           HN       GLY  18  60.634  -9.988  -4.116
  138    HA2  GLY  18           HA2      GLY  18  62.409  -8.406  -5.836
  139    HA3  GLY  18           HA1      GLY  18  62.555 -10.133  -5.508
  140    H    GLY  19           HN       GLY  19  59.385  -9.607  -6.293
  141    HA2  GLY  19           HA2      GLY  19  59.783 -10.734  -8.979
  142    HA3  GLY  19           HA1      GLY  19  58.231 -10.500  -8.174
  143    HA   PRO  20           HA       PRO  20  57.101  -6.697 -10.067
  144    HB2  PRO  20           HB2      PRO  20  58.109  -5.174  -7.685
  145    HB3  PRO  20           HB1      PRO  20  56.559  -5.032  -8.538
  146    HG2  PRO  20           HG2      PRO  20  56.774  -6.323  -6.210
  147    HG3  PRO  20           HG1      PRO  20  55.654  -6.850  -7.476
  148    HD2  PRO  20           HD2      PRO  20  58.169  -8.122  -6.561
  149    HD3  PRO  20           HD1      PRO  20  56.783  -8.844  -7.407
  150    H1U  RCY  21           H1U      RCY  21  57.637  -3.054  -4.498
  151    H1S  RCY  21           H1S      RCY  21  59.890  -3.991  -8.203
  152    HB1  RCY  21           HB1      RCY  21  63.526  -5.337  -9.312
  153    HB2  RCY  21           HB2      RCY  21  62.623  -6.510  -8.354
  154    HA   RCY  21           HA       RCY  21  61.307  -4.690 -10.383
  155    HN1  RCY  21           HN1      RCY  21  60.319  -6.939  -8.728
  156    H    THR  22           HN       THR  22  62.264  -5.011 -12.343
  157    HA   THR  22           HA       THR  22  63.346  -7.698 -13.002
  158    HB   THR  22           HB       THR  22  62.182  -7.415 -15.301
  159    HG1  THR  22           HG1      THR  22  61.381  -5.389 -15.142
  160   HG21  THR  22          HG21      THR  22  61.579  -9.123 -13.600
  161   HG22  THR  22          HG22      THR  22  60.169  -8.541 -14.484
  162   HG23  THR  22          HG23      THR  22  60.485  -7.961 -12.849
  163    HA   PRO  23           HA       PRO  23  66.831  -5.680 -14.806
  164    HB2  PRO  23           HB2      PRO  23  65.960  -7.005 -17.358
  165    HB3  PRO  23           HB1      PRO  23  67.575  -6.928 -16.627
  166    HG2  PRO  23           HG2      PRO  23  66.017  -9.104 -16.435
  167    HG3  PRO  23           HG1      PRO  23  67.133  -8.617 -15.150
  168    HD2  PRO  23           HD2      PRO  23  64.185  -8.554 -15.164
  169    HD3  PRO  23           HD1      PRO  23  65.304  -8.479 -13.786
  170    H    ARG  24           HN       ARG  24  65.796  -3.543 -14.676
  171    HA   ARG  24           HA       ARG  24  64.633  -2.600 -17.272
  172    HE   ARG  24           HE       ARG  24  61.066   1.616 -16.392
  173    HB2  ARG  24           HB2      ARG  24  63.270  -2.439 -15.081
  174    HB3  ARG  24           HB1      ARG  24  64.399  -1.164 -14.624
  175    HG2  ARG  24           HG2      ARG  24  63.828   0.116 -16.621
  176    HG3  ARG  24           HG1      ARG  24  62.780  -1.185 -17.189
  177    HD2  ARG  24           HD2      ARG  24  61.468  -0.910 -15.025
  178    HD3  ARG  24           HD1      ARG  24  62.392   0.567 -14.752
  179   HH11  ARG  24          HH21      ARG  24  60.959  -1.820 -16.649
  180   HH12  ARG  24          HH22      ARG  24  59.748  -1.823 -17.888
  181   HH21  ARG  24          HH11      ARG  24  59.486   1.632 -18.008
  182   HH22  ARG  24          HH12      ARG  24  58.914   0.132 -18.657
  183    H    LYS  25           HN       LYS  25  67.393  -2.820 -17.160
  184    HA   LYS  25           HA       LYS  25  68.469  -0.165 -16.413
  185    HB2  LYS  25           HB2      LYS  25  70.639  -1.213 -17.274
  186    HB3  LYS  25           HB1      LYS  25  69.927  -1.968 -15.848
  187    HG2  LYS  25           HG2      LYS  25  69.039  -3.007 -18.494
  188    HG3  LYS  25           HG1      LYS  25  70.687  -3.397 -18.001
  189    HD2  LYS  25           HD2      LYS  25  68.464  -3.751 -16.021
  190    HD3  LYS  25           HD1      LYS  25  68.682  -4.964 -17.284
  191    HE2  LYS  25           HE2      LYS  25  70.938  -5.406 -16.585
  192    HE3  LYS  25           HE1      LYS  25  70.936  -4.017 -15.499
  193    HZ1  LYS  25           HZ1      LYS  25  68.866  -5.301 -14.529
  194    HZ2  LYS  25           HZ2      LYS  25  70.450  -5.646 -14.022
  195    HZ3  LYS  25           HZ3      LYS  25  69.689  -6.638 -15.172
  196    H    GLY  26           HN       GLY  26  70.254   0.484 -18.282
  197    HA2  GLY  26           HA2      GLY  26  69.591   0.092 -21.009
  198    HA3  GLY  26           HA1      GLY  26  68.702   1.509 -20.449
  199    HA   PRO  27           HA       PRO  27  73.095   2.564 -22.018
  200    HB2  PRO  27           HB2      PRO  27  71.385   4.810 -23.023
  201    HB3  PRO  27           HB1      PRO  27  72.735   3.979 -23.821
  202    HG2  PRO  27           HG2      PRO  27  70.201   3.489 -24.485
  203    HG3  PRO  27           HG1      PRO  27  71.432   2.215 -24.489
  204    HD2  PRO  27           HD2      PRO  27  69.194   2.657 -22.576
  205    HD3  PRO  27           HD1      PRO  27  70.016   1.147 -23.023
  206    HA   PRO  28           HA       PRO  28  74.243   5.299 -18.735
  207    HB2  PRO  28           HB2      PRO  28  74.948   7.280 -20.879
  208    HB3  PRO  28           HB1      PRO  28  75.893   6.769 -19.466
  209    HG2  PRO  28           HG2      PRO  28  76.390   5.833 -21.926
  210    HG3  PRO  28           HG1      PRO  28  76.613   4.844 -20.475
  211    HD2  PRO  28           HD2      PRO  28  74.562   4.605 -22.589
  212    HD3  PRO  28           HD1      PRO  28  75.099   3.399 -21.400
  213    H    LYS  29           HN       LYS  29  73.241   6.937 -17.526
  214    HA   LYS  29           HA       LYS  29  71.486   8.888 -18.863
  215    HB2  LYS  29           HB2      LYS  29  69.537   8.204 -17.392
  216    HB3  LYS  29           HB1      LYS  29  69.934   7.056 -18.671
  217    HG2  LYS  29           HG2      LYS  29  71.124   5.635 -17.121
  218    HG3  LYS  29           HG1      LYS  29  70.977   6.833 -15.835
  219    HD2  LYS  29           HD2      LYS  29  69.276   5.204 -15.416
  220    HD3  LYS  29           HD1      LYS  29  68.450   6.610 -16.089
  221    HE2  LYS  29           HE2      LYS  29  68.202   5.590 -18.213
  222    HE3  LYS  29           HE1      LYS  29  69.406   4.352 -17.851
  223    HZ1  LYS  29           HZ1      LYS  29  66.602   4.458 -17.163
  224    HZ2  LYS  29           HZ2      LYS  29  67.618   3.977 -15.889
  225    HZ3  LYS  29           HZ3      LYS  29  67.624   3.117 -17.354
  226    H1U  RCY  30           H1U      RCY  30  68.795  13.001 -12.456
  227    H1S  RCY  30           H1S      RCY  30  71.615   9.821 -13.525
  228    HB1  RCY  30           HB1      RCY  30  74.948   9.052 -14.390
  229    HB2  RCY  30           HB2      RCY  30  73.264   8.534 -14.340
  230    HA   RCY  30           HA       RCY  30  72.798  10.977 -15.221
  231    HN1  RCY  30           HN1      RCY  30  73.844   9.260 -17.360
  232    H    LYS  31           HN       LYS  31  74.705  12.217 -14.201
  233    HA   LYS  31           HA       LYS  31  76.502  13.025 -16.394
  234    HB2  LYS  31           HB2      LYS  31  77.085  14.433 -13.962
  235    HB3  LYS  31           HB1      LYS  31  76.299  15.049 -15.413
  236    HG2  LYS  31           HG2      LYS  31  74.129  14.163 -14.599
  237    HG3  LYS  31           HG1      LYS  31  74.925  13.605 -13.127
  238    HD2  LYS  31           HD2      LYS  31  74.268  15.650 -12.338
  239    HD3  LYS  31           HD1      LYS  31  75.746  16.184 -13.140
  240    HE2  LYS  31           HE2      LYS  31  72.905  16.354 -14.148
  241    HE3  LYS  31           HE1      LYS  31  74.077  17.658 -13.951
  242    HZ1  LYS  31           HZ1      LYS  31  75.311  16.916 -15.774
  243    HZ2  LYS  31           HZ2      LYS  31  73.695  16.801 -16.285
  244    HZ3  LYS  31           HZ3      LYS  31  74.540  15.405 -15.811
  245    H    GLN  32           HN       GLN  32  76.595  10.865 -13.788
  246    HA   GLN  32           HA       GLN  32  79.425  10.330 -14.250
  247    HB2  GLN  32           HB2      GLN  32  78.624  12.068 -12.066
  248    HB3  GLN  32           HB1      GLN  32  79.375  10.605 -11.434
  249    HG2  GLN  32           HG2      GLN  32  80.580  12.319 -13.626
  250    HG3  GLN  32           HG1      GLN  32  81.021  12.438 -11.922
  251   HE21  GLN  32          HE21      GLN  32  80.890   9.587 -11.328
  252   HE22  GLN  32          HE22      GLN  32  82.180   8.842 -12.141
  253    H    ARG  33           HN       ARG  33  79.841   8.190 -13.801
  254    HA   ARG  33           HA       ARG  33  78.281   6.707 -11.831
  255    HE   ARG  33           HE       ARG  33  75.341   4.148 -10.523
  256    HB2  ARG  33           HB2      ARG  33  76.841   6.858 -13.965
  257    HB3  ARG  33           HB1      ARG  33  78.046   5.807 -14.708
  258    HG2  ARG  33           HG2      ARG  33  76.594   4.203 -13.888
  259    HG3  ARG  33           HG1      ARG  33  77.652   4.383 -12.489
  260    HD2  ARG  33           HD2      ARG  33  76.058   6.114 -11.596
  261    HD3  ARG  33           HD1      ARG  33  74.965   5.715 -12.921
  262   HH11  ARG  33          HH21      ARG  33  74.787   4.025 -13.923
  263   HH12  ARG  33          HH22      ARG  33  73.959   2.504 -13.868
  264   HH21  ARG  33          HH11      ARG  33  74.264   2.163 -10.431
  265   HH22  ARG  33          HH12      ARG  33  73.663   1.450 -11.891
  266    H    GLN  34           HN       GLN  34  80.910   7.116 -13.965
  267    HA   GLN  34           HA       GLN  34  82.217   4.707 -12.806
  268    HB2  GLN  34           HB2      GLN  34  81.243   4.325 -15.195
  269    HB3  GLN  34           HB1      GLN  34  82.570   5.355 -15.732
  270    HG2  GLN  34           HG2      GLN  34  83.401   3.118 -15.850
  271    HG3  GLN  34           HG1      GLN  34  84.119   3.818 -14.398
  272   HE21  GLN  34          HE21      GLN  34  83.922   2.525 -12.569
  273   HE22  GLN  34          HE22      GLN  34  82.714   1.359 -12.322
  274    H    THR  35           HN       THR  35  84.313   5.473 -15.043
  275    HA   THR  35           HA       THR  35  86.365   6.621 -14.934
  276    HB   THR  35           HB       THR  35  86.141   9.030 -14.905
  277    HG1  THR  35           HG1      THR  35  84.902   9.401 -13.145
  278   HG21  THR  35          HG21      THR  35  84.238   9.331 -16.483
  279   HG22  THR  35          HG22      THR  35  83.681   7.707 -16.082
  280   HG23  THR  35          HG23      THR  35  85.233   7.933 -16.889
  281    H    ARG  36           HN       ARG  36  85.282   5.371 -12.403
  282    HA   ARG  36           HA       ARG  36  86.878   7.008 -10.465
  283    HE   ARG  36           HE       ARG  36  82.342   7.034  -8.793
  284    HB2  ARG  36           HB2      ARG  36  85.370   6.375  -8.706
  285    HB3  ARG  36           HB1      ARG  36  84.374   6.957 -10.040
  286    HG2  ARG  36           HG2      ARG  36  84.354   4.439 -10.774
  287    HG3  ARG  36           HG1      ARG  36  84.802   4.135  -9.095
  288    HD2  ARG  36           HD2      ARG  36  82.247   5.161 -10.217
  289    HD3  ARG  36           HD1      ARG  36  82.528   4.141  -8.806
  290   HH11  ARG  36          HH21      ARG  36  83.830   4.265  -7.380
  291   HH12  ARG  36          HH22      ARG  36  84.106   5.028  -5.850
  292   HH21  ARG  36          HH11      ARG  36  82.692   8.048  -6.803
  293   HH22  ARG  36          HH12      ARG  36  83.461   7.170  -5.523
  294    H    GLN  37           HN       GLN  37  86.462   4.016 -12.047
  295    HA   GLN  37           HA       GLN  37  87.494   1.923 -11.773
  296    HB2  GLN  37           HB2      GLN  37  89.587   3.683 -10.458
  297    HB3  GLN  37           HB1      GLN  37  89.850   2.041 -11.047
  298    HG2  GLN  37           HG2      GLN  37  89.399   2.710 -13.323
  299    HG3  GLN  37           HG1      GLN  37  88.887   4.315 -12.801
  300   HE21  GLN  37          HE21      GLN  37  90.913   4.348 -14.634
  301   HE22  GLN  37          HE22      GLN  37  92.405   4.691 -13.901
  302    H1U  RCY  38           H1U      RCY  38  79.946  -3.689  -5.363
  303    H1S  RCY  38           H1S      RCY  38  83.259  -1.186  -7.719
  304    HB1  RCY  38           HB1      RCY  38  84.095   0.317  -8.655
  305    HB2  RCY  38           HB2      RCY  38  84.279   1.935  -7.978
  306    HA   RCY  38           HA       RCY  38  86.620   1.397  -7.364
  307    HN1  RCY  38           HN1      RCY  38  85.850   1.220 -10.232
  308    H    LYS  39           HN       LYS  39  88.329  -0.203  -8.863
  309    HA   LYS  39           HA       LYS  39  87.562  -2.954  -9.010
  310    HB2  LYS  39           HB2      LYS  39  90.006  -3.403  -9.073
  311    HB3  LYS  39           HB1      LYS  39  89.545  -2.104 -10.172
  312    HG2  LYS  39           HG2      LYS  39  90.083  -0.517  -8.194
  313    HG3  LYS  39           HG1      LYS  39  90.936  -1.899  -7.504
  314    HD2  LYS  39           HD2      LYS  39  91.459  -0.640 -10.214
  315    HD3  LYS  39           HD1      LYS  39  92.504  -0.538  -8.796
  316    HE2  LYS  39           HE2      LYS  39  92.576  -3.096  -8.845
  317    HE3  LYS  39           HE1      LYS  39  91.849  -2.985 -10.448
  318    HZ1  LYS  39           HZ1      LYS  39  94.315  -1.523  -9.701
  319    HZ2  LYS  39           HZ2      LYS  39  93.685  -1.785 -11.258
  320    HZ3  LYS  39           HZ3      LYS  39  94.343  -3.080 -10.376
  321    H    SER  40           HN       SER  40  90.054  -3.752  -7.362
  322    HA   SER  40           HA       SER  40  88.594  -4.463  -4.969
  323    HG   SER  40           HG       SER  40  89.409  -5.999  -6.439
  324    HB2  SER  40           HB2      SER  40  91.536  -4.671  -5.661
  325    HB3  SER  40           HB1      SER  40  90.809  -5.358  -4.211
  326    H    LYS  41           HN       LYS  41  88.578  -1.647  -5.236
  327    HA   LYS  41           HA       LYS  41  90.496  -0.115  -3.967
  328    HB2  LYS  41           HB2      LYS  41  87.565   0.004  -4.219
  329    HB3  LYS  41           HB1      LYS  41  88.180   0.858  -2.805
  330    HG2  LYS  41           HG2      LYS  41  89.797   2.059  -4.271
  331    HG3  LYS  41           HG1      LYS  41  89.086   1.258  -5.673
  332    HD2  LYS  41           HD2      LYS  41  86.956   2.317  -5.294
  333    HD3  LYS  41           HD1      LYS  41  87.486   2.946  -3.733
  334    HE2  LYS  41           HE2      LYS  41  88.928   3.662  -6.285
  335    HE3  LYS  41           HE1      LYS  41  87.523   4.576  -5.736
  336    HZ1  LYS  41           HZ1      LYS  41  88.610   5.198  -3.777
  337    HZ2  LYS  41           HZ2      LYS  41  89.779   5.397  -4.994
  338    HZ3  LYS  41           HZ3      LYS  41  89.836   4.041  -3.972
  339    HA   PRO  42           HA       PRO  42  90.454  -2.399  -0.034
  340    HB2  PRO  42           HB2      PRO  42  92.956  -1.691   0.780
  341    HB3  PRO  42           HB1      PRO  42  92.660  -2.964  -0.418
  342    HG2  PRO  42           HG2      PRO  42  93.593  -0.181  -0.810
  343    HG3  PRO  42           HG1      PRO  42  93.990  -1.647  -1.718
  344    HD2  PRO  42           HD2      PRO  42  92.161   0.317  -2.528
  345    HD3  PRO  42           HD1      PRO  42  92.265  -1.330  -3.186
  346    HA   PRO  43           HA       PRO  43  89.405   0.865   2.774
  347    HB2  PRO  43           HB2      PRO  43  90.001  -0.246   5.193
  348    HB3  PRO  43           HB1      PRO  43  88.636  -0.787   4.196
  349    HG2  PRO  43           HG2      PRO  43  91.333  -2.005   4.517
  350    HG3  PRO  43           HG1      PRO  43  89.746  -2.786   4.412
  351    HD2  PRO  43           HD2      PRO  43  91.481  -2.632   2.291
  352    HD3  PRO  43           HD1      PRO  43  89.715  -2.717   2.100
  353    H    LYS  44           HN       LYS  44  90.296   2.590   3.995
  354    HA   LYS  44           HA       LYS  44  92.032   4.125   4.442
  355    HB2  LYS  44           HB2      LYS  44  93.095   1.604   5.749
  356    HB3  LYS  44           HB1      LYS  44  93.677   3.237   6.074
  357    HG2  LYS  44           HG2      LYS  44  91.247   3.825   6.646
  358    HG3  LYS  44           HG1      LYS  44  90.943   2.088   6.658
  359    HD2  LYS  44           HD2      LYS  44  92.716   1.793   8.356
  360    HD3  LYS  44           HD1      LYS  44  92.999   3.534   8.357
  361    HE2  LYS  44           HE2      LYS  44  90.506   3.776   8.924
  362    HE3  LYS  44           HE1      LYS  44  90.532   2.047   9.271
  363    HZ1  LYS  44           HZ1      LYS  44  92.717   3.454  10.474
  364    HZ2  LYS  44           HZ2      LYS  44  91.596   2.388  11.177
  365    HZ3  LYS  44           HZ3      LYS  44  91.213   4.034  11.001
  366    H    LYS  45           HN       LYS  45  92.531   3.993   2.025
  367    HA   LYS  45           HA       LYS  45  95.339   3.906   1.604
  368    HB2  LYS  45           HB2      LYS  45  95.265   1.515   1.748
  369    HB3  LYS  45           HB1      LYS  45  93.811   1.434   0.758
  370    HG2  LYS  45           HG2      LYS  45  95.920   0.831  -0.482
  371    HG3  LYS  45           HG1      LYS  45  95.024   2.169  -1.204
  372    HD2  LYS  45           HD2      LYS  45  96.540   3.785  -0.373
  373    HD3  LYS  45           HD1      LYS  45  97.235   2.657   0.792
  374    HE2  LYS  45           HE2      LYS  45  98.780   2.937  -1.078
  375    HE3  LYS  45           HE1      LYS  45  98.123   1.300  -1.103
  376    HZ1  LYS  45           HZ1      LYS  45  96.875   1.724  -2.937
  377    HZ2  LYS  45           HZ2      LYS  45  98.155   2.797  -3.242
  378    HZ3  LYS  45           HZ3      LYS  45  96.696   3.375  -2.591
  379    H    GLY  46           HN       GLY  46  92.476   2.894  -0.311
  380    HA2  GLY  46           HA2      GLY  46  93.298   4.531  -2.569
  381    HA3  GLY  46           HA1      GLY  46  91.764   3.671  -2.421
  382    H    VAL  47           HN       VAL  47  92.933   5.936   0.001
  383    HA   VAL  47           HA       VAL  47  90.537   7.375   0.228
  384    HB   VAL  47           HB       VAL  47  92.049   9.264   1.087
  385   HG11  VAL  47          HG11      VAL  47  91.054   7.481   2.518
  386   HG12  VAL  47          HG12      VAL  47  92.634   8.005   3.100
  387   HG13  VAL  47          HG13      VAL  47  92.478   6.484   2.222
  388   HG21  VAL  47          HG21      VAL  47  93.984   8.510  -0.384
  389   HG22  VAL  47          HG22      VAL  47  94.189   7.151   0.722
  390   HG23  VAL  47          HG23      VAL  47  94.398   8.803   1.305
  391    H    GLN  48           HN       GLN  48  89.777   9.319  -0.709
  392    HA   GLN  48           HA       GLN  48  91.323  10.562  -2.888
  393    HB2  GLN  48           HB2      GLN  48  89.909   8.523  -3.754
  394    HB3  GLN  48           HB1      GLN  48  88.541   9.620  -3.558
  395    HG2  GLN  48           HG2      GLN  48  89.675  11.284  -4.993
  396    HG3  GLN  48           HG1      GLN  48  91.029  10.174  -5.203
  397   HE21  GLN  48          HE21      GLN  48  87.490   9.500  -5.223
  398   HE22  GLN  48          HE22      GLN  48  87.476   8.831  -6.783
  399    H    GLY  49           HN       GLY  49  89.928  11.145  -0.208
  400    HA2  GLY  49           HA2      GLY  49  89.112  13.227   0.608
  401    HA3  GLY  49           HA1      GLY  49  88.813  13.732  -1.056
  402    H1U  RCY  50           H1U      RCY  50  81.701  12.219  -3.860
  403    H1S  RCY  50           H1S      RCY  50  83.170   9.269  -0.808
  404    HB1  RCY  50           HB1      RCY  50  84.110  11.181   2.132
  405    HB2  RCY  50           HB2      RCY  50  85.867  11.056   2.223
  406    HA   RCY  50           HA       RCY  50  84.642  12.770   0.086
  407    HN1  RCY  50           HN1      RCY  50  87.067  13.592   1.477
  408    H    GLY  51           HN       GLY  51  82.784  13.605   1.133
  409    HA2  GLY  51           HA2      GLY  51  82.984  15.956   2.596
  410    HA3  GLY  51           HA1      GLY  51  81.572  14.902   2.689
  411    H    ASP  52           HN       ASP  52  82.453  12.696   3.978
  412    HA   ASP  52           HA       ASP  52  82.884  11.878   6.133
  413    HB2  ASP  52           HB2      ASP  52  85.200  12.682   5.394
  414    HB3  ASP  52           HB1      ASP  52  84.891  14.129   6.355
  415    H    ASP  53           HN       ASP  53  82.525  12.379   8.416
  416    HA   ASP  53           HA       ASP  53  81.452  13.518  10.162
  417    HB2  ASP  53           HB2      ASP  53  83.182  15.310   9.318
  418    HB3  ASP  53           HB1      ASP  53  81.755  16.108   8.658
  419    H    ILE  54           HN       ILE  54  80.486  14.132   6.853
  420    HA   ILE  54           HA       ILE  54  77.658  14.051   7.702
  421    HB   ILE  54           HB       ILE  54  77.261  16.066   6.105
  422   HG12  ILE  54          HG12      ILE  54  80.117  16.656   6.922
  423   HG13  ILE  54          HG11      ILE  54  79.694  16.003   5.339
  424   HG21  ILE  54          HG21      ILE  54  76.960  16.072   8.590
  425   HG22  ILE  54          HG22      ILE  54  77.506  17.627   7.961
  426   HG23  ILE  54          HG23      ILE  54  78.650  16.548   8.758
  427   HD11  ILE  54          HD11      ILE  54  78.743  18.625   6.528
  428   HD12  ILE  54          HD12      ILE  54  78.148  17.950   5.012
  429   HD13  ILE  54          HD13      ILE  54  79.840  18.423   5.162
  430    HA   PRO  55           HA       PRO  55  78.559  11.867   3.723
  431    HB2  PRO  55           HB2      PRO  55  77.537   9.447   4.413
  432    HB3  PRO  55           HB1      PRO  55  79.183   9.943   4.854
  433    HG2  PRO  55           HG2      PRO  55  76.726   9.859   6.520
  434    HG3  PRO  55           HG1      PRO  55  78.404   9.501   6.959
  435    HD2  PRO  55           HD2      PRO  55  77.092  11.894   7.525
  436    HD3  PRO  55           HD1      PRO  55  78.856  11.689   7.480
  437    H    GLY  56           HN       GLY  56  77.024  12.784   2.370
  438    HA2  GLY  56           HA2      GLY  56  74.985  12.630   1.136
  439    HA3  GLY  56           HA1      GLY  56  74.317  11.612   2.413
  440    H    MET  57           HN       MET  57  75.920  14.520   3.377
  441    HA   MET  57           HA       MET  57  75.095  16.450   4.421
  442    HB2  MET  57           HB2      MET  57  72.665  16.144   2.648
  443    HB3  MET  57           HB1      MET  57  73.381  17.631   3.270
  444    HG2  MET  57           HG2      MET  57  75.483  16.980   1.941
  445    HG3  MET  57           HG1      MET  57  74.461  15.798   1.125
  446    HE1  MET  57           HE1      MET  57  73.727  17.791  -1.814
  447    HE2  MET  57           HE2      MET  57  73.563  16.241  -0.993
  448    HE3  MET  57           HE3      MET  57  75.151  16.992  -1.136
  449    H    GLU  58           HN       GLU  58  74.263  13.677   5.336
  450    HA   GLU  58           HA       GLU  58  72.758  12.723   6.874
  451    HB2  GLU  58           HB2      GLU  58  73.850  14.604   8.183
  452    HB3  GLU  58           HB1      GLU  58  72.438  15.589   7.801
  453    HG2  GLU  58           HG2      GLU  58  70.968  14.044   8.937
  454    HG3  GLU  58           HG1      GLU  58  72.280  12.887   9.162
  455    H    GLY  59           HN       GLY  59  71.210  12.298   5.096
  456    HA2  GLY  59           HA2      GLY  59  68.580  13.276   5.713
  457    HA3  GLY  59           HA1      GLY  59  69.175  14.042   4.240
  458    H1U  RCY  60           H1U      RCY  60  63.356   9.108  -2.672
  459    H1S  RCY  60           H1S      RCY  60  66.122   9.463   0.268
  460    HB1  RCY  60           HB1      RCY  60  69.652  10.041   2.069
  461    HB2  RCY  60           HB2      RCY  60  69.276  11.263   0.854
  462    HA   RCY  60           HA       RCY  60  66.872  11.155   1.590
  463    HN1  RCY  60           HN1      RCY  60  67.719  12.956   2.846
  464    H    GLY  61           HN       GLY  61  67.162  10.964   4.742
  465    HA2  GLY  61           HA2      GLY  61  65.539   8.814   5.271
  466    HA3  GLY  61           HA1      GLY  61  67.137   8.070   5.171
  467    H    THR  62           HN       THR  62  68.541  10.397   6.237
  468    HA   THR  62           HA       THR  62  69.162  11.324   8.298
  469    HB   THR  62           HB       THR  62  67.483  12.073   9.722
  470    HG1  THR  62           HG1      THR  62  65.514  10.832   9.955
  471   HG21  THR  62          HG21      THR  62  66.964  12.294   7.088
  472   HG22  THR  62          HG22      THR  62  65.900  12.965   8.324
  473   HG23  THR  62          HG23      THR  62  65.522  11.408   7.587
  474    H    ASP  63           HN       ASP  63  67.214   8.348   8.585
  475    HA   ASP  63           HA       ASP  63  68.202   7.407  11.037
  476    HB2  ASP  63           HB2      ASP  63  67.601   5.186  10.283
  477    HB3  ASP  63           HB1      ASP  63  66.414   6.316   9.634
  478    H    ILE  64           HN       ILE  64  69.843   7.757   8.004
  479    HA   ILE  64           HA       ILE  64  72.058   5.977   8.849
  480    HB   ILE  64           HB       ILE  64  71.483   5.851   6.507
  481   HG12  ILE  64          HG12      ILE  64  73.866   7.600   6.247
  482   HG13  ILE  64          HG11      ILE  64  74.009   6.284   7.413
  483   HG21  ILE  64          HG21      ILE  64  71.766   8.864   6.599
  484   HG22  ILE  64          HG22      ILE  64  70.333   7.929   6.170
  485   HG23  ILE  64          HG23      ILE  64  71.727   7.952   5.090
  486   HD11  ILE  64          HD11      ILE  64  74.635   5.849   4.900
  487   HD12  ILE  64          HD12      ILE  64  72.889   5.729   4.680
  488   HD13  ILE  64          HD13      ILE  64  73.716   4.633   5.787
  489    H    THR  65           HN       THR  65  71.567   8.222  10.512
  490    HA   THR  65           HA       THR  65  73.087  10.537   9.995
  491    HB   THR  65           HB       THR  65  73.104   9.126  12.676
  492    HG1  THR  65           HG1      THR  65  71.112  10.936  11.897
  493   HG21  THR  65          HG21      THR  65  74.444  11.258  12.234
  494   HG22  THR  65          HG22      THR  65  73.306  11.323  13.579
  495   HG23  THR  65          HG23      THR  65  72.892  12.072  12.037
  496    H    VAL  66           HN       VAL  66  74.070   7.318  10.931
  497    HA   VAL  66           HA       VAL  66  76.752   7.697   9.896
  498    HB   VAL  66           HB       VAL  66  77.633   6.867  12.301
  499   HG11  VAL  66          HG11      VAL  66  78.173   8.980  10.873
  500   HG12  VAL  66          HG12      VAL  66  78.517   9.025  12.602
  501   HG13  VAL  66          HG13      VAL  66  77.068   9.808  11.971
  502   HG21  VAL  66          HG21      VAL  66  75.535   8.849  13.150
  503   HG22  VAL  66          HG22      VAL  66  76.421   7.683  14.132
  504   HG23  VAL  66          HG23      VAL  66  75.131   7.135  13.061
  505    H    ILE  67           HN       ILE  67  74.392   5.829  11.697
  506    HA   ILE  67           HA       ILE  67  75.342   3.364  10.325
  507    HB   ILE  67           HB       ILE  67  74.710   3.622  13.285
  508   HG12  ILE  67          HG12      ILE  67  77.055   2.289  13.114
  509   HG13  ILE  67          HG11      ILE  67  77.165   3.255  11.642
  510   HG21  ILE  67          HG21      ILE  67  73.672   1.595  12.586
  511   HG22  ILE  67          HG22      ILE  67  75.240   1.111  13.231
  512   HG23  ILE  67          HG23      ILE  67  74.996   1.208  11.487
  513   HD11  ILE  67          HD11      ILE  67  76.367   5.202  13.258
  514   HD12  ILE  67          HD12      ILE  67  78.068   4.743  13.175
  515   HD13  ILE  67          HD13      ILE  67  77.059   4.155  14.496
  516    H1U  RCY  68           H1U      RCY  68  73.303   5.145   1.831
  517    H1S  RCY  68           H1S      RCY  68  72.082   3.992   5.829
  518    HB1  RCY  68           HB1      RCY  68  71.023   3.925   7.490
  519    HB2  RCY  68           HB2      RCY  68  70.384   2.299   7.721
  520    HA   RCY  68           HA       RCY  68  70.881   3.921   9.794
  521    HN1  RCY  68           HN1      RCY  68  73.543   3.261   8.953
  522    HA   PRO  69           HA       PRO  69  69.876   0.356  12.207
  523    HB2  PRO  69           HB2      PRO  69  67.141   0.270  11.777
  524    HB3  PRO  69           HB1      PRO  69  67.947   1.367  12.914
  525    HG2  PRO  69           HG2      PRO  69  66.931   1.897  10.175
  526    HG3  PRO  69           HG1      PRO  69  66.929   2.941  11.605
  527    HD2  PRO  69           HD2      PRO  69  68.716   3.245   9.559
  528    HD3  PRO  69           HD1      PRO  69  69.098   3.672  11.242
  529    H    TRP  70           HN       TRP  70  67.894   0.313   9.197
  530    HA   TRP  70           HA       TRP  70  67.905  -2.574   9.095
  531    HD1  TRP  70           HD1      TRP  70  65.624   0.672   8.778
  532    HE1  TRP  70           HE1      TRP  70  65.991   2.999   7.735
  533    HE3  TRP  70           HE3      TRP  70  68.841  -0.552   5.006
  534    HZ2  TRP  70           HZ2      TRP  70  67.459   4.188   5.581
  535    HZ3  TRP  70           HZ3      TRP  70  69.707   1.192   3.478
  536    HH2  TRP  70           HH2      TRP  70  69.022   3.557   3.758
  537    HB2  TRP  70           HB2      TRP  70  67.276  -1.953   6.557
  538    HB3  TRP  70           HB1      TRP  70  66.118  -1.778   7.872
  539    H    GLU  71           HN       GLU  71  70.554  -1.557   9.407
  540    HA   GLU  71           HA       GLU  71  71.979  -3.126   7.530
  541    HB2  GLU  71           HB2      GLU  71  71.197  -0.554   6.517
  542    HB3  GLU  71           HB1      GLU  71  72.947  -0.557   6.712
  543    HG2  GLU  71           HG2      GLU  71  71.401  -2.750   5.305
  544    HG3  GLU  71           HG1      GLU  71  72.182  -1.406   4.472
  545    H    ALA  72           HN       ALA  72  72.557  -3.404   9.919
  546    HA   ALA  72           HA       ALA  72  74.231  -1.354  11.139
  547    HB1  ALA  72           HB1      ALA  72  72.900  -2.949  12.496
  548    HB2  ALA  72           HB2      ALA  72  74.617  -3.029  12.892
  549    HB3  ALA  72           HB3      ALA  72  73.886  -4.276  11.881
  550    H1U  RCY  73           H1U      RCY  73  78.577  -0.530   0.845
  551    H1S  RCY  73           H1S      RCY  73  78.099  -0.453   4.907
  552    HB1  RCY  73           HB1      RCY  73  78.790  -1.664   7.375
  553    HB2  RCY  73           HB2      RCY  73  77.747  -0.485   8.172
  554    HA   RCY  73           HA       RCY  73  77.289  -3.483   8.241
  555    HN1  RCY  73           HN1      RCY  73  75.524  -1.416   8.928
  556    H    ASN  74           HN       ASN  74  77.550  -1.103  10.837
  557    HA   ASN  74           HA       ASN  74  79.141  -0.878  12.556
  558    HB2  ASN  74           HB2      ASN  74  78.973  -3.884  12.212
  559    HB3  ASN  74           HB1      ASN  74  79.801  -3.100  13.559
  560   HD21  ASN  74          HD21      ASN  74  78.149  -4.113  15.013
  561   HD22  ASN  74          HD22      ASN  74  76.606  -3.417  15.139
  562    H    HIS  75           HN       HIS  75  80.362  -0.288  10.195
  563    HA   HIS  75           HA       HIS  75  82.470  -0.188   9.170
  564    HD1  HIS  75           HD1      HIS  75  84.472  -0.904   8.453
  565    HD2  HIS  75           HD2      HIS  75  85.833   0.834  11.992
  566    HE1  HIS  75           HE1      HIS  75  86.741   0.094   7.933
  567    HE2  HIS  75           HE2      HIS  75  87.581   1.155  10.080
  568    HB2  HIS  75           HB2      HIS  75  83.015   0.082  11.703
  569    HB3  HIS  75           HB1      HIS  75  83.584  -1.584  11.602
  570    H1U  RCY  76           H1U      RCY  76  88.442  -0.771   3.381
  571    H1S  RCY  76           H1S      RCY  76  85.539  -2.028   6.182
  572    HB1  RCY  76           HB1      RCY  76  83.349  -4.934   6.322
  573    HB2  RCY  76           HB2      RCY  76  84.167  -4.093   7.639
  574    HA   RCY  76           HA       RCY  76  81.191  -4.340   7.154
  575    HN1  RCY  76           HN1      RCY  76  81.004  -2.271   8.241
  576    H    GLU  77           HN       GLU  77  80.550  -6.164   8.178
  577    HA   GLU  77           HA       GLU  77  81.437  -6.810  10.858
  578    HB2  GLU  77           HB2      GLU  77  79.179  -7.373   9.669
  579    HB3  GLU  77           HB1      GLU  77  80.047  -8.768   9.036
  580    HG2  GLU  77           HG2      GLU  77  80.757  -9.176  11.503
  581    HG3  GLU  77           HG1      GLU  77  79.430  -8.086  11.906
  582    H    LEU  78           HN       LEU  78  81.501  -9.194   8.207
  583    HA   LEU  78           HA       LEU  78  84.413  -9.411   8.364
  584    HG   LEU  78           HG       LEU  78  82.347 -12.710  10.090
  585    HB2  LEU  78           HB2      LEU  78  84.546 -11.655   9.212
  586    HB3  LEU  78           HB1      LEU  78  83.605 -10.712  10.356
  587   HD11  LEU  78          HD11      LEU  78  81.145 -10.887   7.995
  588   HD12  LEU  78          HD12      LEU  78  81.087 -10.519   9.718
  589   HD13  LEU  78          HD13      LEU  78  80.299 -11.970   9.099
  590   HD21  LEU  78          HD21      LEU  78  82.206 -12.583   7.120
  591   HD22  LEU  78          HD22      LEU  78  82.282 -13.988   8.183
  592   HD23  LEU  78          HD23      LEU  78  83.750 -13.084   7.810
  593    H    HIS  79           HN       HIS  79  81.812  -9.313   6.554
  594    HA   HIS  79           HA       HIS  79  81.558  -9.753   4.257
  595    HD1  HIS  79           HD1      HIS  79  85.054  -9.164   2.247
  596    HD2  HIS  79           HD2      HIS  79  81.503 -11.330   1.925
  597    HE1  HIS  79           HE1      HIS  79  84.318  -8.977  -0.170
  598    HE2  HIS  79           HE2      HIS  79  82.158 -10.291  -0.379
  599    HB2  HIS  79           HB2      HIS  79  84.214  -9.943   4.491
  600    HB3  HIS  79           HB1      HIS  79  83.873 -11.647   4.194
  601    H    GLU  80           HN       GLU  80  79.665 -10.940   4.451
  602    HA   GLU  80           HA       GLU  80  79.986 -13.916   4.649
  603    HB2  GLU  80           HB2      GLU  80  77.774 -12.116   5.665
  604    HB3  GLU  80           HB1      GLU  80  77.579 -13.861   5.490
  605    HG2  GLU  80           HG2      GLU  80  79.872 -12.657   7.047
  606    HG3  GLU  80           HG1      GLU  80  78.319 -13.020   7.800
  607    H    LEU  81           HN       LEU  81  77.088 -12.069   3.824
  608    HA   LEU  81           HA       LEU  81  76.956 -13.528   1.252
  609    HG   LEU  81           HG       LEU  81  75.696 -10.752   3.106
  610    HB2  LEU  81           HB2      LEU  81  74.696 -12.288   1.126
  611    HB3  LEU  81           HB1      LEU  81  74.868 -13.518   2.376
  612   HD11  LEU  81          HD11      LEU  81  73.668 -10.162   2.000
  613   HD12  LEU  81          HD12      LEU  81  73.245 -10.296   3.707
  614   HD13  LEU  81          HD13      LEU  81  72.839 -11.602   2.592
  615   HD21  LEU  81          HD21      LEU  81  74.985 -11.434   5.260
  616   HD22  LEU  81          HD22      LEU  81  75.684 -12.894   4.561
  617   HD23  LEU  81          HD23      LEU  81  73.932 -12.690   4.608
  618    H    ALA  82           HN       ALA  82  78.228 -10.647   2.370
  619    HA   ALA  82           HA       ALA  82  77.498  -8.734   0.423
  620    HB1  ALA  82           HB1      ALA  82  79.785  -7.753   0.870
  621    HB2  ALA  82           HB2      ALA  82  80.127  -9.168   1.865
  622    HB3  ALA  82           HB3      ALA  82  78.830  -8.063   2.320
  623    H    GLN  83           HN       GLN  83  79.438 -11.595   0.117
  624    HA   GLN  83           HA       GLN  83  80.822 -10.733  -2.299
  625    HB2  GLN  83           HB2      GLN  83  81.474 -13.127  -2.477
  626    HB3  GLN  83           HB1      GLN  83  81.812 -12.463  -0.879
  627    HG2  GLN  83           HG2      GLN  83  79.203 -13.380  -0.639
  628    HG3  GLN  83           HG1      GLN  83  79.970 -14.608  -1.646
  629   HE21  GLN  83          HE21      GLN  83  80.697 -16.274  -0.317
  630   HE22  GLN  83          HE22      GLN  83  81.466 -16.061   1.180
  631    H    TYR  84           HN       TYR  84  80.472 -12.624  -4.185
  632    HA   TYR  84           HA       TYR  84  79.051 -13.120  -5.986
  633    HD1  TYR  84           HD1      TYR  84  78.618 -15.116  -6.840
  634    HD2  TYR  84           HD2      TYR  84  78.250 -15.673  -2.597
  635    HE1  TYR  84           HE1      TYR  84  79.821 -17.277  -7.019
  636    HE2  TYR  84           HE2      TYR  84  79.453 -17.834  -2.776
  637    HH   TYR  84           HH       TYR  84  80.531 -19.079  -5.940
  638    HB2  TYR  84           HB2      TYR  84  77.357 -13.757  -3.567
  639    HB3  TYR  84           HB1      TYR  84  76.727 -13.974  -5.199
  640    H    GLY  85           HN       GLY  85  76.302 -12.100  -4.082
  641    HA2  GLY  85           HA2      GLY  85  75.740  -9.565  -4.203
  642    HA3  GLY  85           HA1      GLY  85  75.957  -9.789  -5.940
  643    H    ILE  86           HN       ILE  86  73.884 -10.503  -3.200
  644    HA   ILE  86           HA       ILE  86  72.063 -12.289  -4.436
  645    HB   ILE  86           HB       ILE  86  71.133 -10.122  -2.555
  646   HG12  ILE  86          HG12      ILE  86  73.246 -10.827  -1.609
  647   HG13  ILE  86          HG11      ILE  86  71.963 -11.626  -0.700
  648   HG21  ILE  86          HG21      ILE  86  69.480 -11.737  -3.369
  649   HG22  ILE  86          HG22      ILE  86  69.798 -12.021  -1.658
  650   HG23  ILE  86          HG23      ILE  86  70.516 -13.076  -2.876
  651   HD11  ILE  86          HD11      ILE  86  72.259 -13.575  -2.375
  652   HD12  ILE  86          HD12      ILE  86  73.507 -13.360  -1.147
  653   HD13  ILE  86          HD13      ILE  86  73.787 -12.802  -2.796
  654    H1U  RCY  87           H1U      RCY  87  69.906  -0.616  -7.819
  655    H1S  RCY  87           H1S      RCY  87  71.245  -4.867  -7.390
  656    HB1  RCY  87           HB1      RCY  87  71.771  -6.781  -7.771
  657    HB2  RCY  87           HB2      RCY  87  73.047  -7.396  -6.720
  658    HA   RCY  87           HA       RCY  87  70.228  -8.359  -6.326
  659    HN1  RCY  87           HN1      RCY  87  72.882  -9.253  -5.478
  Start of MODEL   13
    1    HA   MET   1           HA       MET   1  57.216 -14.440   5.102
    2    HB2  MET   1           HB2      MET   1  55.398 -15.110   7.431
    3    HB3  MET   1           HB1      MET   1  55.206 -13.797   6.269
    4    HG2  MET   1           HG2      MET   1  55.107 -15.614   4.463
    5    HG3  MET   1           HG1      MET   1  54.915 -16.766   5.785
    6    HE1  MET   1           HE1      MET   1  53.078 -17.188   4.054
    7    HE2  MET   1           HE2      MET   1  52.584 -15.705   3.242
    8    HE3  MET   1           HE3      MET   1  51.432 -16.575   4.252
    9    H    ASN   2           HN       ASN   2  59.224 -13.597   5.817
   10    HA   ASN   2           HA       ASN   2  59.984 -13.464   8.591
   11    HB2  ASN   2           HB2      ASN   2  60.872 -11.895   6.156
   12    HB3  ASN   2           HB1      ASN   2  61.597 -11.691   7.751
   13   HD21  ASN   2          HD21      ASN   2  61.061 -14.103   5.161
   14   HD22  ASN   2          HD22      ASN   2  62.334 -15.123   5.629
   15    H    LEU   3           HN       LEU   3  57.514 -11.923   6.965
   16    HA   LEU   3           HA       LEU   3  56.231 -10.010   7.426
   17    HG   LEU   3           HG       LEU   3  54.516  -9.887   9.074
   18    HB2  LEU   3           HB2      LEU   3  56.350 -11.399   9.680
   19    HB3  LEU   3           HB1      LEU   3  57.318 -10.032  10.228
   20   HD11  LEU   3          HD11      LEU   3  54.045  -8.964  11.396
   21   HD12  LEU   3          HD12      LEU   3  55.655  -9.518  11.856
   22   HD13  LEU   3          HD13      LEU   3  54.436 -10.683  11.339
   23   HD21  LEU   3          HD21      LEU   3  54.795  -7.447   9.879
   24   HD22  LEU   3          HD22      LEU   3  55.616  -7.900   8.385
   25   HD23  LEU   3          HD23      LEU   3  56.526  -7.784   9.892
   26    H    GLU   4           HN       GLU   4  57.428  -8.504   6.166
   27    HA   GLU   4           HA       GLU   4  59.603  -7.024   7.565
   28    HB2  GLU   4           HB2      GLU   4  59.854  -5.984   5.202
   29    HB3  GLU   4           HB1      GLU   4  60.342  -7.665   5.415
   30    HG2  GLU   4           HG2      GLU   4  57.528  -6.980   4.585
   31    HG3  GLU   4           HG1      GLU   4  58.820  -7.078   3.388
   32    HA   PRO   5           HA       PRO   5  57.302  -3.415   8.609
   33    HB2  PRO   5           HB2      PRO   5  59.129  -1.974   6.712
   34    HB3  PRO   5           HB1      PRO   5  58.671  -1.546   8.372
   35    HG2  PRO   5           HG2      PRO   5  61.028  -2.683   7.780
   36    HG3  PRO   5           HG1      PRO   5  60.179  -2.986   9.304
   37    HD2  PRO   5           HD2      PRO   5  60.614  -4.814   7.030
   38    HD3  PRO   5           HD1      PRO   5  60.162  -5.192   8.707
   39    HA   PRO   6           HA       PRO   6  54.449  -2.822   5.251
   40    HB2  PRO   6           HB2      PRO   6  53.213  -0.512   5.996
   41    HB3  PRO   6           HB1      PRO   6  52.969  -2.047   6.854
   42    HG2  PRO   6           HG2      PRO   6  54.703   0.261   7.582
   43    HG3  PRO   6           HG1      PRO   6  53.684  -0.756   8.614
   44    HD2  PRO   6           HD2      PRO   6  56.405  -1.080   8.399
   45    HD3  PRO   6           HD1      PRO   6  55.292  -2.405   8.805
   46    H    LYS   7           HN       LYS   7  54.309  -1.754   3.247
   47    HA   LYS   7           HA       LYS   7  55.351   0.900   2.796
   48    HB2  LYS   7           HB2      LYS   7  57.203   0.009   1.202
   49    HB3  LYS   7           HB1      LYS   7  57.541   0.037   2.932
   50    HG2  LYS   7           HG2      LYS   7  56.937  -2.330   3.119
   51    HG3  LYS   7           HG1      LYS   7  56.514  -2.375   1.407
   52    HD2  LYS   7           HD2      LYS   7  59.268  -1.702   2.484
   53    HD3  LYS   7           HD1      LYS   7  58.798  -3.278   1.846
   54    HE2  LYS   7           HE2      LYS   7  59.640  -2.374  -0.093
   55    HE3  LYS   7           HE1      LYS   7  57.995  -1.749  -0.212
   56    HZ1  LYS   7           HZ1      LYS   7  59.438   0.000   1.400
   57    HZ2  LYS   7           HZ2      LYS   7  58.825   0.284  -0.159
   58    HZ3  LYS   7           HZ3      LYS   7  60.402  -0.316   0.040
   59    H    ALA   8           HN       ALA   8  54.147   1.627   1.119
   60    HA   ALA   8           HA       ALA   8  53.831   0.168  -1.347
   61    HB1  ALA   8           HB1      ALA   8  52.245  -1.057   0.240
   62    HB2  ALA   8           HB2      ALA   8  51.517  -0.430  -1.239
   63    HB3  ALA   8           HB3      ALA   8  51.297   0.429   0.285
   64    H    GLU   9           HN       GLU   9  54.472   2.209  -2.194
   65    HA   GLU   9           HA       GLU   9  52.260   4.174  -2.363
   66    HB2  GLU   9           HB2      GLU   9  55.049   4.819  -1.369
   67    HB3  GLU   9           HB1      GLU   9  53.910   6.044  -1.928
   68    HG2  GLU   9           HG2      GLU   9  52.262   5.197  -0.234
   69    HG3  GLU   9           HG1      GLU   9  53.521   4.130   0.389
   70    H1U  RCY  10           H1U      RCY  10  61.155   0.307  -3.997
   71    H1S  RCY  10           H1S      RCY  10  59.292   1.817  -7.234
   72    HB1  RCY  10           HB1      RCY  10  56.512   1.724  -5.654
   73    HB2  RCY  10           HB2      RCY  10  57.314   3.064  -4.837
   74    HA   RCY  10           HA       RCY  10  55.510   4.574  -5.826
   75    HN1  RCY  10           HN1      RCY  10  55.203   2.766  -3.576
   76    H    ARG  11           HN       ARG  11  53.012   4.325  -6.194
   77    HA   ARG  11           HA       ARG  11  52.210   1.890  -7.613
   78    HE   ARG  11           HE       ARG  11  49.494   7.671  -7.154
   79    HB2  ARG  11           HB2      ARG  11  50.147   3.423  -8.119
   80    HB3  ARG  11           HB1      ARG  11  50.413   2.873  -6.464
   81    HG2  ARG  11           HG2      ARG  11  51.352   4.961  -5.810
   82    HG3  ARG  11           HG1      ARG  11  51.528   5.490  -7.484
   83    HD2  ARG  11           HD2      ARG  11  49.029   5.425  -7.705
   84    HD3  ARG  11           HD1      ARG  11  48.930   5.071  -5.980
   85   HH11  ARG  11          HH21      ARG  11  50.010   5.545  -4.490
   86   HH12  ARG  11          HH22      ARG  11  50.300   6.821  -3.356
   87   HH21  ARG  11          HH11      ARG  11  49.871   9.350  -5.689
   88   HH22  ARG  11          HH12      ARG  11  50.222   8.976  -4.034
   89    H    SER  12           HN       SER  12  53.606   1.794  -9.432
   90    HA   SER  12           HA       SER  12  52.845   3.624 -11.624
   91    HG   SER  12           HG       SER  12  54.018   5.549 -10.984
   92    HB2  SER  12           HB2      SER  12  55.701   3.295 -10.663
   93    HB3  SER  12           HB1      SER  12  55.252   4.032 -12.198
   94    H    ALA  13           HN       ALA  13  55.783   1.712 -11.636
   95    HA   ALA  13           HA       ALA  13  54.534  -0.679 -12.725
   96    HB1  ALA  13           HB1      ALA  13  55.652  -0.431 -14.985
   97    HB2  ALA  13           HB2      ALA  13  55.946   1.259 -14.577
   98    HB3  ALA  13           HB3      ALA  13  54.293   0.660 -14.715
   99    H    THR  14           HN       THR  14  57.572   0.425 -14.031
  100    HA   THR  14           HA       THR  14  59.261  -0.558 -11.910
  101    HB   THR  14           HB       THR  14  58.554  -2.758 -12.490
  102    HG1  THR  14           HG1      THR  14  60.825  -2.359 -14.121
  103   HG21  THR  14          HG21      THR  14  57.381  -2.218 -14.562
  104   HG22  THR  14          HG22      THR  14  58.516  -3.536 -14.856
  105   HG23  THR  14          HG23      THR  14  58.913  -1.897 -15.374
  106    H    ARG  15           HN       ARG  15  59.046   1.688 -13.810
  107    HA   ARG  15           HA       ARG  15  61.243   1.353 -15.716
  108    HE   ARG  15           HE       ARG  15  57.463   6.227 -13.713
  109    HB2  ARG  15           HB2      ARG  15  60.854   3.710 -16.249
  110    HB3  ARG  15           HB1      ARG  15  59.310   2.861 -16.175
  111    HG2  ARG  15           HG2      ARG  15  59.168   3.612 -13.738
  112    HG3  ARG  15           HG1      ARG  15  60.523   4.684 -14.089
  113    HD2  ARG  15           HD2      ARG  15  59.188   5.667 -15.969
  114    HD3  ARG  15           HD1      ARG  15  57.817   4.684 -15.455
  115   HH11  ARG  15          HH21      ARG  15  60.683   6.386 -14.936
  116   HH12  ARG  15          HH22      ARG  15  61.127   7.749 -13.964
  117   HH21  ARG  15          HH11      ARG  15  58.025   8.006 -12.436
  118   HH22  ARG  15          HH12      ARG  15  59.622   8.666 -12.548
  119    H    VAL  16           HN       VAL  16  63.366   1.801 -15.315
  120    HA   VAL  16           HA       VAL  16  64.072   2.817 -12.613
  121    HB   VAL  16           HB       VAL  16  66.414   2.116 -13.358
  122   HG11  VAL  16          HG11      VAL  16  65.103   0.691 -11.892
  123   HG12  VAL  16          HG12      VAL  16  65.875  -0.325 -13.110
  124   HG13  VAL  16          HG13      VAL  16  64.166   0.084 -13.257
  125   HG21  VAL  16          HG21      VAL  16  65.769   2.199 -15.819
  126   HG22  VAL  16          HG22      VAL  16  64.869   0.707 -15.551
  127   HG23  VAL  16          HG23      VAL  16  66.617   0.736 -15.318
  128    H    MET  17           HN       MET  17  63.039   4.842 -14.117
  129    HA   MET  17           HA       MET  17  63.522   6.951 -15.031
  130    HB2  MET  17           HB2      MET  17  66.032   6.377 -13.435
  131    HB3  MET  17           HB1      MET  17  65.709   7.934 -14.199
  132    HG2  MET  17           HG2      MET  17  63.765   8.297 -12.862
  133    HG3  MET  17           HG1      MET  17  63.750   6.624 -12.304
  134    HE1  MET  17           HE1      MET  17  66.269   6.277  -9.644
  135    HE2  MET  17           HE2      MET  17  65.763   5.537 -11.161
  136    HE3  MET  17           HE3      MET  17  64.551   6.036  -9.983
  137    H    GLY  18           HN       GLY  18  66.907   5.978 -15.113
  138    HA2  GLY  18           HA2      GLY  18  68.221   5.263 -16.967
  139    HA3  GLY  18           HA1      GLY  18  66.772   5.298 -17.973
  140    H    GLY  19           HN       GLY  19  66.139   7.293 -18.935
  141    HA2  GLY  19           HA2      GLY  19  68.266   9.041 -19.685
  142    HA3  GLY  19           HA1      GLY  19  66.552   9.370 -19.944
  143    HA   PRO  20           HA       PRO  20  66.017  12.472 -16.886
  144    HB2  PRO  20           HB2      PRO  20  64.814  10.399 -15.076
  145    HB3  PRO  20           HB1      PRO  20  64.223  12.026 -15.469
  146    HG2  PRO  20           HG2      PRO  20  63.199   9.825 -16.601
  147    HG3  PRO  20           HG1      PRO  20  63.325  11.364 -17.466
  148    HD2  PRO  20           HD2      PRO  20  64.840   8.868 -17.893
  149    HD3  PRO  20           HD1      PRO  20  64.624  10.254 -18.984
  150    H1U  RCY  21           H1U      RCY  21  63.954   7.131 -12.195
  151    H1S  RCY  21           H1S      RCY  21  66.879   7.318 -13.493
  152    HB1  RCY  21           HB1      RCY  21  69.910   8.178 -13.945
  153    HB2  RCY  21           HB2      RCY  21  68.279   7.916 -14.561
  154    HA   RCY  21           HA       RCY  21  68.577  10.574 -13.388
  155    HN1  RCY  21           HN1      RCY  21  67.356   9.400 -15.771
  156    H    THR  22           HN       THR  22  70.318  11.896 -13.550
  157    HA   THR  22           HA       THR  22  71.938  11.976 -15.968
  158    HB   THR  22           HB       THR  22  71.971  14.092 -15.086
  159    HG1  THR  22           HG1      THR  22  74.049  14.047 -14.825
  160   HG21  THR  22          HG21      THR  22  71.615  12.703 -12.430
  161   HG22  THR  22          HG22      THR  22  70.483  13.761 -13.272
  162   HG23  THR  22          HG23      THR  22  71.936  14.434 -12.534
  163    HA   PRO  23           HA       PRO  23  75.187   9.083 -15.280
  164    HB2  PRO  23           HB2      PRO  23  77.014  11.457 -15.087
  165    HB3  PRO  23           HB1      PRO  23  77.200   9.969 -16.036
  166    HG2  PRO  23           HG2      PRO  23  76.394  12.277 -17.138
  167    HG3  PRO  23           HG1      PRO  23  75.823  10.702 -17.708
  168    HD2  PRO  23           HD2      PRO  23  74.339  12.796 -16.249
  169    HD3  PRO  23           HD1      PRO  23  73.716  11.439 -17.211
  170    H    ARG  24           HN       ARG  24  76.497   8.244 -13.545
  171    HA   ARG  24           HA       ARG  24  75.746   9.180 -10.910
  172    HE   ARG  24           HE       ARG  24  77.441   3.960 -12.480
  173    HB2  ARG  24           HB2      ARG  24  77.549   7.464 -10.207
  174    HB3  ARG  24           HB1      ARG  24  76.138   6.850 -11.068
  175    HG2  ARG  24           HG2      ARG  24  77.339   6.702 -13.128
  176    HG3  ARG  24           HG1      ARG  24  78.688   7.643 -12.489
  177    HD2  ARG  24           HD2      ARG  24  79.388   5.352 -12.442
  178    HD3  ARG  24           HD1      ARG  24  79.012   5.789 -10.775
  179   HH11  ARG  24          HH21      ARG  24  77.773   5.839  -9.609
  180   HH12  ARG  24          HH22      ARG  24  76.567   4.957  -8.732
  181   HH21  ARG  24          HH11      ARG  24  75.864   2.797 -11.352
  182   HH22  ARG  24          HH12      ARG  24  75.487   3.235  -9.720
  183    H    LYS  25           HN       LYS  25  77.478  10.873 -12.864
  184    HA   LYS  25           HA       LYS  25  80.047  11.210 -11.632
  185    HB2  LYS  25           HB2      LYS  25  80.129  13.339 -12.857
  186    HB3  LYS  25           HB1      LYS  25  79.502  12.059 -13.897
  187    HG2  LYS  25           HG2      LYS  25  77.166  12.810 -13.184
  188    HG3  LYS  25           HG1      LYS  25  77.940  14.236 -12.492
  189    HD2  LYS  25           HD2      LYS  25  78.434  13.411 -15.353
  190    HD3  LYS  25           HD1      LYS  25  77.065  14.432 -14.911
  191    HE2  LYS  25           HE2      LYS  25  79.992  15.026 -14.388
  192    HE3  LYS  25           HE1      LYS  25  78.947  15.849 -15.546
  193    HZ1  LYS  25           HZ1      LYS  25  78.910  17.224 -13.700
  194    HZ2  LYS  25           HZ2      LYS  25  78.864  15.931 -12.598
  195    HZ3  LYS  25           HZ3      LYS  25  77.487  16.318 -13.516
  196    H    GLY  26           HN       GLY  26  80.154  13.978 -11.077
  197    HA2  GLY  26           HA2      GLY  26  78.470  15.340  -9.513
  198    HA3  GLY  26           HA1      GLY  26  78.831  13.997  -8.428
  199    HA   PRO  27           HA       PRO  27  81.787  17.650  -7.731
  200    HB2  PRO  27           HB2      PRO  27  81.551  16.250  -5.088
  201    HB3  PRO  27           HB1      PRO  27  81.666  17.988  -5.435
  202    HG2  PRO  27           HG2      PRO  27  79.343  16.838  -4.822
  203    HG3  PRO  27           HG1      PRO  27  79.447  18.157  -6.000
  204    HD2  PRO  27           HD2      PRO  27  78.931  15.268  -6.465
  205    HD3  PRO  27           HD1      PRO  27  78.477  16.671  -7.458
  206    HA   PRO  28           HA       PRO  28  85.295  14.992  -8.655
  207    HB2  PRO  28           HB2      PRO  28  86.706  17.086  -7.034
  208    HB3  PRO  28           HB1      PRO  28  87.149  16.391  -8.606
  209    HG2  PRO  28           HG2      PRO  28  86.020  18.805  -8.397
  210    HG3  PRO  28           HG1      PRO  28  85.684  17.726  -9.760
  211    HD2  PRO  28           HD2      PRO  28  83.916  18.494  -7.508
  212    HD3  PRO  28           HD1      PRO  28  83.488  17.880  -9.120
  213    H    LYS  29           HN       LYS  29  86.570  13.452  -7.528
  214    HA   LYS  29           HA       LYS  29  87.146  12.049  -5.743
  215    HB2  LYS  29           HB2      LYS  29  86.797  14.448  -3.940
  216    HB3  LYS  29           HB1      LYS  29  87.911  13.094  -3.758
  217    HG2  LYS  29           HG2      LYS  29  89.009  13.851  -5.921
  218    HG3  LYS  29           HG1      LYS  29  88.035  15.317  -5.808
  219    HD2  LYS  29           HD2      LYS  29  88.986  15.587  -3.444
  220    HD3  LYS  29           HD1      LYS  29  90.154  14.341  -3.886
  221    HE2  LYS  29           HE2      LYS  29  91.249  16.378  -4.405
  222    HE3  LYS  29           HE1      LYS  29  90.648  15.797  -5.958
  223    HZ1  LYS  29           HZ1      LYS  29  89.881  18.123  -4.444
  224    HZ2  LYS  29           HZ2      LYS  29  88.562  17.216  -5.013
  225    HZ3  LYS  29           HZ3      LYS  29  89.723  17.808  -6.103
  226    H1U  RCY  30           H1U      RCY  30  80.080   5.268  -6.390
  227    H1S  RCY  30           H1S      RCY  30  83.407   8.634  -6.040
  228    HB1  RCY  30           HB1      RCY  30  82.688  10.896  -6.142
  229    HB2  RCY  30           HB2      RCY  30  81.483  10.830  -4.857
  230    HA   RCY  30           HA       RCY  30  82.089  13.129  -5.038
  231    HN1  RCY  30           HN1      RCY  30  84.176  13.386  -6.126
  232    H    LYS  31           HN       LYS  31  84.078  14.206  -3.281
  233    HA   LYS  31           HA       LYS  31  84.414  14.598  -0.999
  234    HB2  LYS  31           HB2      LYS  31  81.856  13.005  -0.647
  235    HB3  LYS  31           HB1      LYS  31  82.551  14.151   0.495
  236    HG2  LYS  31           HG2      LYS  31  81.930  15.067  -2.296
  237    HG3  LYS  31           HG1      LYS  31  80.618  14.925  -1.125
  238    HD2  LYS  31           HD2      LYS  31  83.131  16.341  -0.310
  239    HD3  LYS  31           HD1      LYS  31  81.974  17.187  -1.338
  240    HE2  LYS  31           HE2      LYS  31  81.027  15.755   1.133
  241    HE3  LYS  31           HE1      LYS  31  81.725  17.370   1.260
  242    HZ1  LYS  31           HZ1      LYS  31  79.243  16.511  -0.036
  243    HZ2  LYS  31           HZ2      LYS  31  80.081  17.828  -0.707
  244    HZ3  LYS  31           HZ3      LYS  31  79.550  17.888   0.906
  245    H    GLN  32           HN       GLN  32  85.645  13.597   0.561
  246    HA   GLN  32           HA       GLN  32  86.886  11.878   1.565
  247    HB2  GLN  32           HB2      GLN  32  84.447  11.326   2.241
  248    HB3  GLN  32           HB1      GLN  32  84.534  10.068   1.008
  249    HG2  GLN  32           HG2      GLN  32  86.560   9.151   2.117
  250    HG3  GLN  32           HG1      GLN  32  86.402  10.374   3.378
  251   HE21  GLN  32          HE21      GLN  32  83.451   9.068   2.028
  252   HE22  GLN  32          HE22      GLN  32  83.043   8.091   3.355
  253    H    ARG  33           HN       ARG  33  88.495  11.589  -0.009
  254    HA   ARG  33           HA       ARG  33  88.104  10.175  -2.475
  255    HE   ARG  33           HE       ARG  33  92.474  10.284  -1.244
  256    HB2  ARG  33           HB2      ARG  33  90.029  11.731  -1.909
  257    HB3  ARG  33           HB1      ARG  33  90.705  10.418  -0.944
  258    HG2  ARG  33           HG2      ARG  33  90.773   8.965  -2.915
  259    HG3  ARG  33           HG1      ARG  33  90.025  10.228  -3.894
  260    HD2  ARG  33           HD2      ARG  33  92.584  10.025  -4.036
  261    HD3  ARG  33           HD1      ARG  33  91.932  11.635  -3.730
  262   HH11  ARG  33          HH21      ARG  33  93.914  11.863  -3.950
  263   HH12  ARG  33          HH22      ARG  33  95.307  12.393  -3.068
  264   HH21  ARG  33          HH11      ARG  33  94.285  10.967  -0.077
  265   HH22  ARG  33          HH12      ARG  33  95.518  11.886  -0.875
  266    H    GLN  34           HN       GLN  34  87.814   8.021  -2.758
  267    HA   GLN  34           HA       GLN  34  89.173   6.109  -0.951
  268    HB2  GLN  34           HB2      GLN  34  86.170   6.097  -1.397
  269    HB3  GLN  34           HB1      GLN  34  87.083   4.865  -0.525
  270    HG2  GLN  34           HG2      GLN  34  87.918   6.760   0.981
  271    HG3  GLN  34           HG1      GLN  34  86.665   7.758   0.244
  272   HE21  GLN  34          HE21      GLN  34  87.027   4.556   1.873
  273   HE22  GLN  34          HE22      GLN  34  85.510   4.609   2.633
  274    H    THR  35           HN       THR  35  90.271   5.996  -3.157
  275    HA   THR  35           HA       THR  35  88.823   4.869  -5.393
  276    HB   THR  35           HB       THR  35  91.805   4.729  -4.871
  277    HG1  THR  35           HG1      THR  35  91.934   6.750  -5.554
  278   HG21  THR  35          HG21      THR  35  90.249   4.871  -7.465
  279   HG22  THR  35          HG22      THR  35  90.824   3.366  -6.748
  280   HG23  THR  35          HG23      THR  35  91.979   4.589  -7.277
  281    H    ARG  36           HN       ARG  36  90.608   3.523  -2.668
  282    HA   ARG  36           HA       ARG  36  89.344   0.946  -3.003
  283    HE   ARG  36           HE       ARG  36  93.606  -0.239  -5.282
  284    HB2  ARG  36           HB2      ARG  36  91.813   1.406  -4.426
  285    HB3  ARG  36           HB1      ARG  36  92.095   0.209  -3.163
  286    HG2  ARG  36           HG2      ARG  36  90.288  -1.176  -3.978
  287    HG3  ARG  36           HG1      ARG  36  89.787   0.069  -5.123
  288    HD2  ARG  36           HD2      ARG  36  91.304  -1.941  -5.927
  289    HD3  ARG  36           HD1      ARG  36  91.592  -0.312  -6.539
  290   HH11  ARG  36          HH21      ARG  36  91.593  -2.912  -4.453
  291   HH12  ARG  36          HH22      ARG  36  92.801  -3.693  -3.488
  292   HH21  ARG  36          HH11      ARG  36  95.195  -1.244  -4.027
  293   HH22  ARG  36          HH12      ARG  36  94.840  -2.749  -3.247
  294    H    GLN  37           HN       GLN  37  90.134   3.141  -1.022
  295    HA   GLN  37           HA       GLN  37  91.853   1.723   0.892
  296    HB2  GLN  37           HB2      GLN  37  90.328   4.337   1.016
  297    HB3  GLN  37           HB1      GLN  37  91.273   3.707   2.366
  298    HG2  GLN  37           HG2      GLN  37  92.444   4.086  -0.397
  299    HG3  GLN  37           HG1      GLN  37  92.490   5.348   0.834
  300   HE21  GLN  37          HE21      GLN  37  94.462   3.081  -0.433
  301   HE22  GLN  37          HE22      GLN  37  95.355   2.638   0.941
  302    H1U  RCY  38           H1U      RCY  38  83.890  -4.643  -1.935
  303    H1S  RCY  38           H1S      RCY  38  84.287  -2.042   1.839
  304    HB1  RCY  38           HB1      RCY  38  87.784  -0.721   0.628
  305    HB2  RCY  38           HB2      RCY  38  86.976   0.433   1.688
  306    HA   RCY  38           HA       RCY  38  88.586   0.185   3.389
  307    HN1  RCY  38           HN1      RCY  38  90.549  -0.185   1.252
  308    H    LYS  39           HN       LYS  39  88.567  -1.622   4.707
  309    HA   LYS  39           HA       LYS  39  90.603  -3.566   4.497
  310    HB2  LYS  39           HB2      LYS  39  87.972  -3.564   5.989
  311    HB3  LYS  39           HB1      LYS  39  89.134  -4.881   6.139
  312    HG2  LYS  39           HG2      LYS  39  90.113  -2.071   6.485
  313    HG3  LYS  39           HG1      LYS  39  89.215  -2.818   7.806
  314    HD2  LYS  39           HD2      LYS  39  90.779  -4.740   7.769
  315    HD3  LYS  39           HD1      LYS  39  91.695  -3.956   6.480
  316    HE2  LYS  39           HE2      LYS  39  92.641  -3.602   8.799
  317    HE3  LYS  39           HE1      LYS  39  92.288  -2.115   7.918
  318    HZ1  LYS  39           HZ1      LYS  39  90.525  -1.632   9.243
  319    HZ2  LYS  39           HZ2      LYS  39  91.466  -2.487  10.370
  320    HZ3  LYS  39           HZ3      LYS  39  90.172  -3.256   9.583
  321    H    SER  40           HN       SER  40  89.541  -6.079   4.741
  322    HA   SER  40           HA       SER  40  88.781  -6.656   1.968
  323    HG   SER  40           HG       SER  40  91.074  -7.793   4.062
  324    HB2  SER  40           HB2      SER  40  89.105  -8.544   4.318
  325    HB3  SER  40           HB1      SER  40  89.013  -9.001   2.620
  326    H    LYS  41           HN       LYS  41  86.980  -8.451   1.758
  327    HA   LYS  41           HA       LYS  41  84.630  -7.606   3.418
  328    HB2  LYS  41           HB2      LYS  41  84.711  -8.409   0.492
  329    HB3  LYS  41           HB1      LYS  41  83.243  -8.063   1.406
  330    HG2  LYS  41           HG2      LYS  41  83.590  -5.962   0.536
  331    HG3  LYS  41           HG1      LYS  41  84.614  -5.817   1.965
  332    HD2  LYS  41           HD2      LYS  41  86.091  -5.137   0.302
  333    HD3  LYS  41           HD1      LYS  41  86.449  -6.863   0.378
  334    HE2  LYS  41           HE2      LYS  41  86.168  -6.448  -1.931
  335    HE3  LYS  41           HE1      LYS  41  84.617  -7.120  -1.431
  336    HZ1  LYS  41           HZ1      LYS  41  84.833  -4.861  -2.783
  337    HZ2  LYS  41           HZ2      LYS  41  84.921  -4.235  -1.207
  338    HZ3  LYS  41           HZ3      LYS  41  83.574  -5.153  -1.685
  339    HA   PRO  42           HA       PRO  42  85.151 -12.164   3.870
  340    HB2  PRO  42           HB2      PRO  42  85.032 -12.269   6.577
  341    HB3  PRO  42           HB1      PRO  42  86.521 -11.842   5.712
  342    HG2  PRO  42           HG2      PRO  42  84.601 -10.095   7.143
  343    HG3  PRO  42           HG1      PRO  42  86.359  -9.958   6.989
  344    HD2  PRO  42           HD2      PRO  42  84.480  -8.505   5.497
  345    HD3  PRO  42           HD1      PRO  42  86.198  -8.697   5.088
  346    HA   PRO  43           HA       PRO  43  80.877 -13.229   4.234
  347    HB2  PRO  43           HB2      PRO  43  81.030 -15.544   5.789
  348    HB3  PRO  43           HB1      PRO  43  81.284 -15.473   4.036
  349    HG2  PRO  43           HG2      PRO  43  83.279 -15.557   6.231
  350    HG3  PRO  43           HG1      PRO  43  83.330 -16.301   4.624
  351    HD2  PRO  43           HD2      PRO  43  84.747 -14.062   5.211
  352    HD3  PRO  43           HD1      PRO  43  84.067 -14.347   3.592
  353    H    LYS  44           HN       LYS  44  79.090 -13.565   5.847
  354    HA   LYS  44           HA       LYS  44  79.058 -11.685   7.903
  355    HB2  LYS  44           HB2      LYS  44  77.524 -14.247   7.491
  356    HB3  LYS  44           HB1      LYS  44  77.248 -13.264   8.929
  357    HG2  LYS  44           HG2      LYS  44  77.249 -11.927   6.244
  358    HG3  LYS  44           HG1      LYS  44  75.825 -12.842   6.739
  359    HD2  LYS  44           HD2      LYS  44  77.035 -10.892   8.669
  360    HD3  LYS  44           HD1      LYS  44  76.034 -10.280   7.352
  361    HE2  LYS  44           HE2      LYS  44  74.121 -11.391   8.114
  362    HE3  LYS  44           HE1      LYS  44  75.054 -12.571   9.035
  363    HZ1  LYS  44           HZ1      LYS  44  75.726 -10.765  10.532
  364    HZ2  LYS  44           HZ2      LYS  44  74.043 -10.996  10.519
  365    HZ3  LYS  44           HZ3      LYS  44  74.730  -9.690   9.677
  366    H    LYS  45           HN       LYS  45  78.617 -12.481  10.344
  367    HA   LYS  45           HA       LYS  45  79.706 -13.148  12.312
  368    HB2  LYS  45           HB2      LYS  45  80.267 -15.548  10.543
  369    HB3  LYS  45           HB1      LYS  45  80.559 -15.506  12.282
  370    HG2  LYS  45           HG2      LYS  45  78.237 -15.227  12.765
  371    HG3  LYS  45           HG1      LYS  45  77.857 -14.873  11.079
  372    HD2  LYS  45           HD2      LYS  45  77.226 -17.193  11.693
  373    HD3  LYS  45           HD1      LYS  45  78.465 -17.163  10.438
  374    HE2  LYS  45           HE2      LYS  45  78.811 -18.782  12.432
  375    HE3  LYS  45           HE1      LYS  45  80.176 -17.778  11.943
  376    HZ1  LYS  45           HZ1      LYS  45  79.618 -17.858  14.401
  377    HZ2  LYS  45           HZ2      LYS  45  78.264 -16.904  14.022
  378    HZ3  LYS  45           HZ3      LYS  45  79.830 -16.322  13.715
  379    H    GLY  46           HN       GLY  46  81.212 -11.296  11.221
  380    HA2  GLY  46           HA2      GLY  46  83.957 -12.241  11.705
  381    HA3  GLY  46           HA1      GLY  46  83.659 -11.594  10.091
  382    H    VAL  47           HN       VAL  47  85.368 -10.494  12.251
  383    HA   VAL  47           HA       VAL  47  85.847  -8.407  13.207
  384    HB   VAL  47           HB       VAL  47  83.805  -7.434  11.186
  385   HG11  VAL  47          HG11      VAL  47  85.322  -5.373  11.318
  386   HG12  VAL  47          HG12      VAL  47  86.004  -6.097  12.774
  387   HG13  VAL  47          HG13      VAL  47  84.293  -5.673  12.719
  388   HG21  VAL  47          HG21      VAL  47  85.898  -7.003   9.810
  389   HG22  VAL  47          HG22      VAL  47  85.479  -8.705  10.010
  390   HG23  VAL  47          HG23      VAL  47  86.775  -7.997  10.974
  391    H    GLN  48           HN       GLN  48  84.868  -6.640  14.533
  392    HA   GLN  48           HA       GLN  48  82.585  -7.681  16.046
  393    HB2  GLN  48           HB2      GLN  48  82.973  -5.639  17.462
  394    HB3  GLN  48           HB1      GLN  48  84.400  -6.661  17.292
  395    HG2  GLN  48           HG2      GLN  48  85.173  -5.188  15.421
  396    HG3  GLN  48           HG1      GLN  48  83.804  -4.123  15.743
  397   HE21  GLN  48          HE21      GLN  48  84.035  -4.678  18.727
  398   HE22  GLN  48          HE22      GLN  48  85.364  -3.753  19.235
  399    H    GLY  49           HN       GLY  49  81.643  -7.208  13.542
  400    HA2  GLY  49           HA2      GLY  49  79.556  -6.214  12.846
  401    HA3  GLY  49           HA1      GLY  49  79.827  -4.902  13.994
  402    H1U  RCY  50           H1U      RCY  50  83.229   1.897   7.845
  403    H1S  RCY  50           H1S      RCY  50  78.898   0.136   9.088
  404    HB1  RCY  50           HB1      RCY  50  80.328  -3.402   9.826
  405    HB2  RCY  50           HB2      RCY  50  81.118  -1.910   9.321
  406    HA   RCY  50           HA       RCY  50  82.532  -2.966  10.972
  407    HN1  RCY  50           HN1      RCY  50  80.698  -3.025  13.209
  408    H    GLY  51           HN       GLY  51  83.839  -1.453  11.906
  409    HA2  GLY  51           HA2      GLY  51  84.487   0.514  13.029
  410    HA3  GLY  51           HA1      GLY  51  83.331   1.275  11.936
  411    H    ASP  52           HN       ASP  52  83.380  -0.585  14.996
  412    HA   ASP  52           HA       ASP  52  80.819   0.590  15.817
  413    HB2  ASP  52           HB2      ASP  52  81.185  -0.698  17.902
  414    HB3  ASP  52           HB1      ASP  52  81.382  -1.716  16.474
  415    H    ASP  53           HN       ASP  53  83.504   2.137  15.422
  416    HA   ASP  53           HA       ASP  53  84.190   3.159  18.036
  417    HB2  ASP  53           HB2      ASP  53  85.689   3.288  16.033
  418    HB3  ASP  53           HB1      ASP  53  84.592   4.479  15.334
  419    H    ILE  54           HN       ILE  54  82.980   5.236  15.427
  420    HA   ILE  54           HA       ILE  54  81.143   6.498  17.419
  421    HB   ILE  54           HB       ILE  54  82.420   7.617  14.910
  422   HG12  ILE  54          HG12      ILE  54  82.757   8.407  17.819
  423   HG13  ILE  54          HG11      ILE  54  83.871   7.345  16.956
  424   HG21  ILE  54          HG21      ILE  54  81.391   9.776  15.761
  425   HG22  ILE  54          HG22      ILE  54  80.431   8.794  16.867
  426   HG23  ILE  54          HG23      ILE  54  80.238   8.604  15.124
  427   HD11  ILE  54          HD11      ILE  54  83.184  10.194  16.174
  428   HD12  ILE  54          HD12      ILE  54  84.284   9.130  15.297
  429   HD13  ILE  54          HD13      ILE  54  84.690   9.668  16.927
  430    HA   PRO  55           HA       PRO  55  78.052   4.734  14.632
  431    HB2  PRO  55           HB2      PRO  55  75.850   5.325  16.106
  432    HB3  PRO  55           HB1      PRO  55  76.963   4.014  16.547
  433    HG2  PRO  55           HG2      PRO  55  76.744   6.757  17.676
  434    HG3  PRO  55           HG1      PRO  55  77.061   5.220  18.496
  435    HD2  PRO  55           HD2      PRO  55  79.025   7.060  17.846
  436    HD3  PRO  55           HD1      PRO  55  79.326   5.326  18.092
  437    H    GLY  56           HN       GLY  56  78.542   6.480  13.039
  438    HA2  GLY  56           HA2      GLY  56  77.411   7.975  11.541
  439    HA3  GLY  56           HA1      GLY  56  76.261   8.353  12.825
  440    H    MET  57           HN       MET  57  79.176   9.320  11.282
  441    HA   MET  57           HA       MET  57  80.465  10.854  13.257
  442    HB2  MET  57           HB2      MET  57  80.114  11.843  10.423
  443    HB3  MET  57           HB1      MET  57  81.505  12.044  11.488
  444    HG2  MET  57           HG2      MET  57  80.559   9.495  10.157
  445    HG3  MET  57           HG1      MET  57  82.092  10.331   9.911
  446    HE1  MET  57           HE1      MET  57  80.683   7.248  11.467
  447    HE2  MET  57           HE2      MET  57  82.336   6.759  11.831
  448    HE3  MET  57           HE3      MET  57  81.960   7.474  10.265
  449    H    GLU  58           HN       GLU  58  78.479  12.477  10.774
  450    HA   GLU  58           HA       GLU  58  77.851  14.631  12.627
  451    HB2  GLU  58           HB2      GLU  58  76.490  14.094   9.979
  452    HB3  GLU  58           HB1      GLU  58  76.707  15.643  10.794
  453    HG2  GLU  58           HG2      GLU  58  78.895  13.920   9.595
  454    HG3  GLU  58           HG1      GLU  58  78.321  15.469   8.975
  455    H    GLY  59           HN       GLY  59  76.075  11.886  11.232
  456    HA2  GLY  59           HA2      GLY  59  74.493  11.006  13.166
  457    HA3  GLY  59           HA1      GLY  59  73.717  12.569  12.905
  458    H1U  RCY  60           H1U      RCY  60  73.263  10.021   2.146
  459    H1S  RCY  60           H1S      RCY  60  75.295  11.385   5.362
  460    HB1  RCY  60           HB1      RCY  60  74.112  12.280   7.710
  461    HB2  RCY  60           HB2      RCY  60  73.377  10.968   6.787
  462    HA   RCY  60           HA       RCY  60  72.335  10.951   8.949
  463    HN1  RCY  60           HN1      RCY  60  74.992  11.579   9.995
  464    H    GLY  61           HN       GLY  61  75.223   9.176   9.859
  465    HA2  GLY  61           HA2      GLY  61  74.969   6.765   8.519
  466    HA3  GLY  61           HA1      GLY  61  75.457   6.854  10.212
  467    H    THR  62           HN       THR  62  73.266   7.596  11.554
  468    HA   THR  62           HA       THR  62  71.368   6.602  12.533
  469    HB   THR  62           HB       THR  62  69.509   6.258  10.775
  470    HG1  THR  62           HG1      THR  62  70.502   7.685   8.880
  471   HG21  THR  62          HG21      THR  62  69.682   8.304  12.076
  472   HG22  THR  62          HG22      THR  62  69.335   8.725  10.399
  473   HG23  THR  62          HG23      THR  62  70.972   8.900  11.031
  474    H    ASP  63           HN       ASP  63  71.731   4.571  13.362
  475    HA   ASP  63           HA       ASP  63  72.624   2.286  12.012
  476    HB2  ASP  63           HB2      ASP  63  71.341   0.994  13.808
  477    HB3  ASP  63           HB1      ASP  63  72.478   2.204  14.403
  478    H    ILE  64           HN       ILE  64  69.301   3.490  12.361
  479    HA   ILE  64           HA       ILE  64  68.469   2.395   9.866
  480    HB   ILE  64           HB       ILE  64  68.504   0.214  10.791
  481   HG12  ILE  64          HG12      ILE  64  65.675   0.852  11.496
  482   HG13  ILE  64          HG11      ILE  64  66.206   1.252   9.862
  483   HG21  ILE  64          HG21      ILE  64  68.851   0.731  13.117
  484   HG22  ILE  64          HG22      ILE  64  67.381  -0.239  13.017
  485   HG23  ILE  64          HG23      ILE  64  67.272   1.508  13.237
  486   HD11  ILE  64          HD11      ILE  64  66.980  -1.059   9.531
  487   HD12  ILE  64          HD12      ILE  64  65.273  -1.040   9.973
  488   HD13  ILE  64          HD13      ILE  64  66.490  -1.468  11.175
  489    H    THR  65           HN       THR  65  67.863   4.707  10.054
  490    HA   THR  65           HA       THR  65  65.833   5.569  11.886
  491    HB   THR  65           HB       THR  65  66.528   6.574   9.103
  492    HG1  THR  65           HG1      THR  65  67.256   7.363  11.725
  493   HG21  THR  65          HG21      THR  65  64.635   7.561  11.221
  494   HG22  THR  65          HG22      THR  65  64.384   7.438   9.480
  495   HG23  THR  65          HG23      THR  65  65.423   8.704  10.133
  496    H    VAL  66           HN       VAL  66  65.805   3.679   8.979
  497    HA   VAL  66           HA       VAL  66  62.916   3.212   9.333
  498    HB   VAL  66           HB       VAL  66  63.846   3.787   6.535
  499   HG11  VAL  66          HG11      VAL  66  61.560   2.793   7.322
  500   HG12  VAL  66          HG12      VAL  66  61.557   4.073   6.109
  501   HG13  VAL  66          HG13      VAL  66  61.194   4.452   7.793
  502   HG21  VAL  66          HG21      VAL  66  62.939   5.863   8.556
  503   HG22  VAL  66          HG22      VAL  66  63.152   6.151   6.830
  504   HG23  VAL  66          HG23      VAL  66  64.545   5.758   7.836
  505    H    ILE  67           HN       ILE  67  65.042   2.493   6.557
  506    HA   ILE  67           HA       ILE  67  65.064  -0.368   7.396
  507    HB   ILE  67           HB       ILE  67  64.474   0.515   4.563
  508   HG12  ILE  67          HG12      ILE  67  62.560  -0.396   6.737
  509   HG13  ILE  67          HG11      ILE  67  62.632   1.222   6.037
  510   HG21  ILE  67          HG21      ILE  67  64.046  -1.776   4.152
  511   HG22  ILE  67          HG22      ILE  67  63.930  -2.150   5.872
  512   HG23  ILE  67          HG23      ILE  67  65.499  -1.785   5.152
  513   HD11  ILE  67          HD11      ILE  67  61.889  -1.352   4.623
  514   HD12  ILE  67          HD12      ILE  67  62.185   0.171   3.783
  515   HD13  ILE  67          HD13      ILE  67  60.848   0.039   4.925
  516    H1U  RCY  68           H1U      RCY  68  72.208   3.391   2.392
  517    H1S  RCY  68           H1S      RCY  68  71.071   3.538   6.788
  518    HB1  RCY  68           HB1      RCY  68  70.860  -0.175   7.446
  519    HB2  RCY  68           HB2      RCY  68  69.480  -0.311   8.530
  520    HA   RCY  68           HA       RCY  68  69.111   0.623   5.688
  521    HN1  RCY  68           HN1      RCY  68  67.289  -0.374   7.807
  522    HA   PRO  69           HA       PRO  69  70.161  -3.025   3.479
  523    HB2  PRO  69           HB2      PRO  69  72.697  -3.010   5.097
  524    HB3  PRO  69           HB1      PRO  69  72.478  -3.323   3.362
  525    HG2  PRO  69           HG2      PRO  69  73.260  -0.932   4.305
  526    HG3  PRO  69           HG1      PRO  69  72.254  -1.099   2.858
  527    HD2  PRO  69           HD2      PRO  69  71.529   0.011   5.477
  528    HD3  PRO  69           HD1      PRO  69  70.645   0.109   3.938
  529    H    TRP  70           HN       TRP  70  71.314  -3.365   6.878
  530    HA   TRP  70           HA       TRP  70  70.812  -6.214   6.888
  531    HD1  TRP  70           HD1      TRP  70  69.342  -3.332   9.399
  532    HE1  TRP  70           HE1      TRP  70  70.229  -1.008  10.071
  533    HE3  TRP  70           HE3      TRP  70  74.359  -4.113   8.855
  534    HZ2  TRP  70           HZ2      TRP  70  72.740   0.345  10.343
  535    HZ3  TRP  70           HZ3      TRP  70  75.972  -2.295   9.325
  536    HH2  TRP  70           HH2      TRP  70  75.173  -0.070  10.067
  537    HB2  TRP  70           HB2      TRP  70  70.939  -5.803   9.471
  538    HB3  TRP  70           HB1      TRP  70  72.386  -5.561   8.496
  539    H    GLU  71           HN       GLU  71  68.533  -4.728   5.961
  540    HA   GLU  71           HA       GLU  71  66.491  -5.930   7.647
  541    HB2  GLU  71           HB2      GLU  71  67.228  -3.148   8.061
  542    HB3  GLU  71           HB1      GLU  71  65.555  -3.266   7.517
  543    HG2  GLU  71           HG2      GLU  71  66.665  -4.988   9.744
  544    HG3  GLU  71           HG1      GLU  71  65.911  -3.421  10.041
  545    H    ALA  72           HN       ALA  72  67.430  -3.951   4.904
  546    HA   ALA  72           HA       ALA  72  64.812  -4.028   3.632
  547    HB1  ALA  72           HB1      ALA  72  66.246  -2.225   2.989
  548    HB2  ALA  72           HB2      ALA  72  66.172  -3.299   1.593
  549    HB3  ALA  72           HB3      ALA  72  67.585  -3.321   2.648
  550    H1U  RCY  73           H1U      RCY  73  70.131  -2.496   3.541
  551    H1S  RCY  73           H1S      RCY  73  69.645  -5.317   0.195
  552    HB1  RCY  73           HB1      RCY  73  67.442  -7.458  -0.998
  553    HB2  RCY  73           HB2      RCY  73  68.818  -7.002   0.007
  554    HA   RCY  73           HA       RCY  73  65.957  -7.382   0.762
  555    HN1  RCY  73           HN1      RCY  73  67.335  -4.958   1.518
  556    H    ASN  74           HN       ASN  74  69.341  -7.067   1.883
  557    HA   ASN  74           HA       ASN  74  69.134  -8.828   4.092
  558    HB2  ASN  74           HB2      ASN  74  69.300 -10.133   1.443
  559    HB3  ASN  74           HB1      ASN  74  70.490 -10.709   2.609
  560   HD21  ASN  74          HD21      ASN  74  69.129 -10.637   5.019
  561   HD22  ASN  74          HD22      ASN  74  67.756 -11.633   4.958
  562    H    HIS  75           HN       HIS  75  71.519  -9.966   4.338
  563    HA   HIS  75           HA       HIS  75  73.363  -7.688   4.245
  564    HD1  HIS  75           HD1      HIS  75  75.251 -11.631   4.228
  565    HD2  HIS  75           HD2      HIS  75  71.623 -11.270   6.255
  566    HE1  HIS  75           HE1      HIS  75  74.275 -13.964   4.369
  567    HE2  HIS  75           HE2      HIS  75  72.066 -13.758   5.601
  568    HB2  HIS  75           HB2      HIS  75  74.926  -9.325   5.380
  569    HB3  HIS  75           HB1      HIS  75  73.410  -9.047   6.236
  570    H1U  RCY  76           H1U      RCY  76  74.898  -3.188   5.111
  571    H1S  RCY  76           H1S      RCY  76  74.424  -6.799   1.952
  572    HB1  RCY  76           HB1      RCY  76  75.117  -7.196  -0.139
  573    HB2  RCY  76           HB2      RCY  76  76.192  -8.538  -0.524
  574    HA   RCY  76           HA       RCY  76  73.684  -9.078  -0.378
  575    HN1  RCY  76           HN1      RCY  76  72.843  -8.204   1.665
  576    H    GLU  77           HN       GLU  77  73.277 -11.349  -0.157
  577    HA   GLU  77           HA       GLU  77  74.960 -13.139   1.303
  578    HB2  GLU  77           HB2      GLU  77  72.610 -13.444   0.018
  579    HB3  GLU  77           HB1      GLU  77  73.679 -14.105  -1.218
  580    HG2  GLU  77           HG2      GLU  77  74.710 -15.548   0.601
  581    HG3  GLU  77           HG1      GLU  77  73.395 -15.024   1.654
  582    H    LEU  78           HN       LEU  78  75.630 -15.038  -0.789
  583    HA   LEU  78           HA       LEU  78  78.059 -13.678  -1.840
  584    HG   LEU  78           HG       LEU  78  79.258 -16.516   0.075
  585    HB2  LEU  78           HB2      LEU  78  77.315 -16.540  -1.270
  586    HB3  LEU  78           HB1      LEU  78  78.604 -16.194  -2.419
  587   HD11  LEU  78          HD11      LEU  78  80.830 -14.431  -0.146
  588   HD12  LEU  78          HD12      LEU  78  80.088 -14.262  -1.737
  589   HD13  LEU  78          HD13      LEU  78  80.966 -15.735  -1.325
  590   HD21  LEU  78          HD21      LEU  78  78.459 -13.609   0.236
  591   HD22  LEU  78          HD22      LEU  78  78.910 -14.697   1.549
  592   HD23  LEU  78          HD23      LEU  78  77.354 -14.887   0.741
  593    H    HIS  79           HN       HIS  79  77.984 -13.001  -3.909
  594    HA   HIS  79           HA       HIS  79  77.138 -12.716  -6.091
  595    HD1  HIS  79           HD1      HIS  79  78.643 -16.128  -4.158
  596    HD2  HIS  79           HD2      HIS  79  75.917 -17.053  -7.176
  597    HE1  HIS  79           HE1      HIS  79  77.767 -18.448  -3.644
  598    HE2  HIS  79           HE2      HIS  79  76.106 -19.023  -5.474
  599    HB2  HIS  79           HB2      HIS  79  77.441 -14.718  -7.471
  600    HB3  HIS  79           HB1      HIS  79  78.772 -14.565  -6.326
  601    H    GLU  80           HN       GLU  80  74.978 -12.036  -5.654
  602    HA   GLU  80           HA       GLU  80  72.945 -13.884  -6.608
  603    HB2  GLU  80           HB2      GLU  80  73.283 -14.407  -4.100
  604    HB3  GLU  80           HB1      GLU  80  72.540 -12.836  -3.804
  605    HG2  GLU  80           HG2      GLU  80  70.714 -14.333  -3.749
  606    HG3  GLU  80           HG1      GLU  80  70.652 -13.658  -5.377
  607    H    LEU  81           HN       LEU  81  72.891 -11.036  -4.427
  608    HA   LEU  81           HA       LEU  81  71.056  -9.702  -6.339
  609    HG   LEU  81           HG       LEU  81  71.050 -10.810  -3.162
  610    HB2  LEU  81           HB2      LEU  81  71.987  -8.665  -3.652
  611    HB3  LEU  81           HB1      LEU  81  70.558  -8.175  -4.562
  612   HD11  LEU  81          HD11      LEU  81  69.086 -10.237  -1.914
  613   HD12  LEU  81          HD12      LEU  81  68.699  -8.910  -3.009
  614   HD13  LEU  81          HD13      LEU  81  70.095  -8.791  -1.937
  615   HD21  LEU  81          HD21      LEU  81  70.103 -11.471  -5.242
  616   HD22  LEU  81          HD22      LEU  81  69.039 -10.066  -5.293
  617   HD23  LEU  81          HD23      LEU  81  68.731 -11.363  -4.139
  618    H    ALA  82           HN       ALA  82  74.124 -10.050  -6.597
  619    HA   ALA  82           HA       ALA  82  75.248  -7.400  -6.398
  620    HB1  ALA  82           HB1      ALA  82  77.110  -8.299  -7.658
  621    HB2  ALA  82           HB2      ALA  82  76.129  -9.645  -8.237
  622    HB3  ALA  82           HB3      ALA  82  76.572  -9.546  -6.534
  623    H    GLN  83           HN       GLN  83  72.722  -7.236  -7.670
  624    HA   GLN  83           HA       GLN  83  72.745  -7.207 -10.494
  625    HB2  GLN  83           HB2      GLN  83  71.267  -5.478  -8.495
  626    HB3  GLN  83           HB1      GLN  83  70.974  -5.394 -10.231
  627    HG2  GLN  83           HG2      GLN  83  70.977  -8.152  -9.325
  628    HG3  GLN  83           HG1      GLN  83  69.802  -7.198  -8.420
  629   HE21  GLN  83          HE21      GLN  83  68.544  -5.567 -10.039
  630   HE22  GLN  83          HE22      GLN  83  67.967  -6.303 -11.455
  631    H    TYR  84           HN       TYR  84  73.758  -5.911 -11.954
  632    HA   TYR  84           HA       TYR  84  75.284  -4.279 -12.720
  633    HD1  TYR  84           HD2      TYR  84  74.378  -2.722 -14.600
  634    HD2  TYR  84           HD1      TYR  84  71.294  -3.389 -11.685
  635    HE1  TYR  84           HE2      TYR  84  72.736  -3.089 -16.422
  636    HE2  TYR  84           HE1      TYR  84  69.652  -3.757 -13.507
  637    HH   TYR  84           HH       TYR  84  69.391  -3.132 -15.898
  638    HB2  TYR  84           HB2      TYR  84  73.419  -2.628 -10.989
  639    HB3  TYR  84           HB1      TYR  84  74.558  -1.953 -12.154
  640    H    GLY  85           HN       GLY  85  75.694  -5.550  -9.895
  641    HA2  GLY  85           HA2      GLY  85  77.620  -3.481  -8.906
  642    HA3  GLY  85           HA1      GLY  85  76.797  -4.622  -7.842
  643    H    ILE  86           HN       ILE  86  78.170  -5.473 -10.988
  644    HA   ILE  86           HA       ILE  86  79.812  -7.525  -9.655
  645    HB   ILE  86           HB       ILE  86  80.477  -7.981 -12.141
  646   HG12  ILE  86          HG12      ILE  86  78.788  -7.141 -13.754
  647   HG13  ILE  86          HG11      ILE  86  78.056  -6.178 -12.470
  648   HG21  ILE  86          HG21      ILE  86  78.877  -9.318 -10.733
  649   HG22  ILE  86          HG22      ILE  86  78.477  -9.316 -12.450
  650   HG23  ILE  86          HG23      ILE  86  77.572  -8.295 -11.332
  651   HD11  ILE  86          HD11      ILE  86  79.894  -4.732 -12.328
  652   HD12  ILE  86          HD12      ILE  86  79.798  -5.046 -14.061
  653   HD13  ILE  86          HD13      ILE  86  80.989  -5.895 -13.075
  654    H1U  RCY  87           H1U      RCY  87  81.691  -1.947  -3.636
  655    H1S  RCY  87           H1S      RCY  87  84.191  -1.978  -6.826
  656    HB1  RCY  87           HB1      RCY  87  81.777  -2.984  -8.268
  657    HB2  RCY  87           HB2      RCY  87  81.514  -2.141  -9.795
  658    HA   RCY  87           HA       RCY  87  82.671  -3.869 -11.026
  659    HN1  RCY  87           HN1      RCY  87  80.344  -4.517  -9.539
  Start of MODEL   14
    1    HA   MET   1           HA       MET   1  66.104 -16.502 -16.810
    2    HB2  MET   1           HB2      MET   1  64.986 -16.984 -14.030
    3    HB3  MET   1           HB1      MET   1  64.060 -17.067 -15.529
    4    HG2  MET   1           HG2      MET   1  66.497 -18.771 -14.941
    5    HG3  MET   1           HG1      MET   1  64.833 -19.311 -14.718
    6    HE1  MET   1           HE1      MET   1  66.506 -21.026 -17.880
    7    HE2  MET   1           HE2      MET   1  65.371 -21.439 -16.597
    8    HE3  MET   1           HE3      MET   1  66.922 -20.710 -16.191
    9    H    ASN   2           HN       ASN   2  64.405 -15.291 -14.056
   10    HA   ASN   2           HA       ASN   2  64.986 -12.471 -14.751
   11    HB2  ASN   2           HB2      ASN   2  62.315 -13.833 -15.108
   12    HB3  ASN   2           HB1      ASN   2  62.418 -12.099 -14.804
   13   HD21  ASN   2          HD21      ASN   2  62.454 -10.906 -16.706
   14   HD22  ASN   2          HD22      ASN   2  63.129 -11.424 -18.175
   15    H    LEU   3           HN       LEU   3  63.370 -11.089 -13.226
   16    HA   LEU   3           HA       LEU   3  63.965 -12.040 -10.504
   17    HG   LEU   3           HG       LEU   3  64.809 -10.211  -9.277
   18    HB2  LEU   3           HB2      LEU   3  64.097  -9.581 -11.547
   19    HB3  LEU   3           HB1      LEU   3  62.417  -9.526 -11.014
   20   HD11  LEU   3          HD11      LEU   3  64.580  -7.802  -9.885
   21   HD12  LEU   3          HD12      LEU   3  64.318  -8.090  -8.165
   22   HD13  LEU   3          HD13      LEU   3  62.941  -7.820  -9.234
   23   HD21  LEU   3          HD21      LEU   3  62.940 -11.465  -8.471
   24   HD22  LEU   3          HD22      LEU   3  61.829 -10.126  -8.755
   25   HD23  LEU   3          HD23      LEU   3  63.017 -10.025  -7.455
   26    H    GLU   4           HN       GLU   4  62.515 -13.522  -9.722
   27    HA   GLU   4           HA       GLU   4  59.662 -13.307 -10.448
   28    HB2  GLU   4           HB2      GLU   4  61.073 -15.322  -8.674
   29    HB3  GLU   4           HB1      GLU   4  59.425 -15.452  -9.290
   30    HG2  GLU   4           HG2      GLU   4  61.849 -15.209 -11.089
   31    HG3  GLU   4           HG1      GLU   4  61.156 -16.758 -10.606
   32    HA   PRO   5           HA       PRO   5  58.137 -10.963  -7.017
   33    HB2  PRO   5           HB2      PRO   5  56.481 -13.413  -6.500
   34    HB3  PRO   5           HB1      PRO   5  55.985 -11.710  -6.543
   35    HG2  PRO   5           HG2      PRO   5  55.558 -13.381  -8.598
   36    HG3  PRO   5           HG1      PRO   5  55.883 -11.656  -8.825
   37    HD2  PRO   5           HD2      PRO   5  57.595 -13.961  -9.484
   38    HD3  PRO   5           HD1      PRO   5  57.709 -12.280 -10.047
   39    HA   PRO   6           HA       PRO   6  60.596 -13.252  -3.891
   40    HB2  PRO   6           HB2      PRO   6  62.091 -11.193  -3.023
   41    HB3  PRO   6           HB1      PRO   6  62.416 -11.972  -4.585
   42    HG2  PRO   6           HG2      PRO   6  61.069  -9.388  -4.014
   43    HG3  PRO   6           HG1      PRO   6  62.148  -9.832  -5.346
   44    HD2  PRO   6           HD2      PRO   6  59.341  -9.743  -5.480
   45    HD3  PRO   6           HD1      PRO   6  60.409 -10.551  -6.648
   46    H    LYS   7           HN       LYS   7  60.243 -13.415  -1.646
   47    HA   LYS   7           HA       LYS   7  58.102 -11.703  -0.548
   48    HB2  LYS   7           HB2      LYS   7  58.307 -13.280   1.426
   49    HB3  LYS   7           HB1      LYS   7  57.872 -14.058  -0.096
   50    HG2  LYS   7           HG2      LYS   7  59.984 -15.014  -0.368
   51    HG3  LYS   7           HG1      LYS   7  60.770 -13.812   0.657
   52    HD2  LYS   7           HD2      LYS   7  60.598 -16.030   1.773
   53    HD3  LYS   7           HD1      LYS   7  59.718 -14.774   2.645
   54    HE2  LYS   7           HE2      LYS   7  57.611 -15.514   1.726
   55    HE3  LYS   7           HE1      LYS   7  58.425 -16.639   0.638
   56    HZ1  LYS   7           HZ1      LYS   7  58.264 -18.148   2.231
   57    HZ2  LYS   7           HZ2      LYS   7  57.657 -17.011   3.337
   58    HZ3  LYS   7           HZ3      LYS   7  59.334 -17.231   3.176
   59    H    ALA   8           HN       ALA   8  58.734 -11.574   2.130
   60    HA   ALA   8           HA       ALA   8  61.410 -10.764   2.722
   61    HB1  ALA   8           HB1      ALA   8  61.150  -8.894   1.274
   62    HB2  ALA   8           HB2      ALA   8  60.869  -8.255   2.893
   63    HB3  ALA   8           HB3      ALA   8  59.503  -8.595   1.831
   64    H    GLU   9           HN       GLU   9  58.128 -11.162   3.471
   65    HA   GLU   9           HA       GLU   9  56.933 -11.049   5.495
   66    HB2  GLU   9           HB2      GLU   9  58.738 -12.759   5.981
   67    HB3  GLU   9           HB1      GLU   9  59.675 -11.460   6.720
   68    HG2  GLU   9           HG2      GLU   9  58.462 -12.559   8.489
   69    HG3  GLU   9           HG1      GLU   9  57.686 -10.999   8.213
   70    H1U  RCY  10           H1U      RCY  10  54.244 -11.356   3.015
   71    H1S  RCY  10           H1S      RCY  10  54.652  -9.084   6.756
   72    HB1  RCY  10           HB1      RCY  10  55.763  -6.580   4.999
   73    HB2  RCY  10           HB2      RCY  10  56.197  -5.294   6.123
   74    HA   RCY  10           HA       RCY  10  58.152  -6.612   5.994
   75    HN1  RCY  10           HN1      RCY  10  56.513  -8.738   5.212
   76    H    ARG  11           HN       ARG  11  57.529  -5.212   8.084
   77    HA   ARG  11           HA       ARG  11  57.353  -7.016  10.457
   78    HE   ARG  11           HE       ARG  11  61.352  -5.658  10.378
   79    HB2  ARG  11           HB2      ARG  11  59.767  -6.375   9.805
   80    HB3  ARG  11           HB1      ARG  11  59.339  -4.744  10.319
   81    HG2  ARG  11           HG2      ARG  11  58.518  -5.845  12.504
   82    HG3  ARG  11           HG1      ARG  11  59.424  -7.265  11.977
   83    HD2  ARG  11           HD2      ARG  11  60.442  -4.550  12.752
   84    HD3  ARG  11           HD1      ARG  11  61.038  -6.141  13.226
   85   HH11  ARG  11          HH21      ARG  11  62.612  -5.108  13.539
   86   HH12  ARG  11          HH22      ARG  11  64.244  -4.898  12.997
   87   HH21  ARG  11          HH11      ARG  11  63.475  -5.388   9.651
   88   HH22  ARG  11          HH12      ARG  11  64.732  -5.057  10.796
   89    H    SER  12           HN       SER  12  57.302  -3.665   9.244
   90    HA   SER  12           HA       SER  12  55.039  -3.104  11.062
   91    HG   SER  12           HG       SER  12  57.915  -0.726  10.570
   92    HB2  SER  12           HB2      SER  12  56.199  -0.962  11.810
   93    HB3  SER  12           HB1      SER  12  56.845  -2.451  12.494
   94    H    ALA  13           HN       ALA  13  57.351  -1.293   8.999
   95    HA   ALA  13           HA       ALA  13  56.937   0.192   7.230
   96    HB1  ALA  13           HB1      ALA  13  55.364  -0.529   5.598
   97    HB2  ALA  13           HB2      ALA  13  54.370  -1.344   6.806
   98    HB3  ALA  13           HB3      ALA  13  55.939  -2.012   6.359
   99    H    THR  14           HN       THR  14  56.480   2.198   8.054
  100    HA   THR  14           HA       THR  14  53.672   2.994   8.261
  101    HB   THR  14           HB       THR  14  55.399   3.369  10.716
  102    HG1  THR  14           HG1      THR  14  54.523   1.566  11.538
  103   HG21  THR  14          HG21      THR  14  53.369   4.040  11.762
  104   HG22  THR  14          HG22      THR  14  52.391   3.407  10.438
  105   HG23  THR  14          HG23      THR  14  53.376   4.850  10.196
  106    H    ARG  15           HN       ARG  15  57.091   3.804   8.679
  107    HA   ARG  15           HA       ARG  15  56.887   6.147   7.042
  108    HE   ARG  15           HE       ARG  15  57.014   6.058  12.997
  109    HB2  ARG  15           HB2      ARG  15  57.401   7.814   8.891
  110    HB3  ARG  15           HB1      ARG  15  55.748   7.200   8.878
  111    HG2  ARG  15           HG2      ARG  15  56.384   5.513  10.590
  112    HG3  ARG  15           HG1      ARG  15  58.008   6.199  10.637
  113    HD2  ARG  15           HD2      ARG  15  57.099   8.360  11.358
  114    HD3  ARG  15           HD1      ARG  15  55.459   7.720  11.260
  115   HH11  ARG  15          HH21      ARG  15  55.584   9.183  12.725
  116   HH12  ARG  15          HH22      ARG  15  55.347   9.370  14.431
  117   HH21  ARG  15          HH11      ARG  15  56.713   6.283  15.226
  118   HH22  ARG  15          HH12      ARG  15  55.986   7.728  15.847
  119    H    VAL  16           HN       VAL  16  58.932   6.613   6.325
  120    HA   VAL  16           HA       VAL  16  61.141   4.974   7.087
  121    HB   VAL  16           HB       VAL  16  61.422   7.691   5.796
  122   HG11  VAL  16          HG11      VAL  16  63.404   6.168   6.414
  123   HG12  VAL  16          HG12      VAL  16  63.324   6.730   4.744
  124   HG13  VAL  16          HG13      VAL  16  62.816   5.090   5.148
  125   HG21  VAL  16          HG21      VAL  16  60.333   5.116   4.637
  126   HG22  VAL  16          HG22      VAL  16  61.027   6.386   3.628
  127   HG23  VAL  16          HG23      VAL  16  59.594   6.717   4.601
  128    H    MET  17           HN       MET  17  62.664   7.850   7.056
  129    HA   MET  17           HA       MET  17  62.348   8.443   9.947
  130    HB2  MET  17           HB2      MET  17  64.173   6.673   9.576
  131    HB3  MET  17           HB1      MET  17  65.088   7.946   8.768
  132    HG2  MET  17           HG2      MET  17  65.010   9.330  10.780
  133    HG3  MET  17           HG1      MET  17  64.001   8.134  11.593
  134    HE1  MET  17           HE1      MET  17  66.817   7.084  13.711
  135    HE2  MET  17           HE2      MET  17  65.089   6.892  13.424
  136    HE3  MET  17           HE3      MET  17  65.795   8.506  13.463
  137    H    GLY  18           HN       GLY  18  64.286   9.226   7.037
  138    HA2  GLY  18           HA2      GLY  18  64.390  12.057   7.883
  139    HA3  GLY  18           HA1      GLY  18  65.231  11.361   6.496
  140    H    GLY  19           HN       GLY  19  61.867  11.905   7.608
  141    HA2  GLY  19           HA2      GLY  19  60.538  11.710   5.170
  142    HA3  GLY  19           HA1      GLY  19  60.057  12.849   6.429
  143    HA   PRO  20           HA       PRO  20  61.415  16.521   4.414
  144    HB2  PRO  20           HB2      PRO  20  63.998  16.568   5.931
  145    HB3  PRO  20           HB1      PRO  20  62.786  17.849   5.729
  146    HG2  PRO  20           HG2      PRO  20  62.989  16.466   7.996
  147    HG3  PRO  20           HG1      PRO  20  61.420  16.999   7.368
  148    HD2  PRO  20           HD2      PRO  20  62.589  14.258   7.421
  149    HD3  PRO  20           HD1      PRO  20  60.884  14.760   7.450
  150    H1U  RCY  21           H1U      RCY  21  70.338  11.775  -0.626
  151    H1S  RCY  21           H1S      RCY  21  68.062  15.417   1.345
  152    HB1  RCY  21           HB1      RCY  21  66.586  12.948   2.694
  153    HB2  RCY  21           HB2      RCY  21  65.911  13.310   4.282
  154    HA   RCY  21           HA       RCY  21  64.824  14.789   1.917
  155    HN1  RCY  21           HN1      RCY  21  63.478  13.775   4.394
  156    H    THR  22           HN       THR  22  63.951  13.712   0.216
  157    HA   THR  22           HA       THR  22  62.863  10.987   0.621
  158    HB   THR  22           HB       THR  22  61.338  12.162  -0.676
  159    HG1  THR  22           HG1      THR  22  63.032  11.461  -2.803
  160   HG21  THR  22          HG21      THR  22  62.148  13.742  -2.522
  161   HG22  THR  22          HG22      THR  22  63.759  13.556  -1.828
  162   HG23  THR  22          HG23      THR  22  62.458  14.254  -0.863
  163    HA   PRO  23           HA       PRO  23  66.421   9.048  -1.175
  164    HB2  PRO  23           HB2      PRO  23  65.297   6.801  -2.253
  165    HB3  PRO  23           HB1      PRO  23  65.504   7.034  -0.506
  166    HG2  PRO  23           HG2      PRO  23  63.066   7.389  -2.178
  167    HG3  PRO  23           HG1      PRO  23  63.235   6.683  -0.561
  168    HD2  PRO  23           HD2      PRO  23  62.332   9.236  -0.982
  169    HD3  PRO  23           HD1      PRO  23  63.198   8.746   0.491
  170    H    ARG  24           HN       ARG  24  67.519   9.391  -3.074
  171    HA   ARG  24           HA       ARG  24  66.372   8.923  -5.675
  172    HE   ARG  24           HE       ARG  24  66.844  14.196  -2.991
  173    HB2  ARG  24           HB2      ARG  24  66.438  11.319  -6.444
  174    HB3  ARG  24           HB1      ARG  24  65.161  10.983  -5.277
  175    HG2  ARG  24           HG2      ARG  24  66.413  11.964  -3.485
  176    HG3  ARG  24           HG1      ARG  24  67.877  12.042  -4.466
  177    HD2  ARG  24           HD2      ARG  24  67.041  13.797  -5.796
  178    HD3  ARG  24           HD1      ARG  24  65.372  13.480  -5.324
  179   HH11  ARG  24          HH21      ARG  24  65.694  15.468  -5.982
  180   HH12  ARG  24          HH22      ARG  24  65.538  17.087  -5.386
  181   HH21  ARG  24          HH11      ARG  24  66.646  16.303  -2.195
  182   HH22  ARG  24          HH12      ARG  24  66.077  17.559  -3.242
  183    H    LYS  25           HN       LYS  25  68.056  11.050  -6.924
  184    HA   LYS  25           HA       LYS  25  70.598   9.589  -6.767
  185    HB2  LYS  25           HB2      LYS  25  71.260  11.386  -8.513
  186    HB3  LYS  25           HB1      LYS  25  70.033  10.208  -8.975
  187    HG2  LYS  25           HG2      LYS  25  68.993  12.627  -7.625
  188    HG3  LYS  25           HG1      LYS  25  69.706  12.908  -9.214
  189    HD2  LYS  25           HD2      LYS  25  68.266  11.161 -10.182
  190    HD3  LYS  25           HD1      LYS  25  67.560  10.855  -8.594
  191    HE2  LYS  25           HE2      LYS  25  67.442  13.497 -10.081
  192    HE3  LYS  25           HE1      LYS  25  66.117  12.340  -9.953
  193    HZ1  LYS  25           HZ1      LYS  25  65.602  13.126  -7.963
  194    HZ2  LYS  25           HZ2      LYS  25  66.757  14.354  -8.175
  195    HZ3  LYS  25           HZ3      LYS  25  67.185  12.906  -7.395
  196    H    GLY  26           HN       GLY  26  71.190  12.833  -7.443
  197    HA2  GLY  26           HA2      GLY  26  72.563  14.371  -6.304
  198    HA3  GLY  26           HA1      GLY  26  71.386  14.161  -5.006
  199    HA   PRO  27           HA       PRO  27  74.885  10.954  -4.159
  200    HB2  PRO  27           HB2      PRO  27  77.084  11.615  -5.972
  201    HB3  PRO  27           HB1      PRO  27  76.222  10.079  -5.784
  202    HG2  PRO  27           HG2      PRO  27  76.029  11.663  -7.978
  203    HG3  PRO  27           HG1      PRO  27  74.752  10.558  -7.444
  204    HD2  PRO  27           HD2      PRO  27  74.928  13.536  -7.110
  205    HD3  PRO  27           HD1      PRO  27  73.504  12.519  -7.433
  206    HA   PRO  28           HA       PRO  28  77.141  13.418  -1.253
  207    HB2  PRO  28           HB2      PRO  28  79.506  11.729  -2.011
  208    HB3  PRO  28           HB1      PRO  28  78.901  12.157  -0.398
  209    HG2  PRO  28           HG2      PRO  28  78.435   9.764  -1.493
  210    HG3  PRO  28           HG1      PRO  28  77.252  10.566  -0.447
  211    HD2  PRO  28           HD2      PRO  28  77.145  10.106  -3.369
  212    HD3  PRO  28           HD1      PRO  28  75.820  10.432  -2.230
  213    H    LYS  29           HN       LYS  29  79.033  14.934  -1.126
  214    HA   LYS  29           HA       LYS  29  79.807  15.895  -3.853
  215    HB2  LYS  29           HB2      LYS  29  78.449  17.392  -2.258
  216    HB3  LYS  29           HB1      LYS  29  79.925  17.506  -1.299
  217    HG2  LYS  29           HG2      LYS  29  81.145  18.426  -3.190
  218    HG3  LYS  29           HG1      LYS  29  79.753  18.188  -4.248
  219    HD2  LYS  29           HD2      LYS  29  78.446  19.712  -2.695
  220    HD3  LYS  29           HD1      LYS  29  79.976  20.088  -1.901
  221    HE2  LYS  29           HE2      LYS  29  79.320  20.533  -4.829
  222    HE3  LYS  29           HE1      LYS  29  79.505  21.783  -3.598
  223    HZ1  LYS  29           HZ1      LYS  29  81.807  20.861  -3.256
  224    HZ2  LYS  29           HZ2      LYS  29  81.545  21.672  -4.727
  225    HZ3  LYS  29           HZ3      LYS  29  81.582  19.974  -4.684
  226    H1U  RCY  30           H1U      RCY  30  84.066   8.626  -5.657
  227    H1S  RCY  30           H1S      RCY  30  83.154  10.273  -1.474
  228    HB1  RCY  30           HB1      RCY  30  82.270  12.842  -0.311
  229    HB2  RCY  30           HB2      RCY  30  83.600  13.531   0.616
  230    HA   RCY  30           HA       RCY  30  83.540  15.409  -0.632
  231    HN1  RCY  30           HN1      RCY  30  81.023  14.331  -1.125
  232    H    LYS  31           HN       LYS  31  82.403  13.870  -3.546
  233    HA   LYS  31           HA       LYS  31  83.482  13.435  -5.590
  234    HB2  LYS  31           HB2      LYS  31  84.922  15.869  -4.529
  235    HB3  LYS  31           HB1      LYS  31  85.309  15.181  -6.105
  236    HG2  LYS  31           HG2      LYS  31  82.437  15.717  -5.438
  237    HG3  LYS  31           HG1      LYS  31  83.469  17.074  -5.890
  238    HD2  LYS  31           HD2      LYS  31  83.536  14.600  -7.578
  239    HD3  LYS  31           HD1      LYS  31  82.169  15.702  -7.747
  240    HE2  LYS  31           HE2      LYS  31  83.753  17.577  -8.127
  241    HE3  LYS  31           HE1      LYS  31  85.098  16.442  -8.021
  242    HZ1  LYS  31           HZ1      LYS  31  82.872  16.170  -9.962
  243    HZ2  LYS  31           HZ2      LYS  31  84.326  15.293  -9.929
  244    HZ3  LYS  31           HZ3      LYS  31  84.337  16.946 -10.322
  245    H    GLN  32           HN       GLN  32  84.436  11.932  -3.272
  246    HA   GLN  32           HA       GLN  32  86.407  10.860  -2.443
  247    HB2  GLN  32           HB2      GLN  32  87.337   9.436  -4.345
  248    HB3  GLN  32           HB1      GLN  32  85.602   9.309  -4.069
  249    HG2  GLN  32           HG2      GLN  32  85.135  10.827  -5.900
  250    HG3  GLN  32           HG1      GLN  32  86.853  11.167  -6.110
  251   HE21  GLN  32          HE21      GLN  32  87.890   9.906  -7.664
  252   HE22  GLN  32          HE22      GLN  32  87.327   8.411  -8.237
  253    H    ARG  33           HN       ARG  33  88.400  10.617  -5.026
  254    HA   ARG  33           HA       ARG  33  90.539  11.507  -5.416
  255    HE   ARG  33           HE       ARG  33  89.119  16.165  -6.861
  256    HB2  ARG  33           HB2      ARG  33  88.793  13.956  -5.127
  257    HB3  ARG  33           HB1      ARG  33  90.505  14.078  -5.535
  258    HG2  ARG  33           HG2      ARG  33  90.228  13.024  -7.598
  259    HG3  ARG  33           HG1      ARG  33  88.749  12.206  -7.094
  260    HD2  ARG  33           HD2      ARG  33  88.227  14.027  -8.664
  261    HD3  ARG  33           HD1      ARG  33  87.565  14.380  -7.068
  262   HH11  ARG  33          HH21      ARG  33  89.779  14.100  -9.542
  263   HH12  ARG  33          HH22      ARG  33  90.967  15.153 -10.232
  264   HH21  ARG  33          HH11      ARG  33  90.668  17.553  -7.747
  265   HH22  ARG  33          HH12      ARG  33  91.470  17.109  -9.216
  266    H    GLN  34           HN       GLN  34  91.090  10.558  -3.214
  267    HA   GLN  34           HA       GLN  34  92.232  10.772  -1.179
  268    HB2  GLN  34           HB2      GLN  34  93.449  12.505  -2.722
  269    HB3  GLN  34           HB1      GLN  34  92.598  13.707  -1.753
  270    HG2  GLN  34           HG2      GLN  34  94.650  13.410  -0.615
  271    HG3  GLN  34           HG1      GLN  34  93.510  12.419   0.296
  272   HE21  GLN  34          HE21      GLN  34  96.092  11.626   0.608
  273   HE22  GLN  34          HE22      GLN  34  96.438  10.241  -0.311
  274    H    THR  35           HN       THR  35  90.176  10.468  -0.055
  275    HA   THR  35           HA       THR  35  89.586  12.646   1.767
  276    HB   THR  35           HB       THR  35  87.315  11.818  -0.053
  277    HG1  THR  35           HG1      THR  35  88.310  14.360  -0.281
  278   HG21  THR  35          HG21      THR  35  86.165  13.679   0.945
  279   HG22  THR  35          HG22      THR  35  87.639  14.237   1.738
  280   HG23  THR  35          HG23      THR  35  86.867  12.740   2.263
  281    H    ARG  36           HN       ARG  36  89.907  11.122   3.413
  282    HA   ARG  36           HA       ARG  36  89.433   9.269   4.785
  283    HE   ARG  36           HE       ARG  36  87.449   8.949   7.496
  284    HB2  ARG  36           HB2      ARG  36  86.626   9.740   3.736
  285    HB3  ARG  36           HB1      ARG  36  87.063   8.934   5.241
  286    HG2  ARG  36           HG2      ARG  36  87.982  11.752   4.709
  287    HG3  ARG  36           HG1      ARG  36  86.361  11.447   5.334
  288    HD2  ARG  36           HD2      ARG  36  88.961  10.537   6.602
  289    HD3  ARG  36           HD1      ARG  36  87.909  11.821   7.196
  290   HH11  ARG  36          HH21      ARG  36  86.106  12.121   7.339
  291   HH12  ARG  36          HH22      ARG  36  84.690  11.710   8.248
  292   HH21  ARG  36          HH11      ARG  36  85.608   8.394   8.683
  293   HH22  ARG  36          HH12      ARG  36  84.408   9.600   9.009
  294    H    GLN  37           HN       GLN  37  90.062   8.794   1.891
  295    HA   GLN  37           HA       GLN  37  88.439   6.641   0.906
  296    HB2  GLN  37           HB2      GLN  37  90.482   6.146  -0.513
  297    HB3  GLN  37           HB1      GLN  37  89.890   7.803  -0.626
  298    HG2  GLN  37           HG2      GLN  37  91.608   8.619   0.818
  299    HG3  GLN  37           HG1      GLN  37  92.065   6.987   1.310
  300   HE21  GLN  37          HE21      GLN  37  94.046   6.482   0.369
  301   HE22  GLN  37          HE22      GLN  37  94.488   6.847  -1.229
  302    H1U  RCY  38           H1U      RCY  38  85.170   0.024   0.153
  303    H1S  RCY  38           H1S      RCY  38  87.619   1.116   3.192
  304    HB1  RCY  38           HB1      RCY  38  90.216   1.468   2.581
  305    HB2  RCY  38           HB2      RCY  38  89.242   2.314   1.380
  306    HA   RCY  38           HA       RCY  38  91.371   3.710   3.015
  307    HN1  RCY  38           HN1      RCY  38  90.449   4.653   0.375
  308    H    LYS  39           HN       LYS  39  92.162   1.194   2.432
  309    HA   LYS  39           HA       LYS  39  94.413   1.580   0.706
  310    HB2  LYS  39           HB2      LYS  39  93.152  -1.005   1.676
  311    HB3  LYS  39           HB1      LYS  39  94.757  -0.860   0.959
  312    HG2  LYS  39           HG2      LYS  39  95.116   0.948   2.841
  313    HG3  LYS  39           HG1      LYS  39  93.784   0.104   3.632
  314    HD2  LYS  39           HD2      LYS  39  96.358  -1.173   2.659
  315    HD3  LYS  39           HD1      LYS  39  95.945  -0.840   4.341
  316    HE2  LYS  39           HE2      LYS  39  93.912  -2.299   4.053
  317    HE3  LYS  39           HE1      LYS  39  94.521  -2.740   2.458
  318    HZ1  LYS  39           HZ1      LYS  39  95.617  -4.335   3.534
  319    HZ2  LYS  39           HZ2      LYS  39  95.382  -3.615   5.055
  320    HZ3  LYS  39           HZ3      LYS  39  96.667  -3.112   4.063
  321    H    SER  40           HN       SER  40  93.742  -1.285  -0.460
  322    HA   SER  40           HA       SER  40  91.741  -0.632  -2.497
  323    HG   SER  40           HG       SER  40  93.458   1.071  -4.502
  324    HB2  SER  40           HB2      SER  40  94.690  -0.755  -3.154
  325    HB3  SER  40           HB1      SER  40  93.443  -1.029  -4.367
  326    H    LYS  41           HN       LYS  41  94.307  -2.789  -1.360
  327    HA   LYS  41           HA       LYS  41  94.021  -5.099  -2.782
  328    HB2  LYS  41           HB2      LYS  41  93.947  -4.967   0.245
  329    HB3  LYS  41           HB1      LYS  41  94.432  -6.363  -0.718
  330    HG2  LYS  41           HG2      LYS  41  96.362  -5.238  -1.559
  331    HG3  LYS  41           HG1      LYS  41  95.795  -3.675  -0.969
  332    HD2  LYS  41           HD2      LYS  41  95.934  -4.606   1.374
  333    HD3  LYS  41           HD1      LYS  41  96.721  -6.030   0.695
  334    HE2  LYS  41           HE2      LYS  41  98.461  -4.526   1.428
  335    HE3  LYS  41           HE1      LYS  41  98.434  -4.486  -0.335
  336    HZ1  LYS  41           HZ1      LYS  41  98.171  -2.305  -0.172
  337    HZ2  LYS  41           HZ2      LYS  41  97.961  -2.384   1.512
  338    HZ3  LYS  41           HZ3      LYS  41  96.627  -2.577   0.477
  339    HA   PRO  42           HA       PRO  42  89.537  -5.627  -2.148
  340    HB2  PRO  42           HB2      PRO  42  88.945  -6.636  -4.578
  341    HB3  PRO  42           HB1      PRO  42  89.273  -4.907  -4.342
  342    HG2  PRO  42           HG2      PRO  42  91.022  -7.018  -5.477
  343    HG3  PRO  42           HG1      PRO  42  90.874  -5.311  -5.921
  344    HD2  PRO  42           HD2      PRO  42  92.883  -6.409  -4.285
  345    HD3  PRO  42           HD1      PRO  42  92.492  -4.682  -4.431
  346    HA   PRO  43           HA       PRO  43  89.674  -9.977  -1.139
  347    HB2  PRO  43           HB2      PRO  43  87.033 -10.490  -0.789
  348    HB3  PRO  43           HB1      PRO  43  87.952  -9.467   0.335
  349    HG2  PRO  43           HG2      PRO  43  86.110  -8.660  -1.862
  350    HG3  PRO  43           HG1      PRO  43  86.286  -7.987  -0.232
  351    HD2  PRO  43           HD2      PRO  43  87.404  -6.841  -2.473
  352    HD3  PRO  43           HD1      PRO  43  88.065  -6.644  -0.835
  353    H    LYS  44           HN       LYS  44  88.876 -12.133  -1.928
  354    HA   LYS  44           HA       LYS  44  88.737 -12.175  -4.839
  355    HB2  LYS  44           HB2      LYS  44  88.257 -14.531  -3.007
  356    HB3  LYS  44           HB1      LYS  44  88.907 -14.540  -4.647
  357    HG2  LYS  44           HG2      LYS  44  90.847 -13.144  -3.729
  358    HG3  LYS  44           HG1      LYS  44  90.251 -13.561  -2.122
  359    HD2  LYS  44           HD2      LYS  44  90.317 -16.011  -2.943
  360    HD3  LYS  44           HD1      LYS  44  91.324 -15.403  -4.257
  361    HE2  LYS  44           HE2      LYS  44  92.930 -14.496  -2.651
  362    HE3  LYS  44           HE1      LYS  44  91.904 -14.999  -1.308
  363    HZ1  LYS  44           HZ1      LYS  44  92.538 -17.102  -3.178
  364    HZ2  LYS  44           HZ2      LYS  44  92.577 -17.107  -1.480
  365    HZ3  LYS  44           HZ3      LYS  44  93.887 -16.478  -2.360
  366    H    LYS  45           HN       LYS  45  86.906 -14.601  -4.705
  367    HA   LYS  45           HA       LYS  45  84.631 -15.036  -5.052
  368    HB2  LYS  45           HB2      LYS  45  84.096 -12.711  -3.192
  369    HB3  LYS  45           HB1      LYS  45  83.081 -14.122  -3.485
  370    HG2  LYS  45           HG2      LYS  45  84.700 -15.583  -2.424
  371    HG3  LYS  45           HG1      LYS  45  85.854 -14.258  -2.270
  372    HD2  LYS  45           HD2      LYS  45  84.763 -14.554  -0.127
  373    HD3  LYS  45           HD1      LYS  45  84.174 -13.051  -0.839
  374    HE2  LYS  45           HE2      LYS  45  82.689 -15.606  -1.368
  375    HE3  LYS  45           HE1      LYS  45  82.459 -14.776   0.171
  376    HZ1  LYS  45           HZ1      LYS  45  82.359 -12.825  -1.781
  377    HZ2  LYS  45           HZ2      LYS  45  81.061 -13.433  -0.869
  378    HZ3  LYS  45           HZ3      LYS  45  81.431 -14.112  -2.382
  379    H    GLY  46           HN       GLY  46  86.038 -12.047  -5.816
  380    HA2  GLY  46           HA2      GLY  46  83.707 -10.762  -6.967
  381    HA3  GLY  46           HA1      GLY  46  85.386 -10.306  -7.263
  382    H    VAL  47           HN       VAL  47  84.261 -10.106  -9.516
  383    HA   VAL  47           HA       VAL  47  84.134 -10.902 -11.716
  384    HB   VAL  47           HB       VAL  47  85.760 -13.274 -10.786
  385   HG11  VAL  47          HG11      VAL  47  86.755 -12.957 -13.073
  386   HG12  VAL  47          HG12      VAL  47  85.567 -11.686 -13.362
  387   HG13  VAL  47          HG13      VAL  47  85.036 -13.348 -13.101
  388   HG21  VAL  47          HG21      VAL  47  86.883 -11.376  -9.823
  389   HG22  VAL  47          HG22      VAL  47  86.638 -10.416 -11.283
  390   HG23  VAL  47          HG23      VAL  47  87.755 -11.781 -11.302
  391    H    GLN  48           HN       GLN  48  82.858 -12.555  -9.096
  392    HA   GLN  48           HA       GLN  48  80.784 -13.771 -10.675
  393    HB2  GLN  48           HB2      GLN  48  82.832 -15.330 -11.001
  394    HB3  GLN  48           HB1      GLN  48  82.567 -15.799  -9.323
  395    HG2  GLN  48           HG2      GLN  48  80.281 -16.489  -9.836
  396    HG3  GLN  48           HG1      GLN  48  80.459 -15.931 -11.499
  397   HE21  GLN  48          HE21      GLN  48  80.185 -18.081 -12.413
  398   HE22  GLN  48          HE22      GLN  48  81.369 -19.284 -12.233
  399    H    GLY  49           HN       GLY  49  80.801 -12.050  -8.460
  400    HA2  GLY  49           HA2      GLY  49  79.316 -13.717  -6.513
  401    HA3  GLY  49           HA1      GLY  49  80.669 -12.772  -5.887
  402    H1U  RCY  50           H1U      RCY  50  77.585  -2.558  -2.041
  403    H1S  RCY  50           H1S      RCY  50  78.949  -6.620  -4.350
  404    HB1  RCY  50           HB1      RCY  50  79.507  -8.276  -5.401
  405    HB2  RCY  50           HB2      RCY  50  78.374  -9.564  -4.988
  406    HA   RCY  50           HA       RCY  50  77.633  -9.478  -7.446
  407    HN1  RCY  50           HN1      RCY  50  80.328 -10.490  -7.589
  408    H    GLY  51           HN       GLY  51  81.080  -8.953  -7.751
  409    HA2  GLY  51           HA2      GLY  51  80.641  -6.331  -9.069
  410    HA3  GLY  51           HA1      GLY  51  82.210  -7.018  -8.647
  411    H    ASP  52           HN       ASP  52  80.382  -9.445 -10.008
  412    HA   ASP  52           HA       ASP  52  82.004  -9.656 -12.340
  413    HB2  ASP  52           HB2      ASP  52  80.123 -11.220 -13.129
  414    HB3  ASP  52           HB1      ASP  52  80.907 -11.636 -11.604
  415    H    ASP  53           HN       ASP  53  79.035  -7.909 -11.720
  416    HA   ASP  53           HA       ASP  53  78.545  -7.399 -14.575
  417    HB2  ASP  53           HB2      ASP  53  76.747  -7.592 -12.735
  418    HB3  ASP  53           HB1      ASP  53  77.239  -5.966 -12.257
  419    H    ILE  54           HN       ILE  54  77.844  -4.706 -14.551
  420    HA   ILE  54           HA       ILE  54  80.490  -3.384 -14.075
  421    HB   ILE  54           HB       ILE  54  78.351  -2.577 -16.062
  422   HG12  ILE  54          HG12      ILE  54  79.186  -4.774 -16.691
  423   HG13  ILE  54          HG11      ILE  54  79.919  -3.573 -17.755
  424   HG21  ILE  54          HG21      ILE  54  81.265  -1.809 -15.708
  425   HG22  ILE  54          HG22      ILE  54  79.870  -0.775 -15.399
  426   HG23  ILE  54          HG23      ILE  54  80.241  -1.287 -17.046
  427   HD11  ILE  54          HD11      ILE  54  81.169  -5.095 -15.482
  428   HD12  ILE  54          HD12      ILE  54  81.829  -3.532 -15.964
  429   HD13  ILE  54          HD13      ILE  54  81.770  -4.860 -17.124
  430    HA   PRO  55           HA       PRO  55  77.516  -1.183 -11.345
  431    HB2  PRO  55           HB2      PRO  55  79.176  -0.855  -9.226
  432    HB3  PRO  55           HB1      PRO  55  78.324  -2.380  -9.533
  433    HG2  PRO  55           HG2      PRO  55  81.160  -1.668 -10.046
  434    HG3  PRO  55           HG1      PRO  55  80.458  -3.203  -9.512
  435    HD2  PRO  55           HD2      PRO  55  81.239  -2.634 -12.130
  436    HD3  PRO  55           HD1      PRO  55  80.108  -3.922 -11.662
  437    H    GLY  56           HN       GLY  56  77.279   1.039 -11.248
  438    HA2  GLY  56           HA2      GLY  56  78.109   3.301 -10.957
  439    HA3  GLY  56           HA1      GLY  56  79.702   2.750 -11.479
  440    H    MET  57           HN       MET  57  76.811   1.802 -13.211
  441    HA   MET  57           HA       MET  57  77.796   3.349 -15.559
  442    HB2  MET  57           HB2      MET  57  75.939   1.864 -16.694
  443    HB3  MET  57           HB1      MET  57  77.488   1.144 -16.259
  444    HG2  MET  57           HG2      MET  57  75.619  -0.282 -15.508
  445    HG3  MET  57           HG1      MET  57  76.523   0.347 -14.130
  446    HE1  MET  57           HE1      MET  57  73.018   0.201 -12.702
  447    HE2  MET  57           HE2      MET  57  74.514  -0.665 -13.045
  448    HE3  MET  57           HE3      MET  57  73.187  -0.718 -14.203
  449    H    GLU  58           HN       GLU  58  75.425   3.466 -13.136
  450    HA   GLU  58           HA       GLU  58  74.278   5.892 -14.044
  451    HB2  GLU  58           HB2      GLU  58  73.216   3.565 -15.365
  452    HB3  GLU  58           HB1      GLU  58  71.960   4.238 -14.329
  453    HG2  GLU  58           HG2      GLU  58  73.598   5.879 -16.282
  454    HG3  GLU  58           HG1      GLU  58  71.997   5.231 -16.639
  455    H    GLY  59           HN       GLY  59  74.557   3.287 -11.937
  456    HA2  GLY  59           HA2      GLY  59  73.523   4.709  -9.695
  457    HA3  GLY  59           HA1      GLY  59  72.299   3.559 -10.237
  458    H1U  RCY  60           H1U      RCY  60  70.925   0.899  -5.402
  459    H1S  RCY  60           H1S      RCY  60  72.930   3.654  -6.213
  460    HB1  RCY  60           HB1      RCY  60  74.571  -0.222  -6.652
  461    HB2  RCY  60           HB2      RCY  60  72.912   0.320  -6.901
  462    HA   RCY  60           HA       RCY  60  75.184   0.381  -8.904
  463    HN1  RCY  60           HN1      RCY  60  72.544   1.422  -9.680
  464    H    GLY  61           HN       GLY  61  72.190   0.020 -10.281
  465    HA2  GLY  61           HA2      GLY  61  70.919  -1.843 -10.964
  466    HA3  GLY  61           HA1      GLY  61  72.506  -2.565 -11.232
  467    H    THR  62           HN       THR  62  71.256  -1.596  -8.072
  468    HA   THR  62           HA       THR  62  70.339  -4.215  -7.297
  469    HB   THR  62           HB       THR  62  72.781  -4.687  -7.478
  470    HG1  THR  62           HG1      THR  62  72.964  -5.279  -5.148
  471   HG21  THR  62          HG21      THR  62  73.421  -3.094  -5.080
  472   HG22  THR  62          HG22      THR  62  73.096  -2.138  -6.526
  473   HG23  THR  62          HG23      THR  62  74.369  -3.358  -6.544
  474    H    ASP  63           HN       ASP  63  68.873  -2.190  -6.811
  475    HA   ASP  63           HA       ASP  63  69.548  -0.555  -4.529
  476    HB2  ASP  63           HB2      ASP  63  66.754  -1.209  -5.487
  477    HB3  ASP  63           HB1      ASP  63  67.300   0.246  -4.652
  478    H    ILE  64           HN       ILE  64  69.444  -3.710  -4.433
  479    HA   ILE  64           HA       ILE  64  68.615  -3.811  -1.652
  480    HB   ILE  64           HB       ILE  64  66.395  -4.061  -2.325
  481   HG12  ILE  64          HG12      ILE  64  67.347  -6.919  -2.621
  482   HG13  ILE  64          HG11      ILE  64  67.325  -6.091  -1.063
  483   HG21  ILE  64          HG21      ILE  64  65.799  -5.471  -4.355
  484   HG22  ILE  64          HG22      ILE  64  67.524  -5.538  -4.715
  485   HG23  ILE  64          HG23      ILE  64  66.684  -3.987  -4.708
  486   HD11  ILE  64          HD11      ILE  64  65.250  -7.354  -1.346
  487   HD12  ILE  64          HD12      ILE  64  64.941  -6.545  -2.882
  488   HD13  ILE  64          HD13      ILE  64  64.899  -5.626  -1.378
  489    H    THR  65           HN       THR  65  70.143  -5.068  -4.404
  490    HA   THR  65           HA       THR  65  71.302  -7.118  -4.783
  491    HB   THR  65           HB       THR  65  72.252  -6.630  -1.954
  492    HG1  THR  65           HG1      THR  65  73.101  -4.823  -2.572
  493   HG21  THR  65          HG21      THR  65  73.583  -7.627  -4.488
  494   HG22  THR  65          HG22      THR  65  73.150  -8.601  -3.083
  495   HG23  THR  65          HG23      THR  65  74.409  -7.373  -2.950
  496    H    VAL  66           HN       VAL  66  68.712  -7.609  -3.985
  497    HA   VAL  66           HA       VAL  66  67.380  -9.377  -3.212
  498    HB   VAL  66           HB       VAL  66  69.886 -10.727  -2.190
  499   HG11  VAL  66          HG11      VAL  66  67.596 -11.659  -1.704
  500   HG12  VAL  66          HG12      VAL  66  68.629 -12.750  -2.628
  501   HG13  VAL  66          HG13      VAL  66  67.358 -11.836  -3.442
  502   HG21  VAL  66          HG21      VAL  66  69.785 -11.820  -4.569
  503   HG22  VAL  66          HG22      VAL  66  70.574 -10.254  -4.383
  504   HG23  VAL  66          HG23      VAL  66  68.932 -10.343  -5.019
  505    H    ILE  67           HN       ILE  67  70.107  -8.592  -1.083
  506    HA   ILE  67           HA       ILE  67  68.182  -8.046   1.114
  507    HB   ILE  67           HB       ILE  67  70.662  -9.784   1.307
  508   HG12  ILE  67          HG12      ILE  67  67.797 -10.333   2.132
  509   HG13  ILE  67          HG11      ILE  67  68.466 -10.812   0.572
  510   HG21  ILE  67          HG21      ILE  67  69.940  -9.876   3.775
  511   HG22  ILE  67          HG22      ILE  67  68.988  -8.432   3.429
  512   HG23  ILE  67          HG23      ILE  67  70.741  -8.399   3.238
  513   HD11  ILE  67          HD11      ILE  67  69.465 -11.680   3.300
  514   HD12  ILE  67          HD12      ILE  67  70.249 -12.083   1.773
  515   HD13  ILE  67          HD13      ILE  67  68.630 -12.690   2.120
  516    H1U  RCY  68           H1U      RCY  68  70.919   3.509   0.084
  517    H1S  RCY  68           H1S      RCY  68  69.438  -0.489  -0.049
  518    HB1  RCY  68           HB1      RCY  68  69.487  -2.800   1.745
  519    HB2  RCY  68           HB2      RCY  68  68.617  -3.702   0.509
  520    HA   RCY  68           HA       RCY  68  71.266  -4.730   0.563
  521    HN1  RCY  68           HN1      RCY  68  68.600  -5.779   0.780
  522    HA   PRO  69           HA       PRO  69  72.466  -5.411   4.821
  523    HB2  PRO  69           HB2      PRO  69  74.520  -3.493   4.828
  524    HB3  PRO  69           HB1      PRO  69  74.692  -5.199   4.379
  525    HG2  PRO  69           HG2      PRO  69  74.424  -2.811   2.652
  526    HG3  PRO  69           HG1      PRO  69  75.312  -4.317   2.375
  527    HD2  PRO  69           HD2      PRO  69  72.949  -3.772   1.133
  528    HD3  PRO  69           HD1      PRO  69  73.442  -5.428   1.554
  529    H    TRP  70           HN       TRP  70  70.968  -2.704   3.571
  530    HA   TRP  70           HA       TRP  70  71.303  -0.745   5.614
  531    HD1  TRP  70           HD1      TRP  70  69.818   0.922   6.671
  532    HE1  TRP  70           HE1      TRP  70  67.583   1.911   7.489
  533    HE3  TRP  70           HE3      TRP  70  66.672  -0.941   3.106
  534    HZ2  TRP  70           HZ2      TRP  70  64.821   1.912   6.730
  535    HZ3  TRP  70           HZ3      TRP  70  64.251  -0.433   3.177
  536    HH2  TRP  70           HH2      TRP  70  63.320   0.989   4.980
  537    HB2  TRP  70           HB2      TRP  70  70.162   0.025   3.704
  538    HB3  TRP  70           HB1      TRP  70  69.096  -1.377   3.659
  539    H    GLU  71           HN       GLU  71  69.514  -3.729   5.492
  540    HA   GLU  71           HA       GLU  71  67.825  -3.160   7.790
  541    HB2  GLU  71           HB2      GLU  71  68.524  -5.632   6.210
  542    HB3  GLU  71           HB1      GLU  71  67.599  -5.756   7.709
  543    HG2  GLU  71           HG2      GLU  71  66.794  -3.839   5.521
  544    HG3  GLU  71           HG1      GLU  71  66.261  -5.521   5.511
  545    H    ALA  72           HN       ALA  72  70.494  -5.530   7.390
  546    HA   ALA  72           HA       ALA  72  70.883  -5.666  10.278
  547    HB1  ALA  72           HB1      ALA  72  72.867  -7.085   9.639
  548    HB2  ALA  72           HB2      ALA  72  72.476  -6.774   7.948
  549    HB3  ALA  72           HB3      ALA  72  71.337  -7.652   8.969
  550    H1U  RCY  73           H1U      RCY  73  71.563   0.744   3.432
  551    H1S  RCY  73           H1S      RCY  73  72.368   1.951   7.277
  552    HB1  RCY  73           HB1      RCY  73  71.845  -1.113   7.853
  553    HB2  RCY  73           HB2      RCY  73  73.451  -1.300   7.156
  554    HA   RCY  73           HA       RCY  73  74.216  -2.576   8.916
  555    HN1  RCY  73           HN1      RCY  73  71.381  -3.127   8.517
  556    H    ASN  74           HN       ASN  74  71.515  -2.602  10.946
  557    HA   ASN  74           HA       ASN  74  71.057  -1.595  13.030
  558    HB2  ASN  74           HB2      ASN  74  72.841  -1.909  14.618
  559    HB3  ASN  74           HB1      ASN  74  72.941  -3.232  13.455
  560   HD21  ASN  74          HD21      ASN  74  74.709  -3.180  11.876
  561   HD22  ASN  74          HD22      ASN  74  76.051  -2.163  12.095
  562    H    HIS  75           HN       HIS  75  71.193   0.389  11.111
  563    HA   HIS  75           HA       HIS  75  71.469   2.711  10.925
  564    HD1  HIS  75           HD1      HIS  75  68.903   3.264  12.570
  565    HD2  HIS  75           HD2      HIS  75  71.083   0.652  14.984
  566    HE1  HIS  75           HE1      HIS  75  67.209   1.794  13.747
  567    HE2  HIS  75           HE2      HIS  75  68.523   0.200  15.220
  568    HB2  HIS  75           HB2      HIS  75  72.455   2.799  13.766
  569    HB3  HIS  75           HB1      HIS  75  71.423   3.946  12.910
  570    H1U  RCY  76           H1U      RCY  76  70.813   4.513   5.843
  571    H1S  RCY  76           H1S      RCY  76  73.006   6.376   8.655
  572    HB1  RCY  76           HB1      RCY  76  74.635   3.977   8.131
  573    HB2  RCY  76           HB2      RCY  76  76.373   4.142   8.376
  574    HA   RCY  76           HA       RCY  76  75.820   2.562  10.005
  575    HN1  RCY  76           HN1      RCY  76  73.161   3.582   9.832
  576    H    GLU  77           HN       GLU  77  74.139   4.891  11.921
  577    HA   GLU  77           HA       GLU  77  76.380   6.432  12.838
  578    HB2  GLU  77           HB2      GLU  77  73.735   5.776  14.168
  579    HB3  GLU  77           HB1      GLU  77  74.890   6.952  14.794
  580    HG2  GLU  77           HG2      GLU  77  73.809   7.105  11.976
  581    HG3  GLU  77           HG1      GLU  77  73.004   7.890  13.335
  582    H    LEU  78           HN       LEU  78  74.821   3.489  14.118
  583    HA   LEU  78           HA       LEU  78  76.909   3.261  16.199
  584    HG   LEU  78           HG       LEU  78  73.554   3.358  15.862
  585    HB2  LEU  78           HB2      LEU  78  74.709   1.280  15.600
  586    HB3  LEU  78           HB1      LEU  78  75.589   1.503  17.113
  587   HD11  LEU  78          HD11      LEU  78  73.778   2.003  18.567
  588   HD12  LEU  78          HD12      LEU  78  72.669   1.555  17.272
  589   HD13  LEU  78          HD13      LEU  78  72.487   3.106  18.091
  590   HD21  LEU  78          HD21      LEU  78  75.269   4.840  16.584
  591   HD22  LEU  78          HD22      LEU  78  75.615   3.868  18.014
  592   HD23  LEU  78          HD23      LEU  78  74.120   4.799  17.921
  593    H    HIS  79           HN       HIS  79  78.017   1.092  16.426
  594    HA   HIS  79           HA       HIS  79  78.311  -0.447  13.924
  595    HD1  HIS  79           HD1      HIS  79  80.409   3.187  15.398
  596    HD2  HIS  79           HD2      HIS  79  79.126   1.670  11.730
  597    HE1  HIS  79           HE1      HIS  79  79.794   5.188  13.972
  598    HE2  HIS  79           HE2      HIS  79  79.011   4.278  11.736
  599    HB2  HIS  79           HB2      HIS  79  80.792   0.697  15.210
  600    HB3  HIS  79           HB1      HIS  79  80.619  -0.029  13.612
  601    H    GLU  80           HN       GLU  80  77.501  -2.199  15.191
  602    HA   GLU  80           HA       GLU  80  79.546  -3.411  16.969
  603    HB2  GLU  80           HB2      GLU  80  76.690  -2.793  17.751
  604    HB3  GLU  80           HB1      GLU  80  77.643  -4.030  18.571
  605    HG2  GLU  80           HG2      GLU  80  79.362  -2.357  19.122
  606    HG3  GLU  80           HG1      GLU  80  78.431  -1.114  18.285
  607    H    LEU  81           HN       LEU  81  76.271  -3.854  15.590
  608    HA   LEU  81           HA       LEU  81  76.603  -6.750  15.464
  609    HG   LEU  81           HG       LEU  81  74.521  -4.267  16.215
  610    HB2  LEU  81           HB2      LEU  81  74.544  -5.144  13.946
  611    HB3  LEU  81           HB1      LEU  81  74.415  -6.797  14.549
  612   HD11  LEU  81          HD11      LEU  81  72.376  -6.386  15.875
  613   HD12  LEU  81          HD12      LEU  81  72.338  -4.777  15.153
  614   HD13  LEU  81          HD13      LEU  81  72.267  -4.959  16.906
  615   HD21  LEU  81          HD21      LEU  81  74.111  -5.954  18.102
  616   HD22  LEU  81          HD22      LEU  81  75.742  -5.919  17.433
  617   HD23  LEU  81          HD23      LEU  81  74.623  -7.197  16.960
  618    H    ALA  82           HN       ALA  82  78.206  -4.506  13.828
  619    HA   ALA  82           HA       ALA  82  77.864  -4.881  11.083
  620    HB1  ALA  82           HB1      ALA  82  80.480  -4.701  12.611
  621    HB2  ALA  82           HB2      ALA  82  79.539  -3.341  11.999
  622    HB3  ALA  82           HB3      ALA  82  80.308  -4.460  10.872
  623    H    GLN  83           HN       GLN  83  79.013  -7.159  13.452
  624    HA   GLN  83           HA       GLN  83  80.127  -8.983  11.429
  625    HB2  GLN  83           HB2      GLN  83  80.901  -8.676  13.908
  626    HB3  GLN  83           HB1      GLN  83  79.543  -9.734  14.290
  627    HG2  GLN  83           HG2      GLN  83  80.424 -11.457  12.788
  628    HG3  GLN  83           HG1      GLN  83  81.754 -10.396  12.321
  629   HE21  GLN  83          HE21      GLN  83  81.337 -13.047  14.116
  630   HE22  GLN  83          HE22      GLN  83  82.388 -12.737  15.413
  631    H    TYR  84           HN       TYR  84  77.387  -8.320  10.981
  632    HA   TYR  84           HA       TYR  84  75.688 -10.436  12.029
  633    HD1  TYR  84           HD1      TYR  84  76.732  -7.134   9.826
  634    HD2  TYR  84           HD2      TYR  84  73.871  -9.932   8.265
  635    HE1  TYR  84           HE1      TYR  84  77.280  -6.408   7.519
  636    HE2  TYR  84           HE2      TYR  84  74.419  -9.206   5.958
  637    HH   TYR  84           HH       TYR  84  75.374  -7.328   4.802
  638    HB2  TYR  84           HB2      TYR  84  73.977  -9.528  10.602
  639    HB3  TYR  84           HB1      TYR  84  74.882  -8.159  11.246
  640    H    GLY  85           HN       GLY  85  76.972  -9.756   8.745
  641    HA2  GLY  85           HA2      GLY  85  77.478 -12.600   8.314
  642    HA3  GLY  85           HA1      GLY  85  76.121 -11.985   7.371
  643    H    ILE  86           HN       ILE  86  78.653  -9.761   8.095
  644    HA   ILE  86           HA       ILE  86  79.868  -8.466   6.534
  645    HB   ILE  86           HB       ILE  86  81.186 -10.653   7.345
  646   HG12  ILE  86          HG12      ILE  86  82.083  -8.792   5.121
  647   HG13  ILE  86          HG11      ILE  86  82.219  -8.484   6.852
  648   HG21  ILE  86          HG21      ILE  86  81.523 -10.977   4.388
  649   HG22  ILE  86          HG22      ILE  86  80.141 -11.753   5.161
  650   HG23  ILE  86          HG23      ILE  86  81.780 -12.151   5.679
  651   HD11  ILE  86          HD11      ILE  86  83.602 -10.618   6.998
  652   HD12  ILE  86          HD12      ILE  86  84.367  -9.276   6.147
  653   HD13  ILE  86          HD13      ILE  86  83.649 -10.604   5.235
  654    H1U  RCY  87           H1U      RCY  87  77.041  -5.095   3.700
  655    H1S  RCY  87           H1S      RCY  87  80.010  -7.883   3.617
  656    HB1  RCY  87           HB1      RCY  87  80.313  -8.511   0.646
  657    HB2  RCY  87           HB2      RCY  87  81.191  -9.964   1.123
  658    HA   RCY  87           HA       RCY  87  78.746  -8.745   2.310
  659    HN1  RCY  87           HN1      RCY  87  80.992  -9.352   4.019
  Start of MODEL   15
    1    HA   MET   1           HA       MET   1  66.548 -12.787  22.900
    2    HB2  MET   1           HB2      MET   1  67.947 -10.767  22.832
    3    HB3  MET   1           HB1      MET   1  68.948 -12.207  22.638
    4    HG2  MET   1           HG2      MET   1  68.691 -11.862  20.112
    5    HG3  MET   1           HG1      MET   1  68.052 -10.266  20.502
    6    HE1  MET   1           HE1      MET   1  71.340  -8.854  19.523
    7    HE2  MET   1           HE2      MET   1  69.580  -8.793  19.494
    8    HE3  MET   1           HE3      MET   1  70.424 -10.103  18.670
    9    H    ASN   2           HN       ASN   2  66.524  -9.923  22.112
   10    HA   ASN   2           HA       ASN   2  63.865  -9.861  20.970
   11    HB2  ASN   2           HB2      ASN   2  65.855  -7.610  21.401
   12    HB3  ASN   2           HB1      ASN   2  64.137  -7.409  21.053
   13   HD21  ASN   2          HD21      ASN   2  65.609  -6.592  23.533
   14   HD22  ASN   2          HD22      ASN   2  64.842  -7.407  24.809
   15    H    LEU   3           HN       LEU   3  65.664 -11.200  19.214
   16    HA   LEU   3           HA       LEU   3  66.512  -9.398  17.102
   17    HG   LEU   3           HG       LEU   3  68.429 -10.396  16.350
   18    HB2  LEU   3           HB2      LEU   3  67.115 -11.991  17.757
   19    HB3  LEU   3           HB1      LEU   3  66.019 -12.237  16.400
   20   HD11  LEU   3          HD11      LEU   3  69.140 -12.731  16.488
   21   HD12  LEU   3          HD12      LEU   3  69.395 -12.137  14.847
   22   HD13  LEU   3          HD13      LEU   3  68.014 -13.174  15.204
   23   HD21  LEU   3          HD21      LEU   3  67.967 -10.477  13.871
   24   HD22  LEU   3          HD22      LEU   3  66.708  -9.670  14.806
   25   HD23  LEU   3          HD23      LEU   3  66.461 -11.320  14.236
   26    H    GLU   4           HN       GLU   4  63.588  -9.535  18.049
   27    HA   GLU   4           HA       GLU   4  62.000 -10.609  15.936
   28    HB2  GLU   4           HB2      GLU   4  61.170  -9.877  18.207
   29    HB3  GLU   4           HB1      GLU   4  61.322  -8.209  17.655
   30    HG2  GLU   4           HG2      GLU   4  59.042  -8.834  17.263
   31    HG3  GLU   4           HG1      GLU   4  59.836  -8.853  15.688
   32    HA   PRO   5           HA       PRO   5  63.080  -7.503  12.877
   33    HB2  PRO   5           HB2      PRO   5  61.394  -8.308  10.891
   34    HB3  PRO   5           HB1      PRO   5  62.875  -9.192  11.308
   35    HG2  PRO   5           HG2      PRO   5  60.056  -9.788  12.044
   36    HG3  PRO   5           HG1      PRO   5  61.362 -10.893  11.584
   37    HD2  PRO   5           HD2      PRO   5  60.579 -10.461  14.193
   38    HD3  PRO   5           HD1      PRO   5  62.212 -10.988  13.728
   39    HA   PRO   6           HA       PRO   6  59.996  -4.347  13.249
   40    HB2  PRO   6           HB2      PRO   6  60.275  -3.000  10.869
   41    HB3  PRO   6           HB1      PRO   6  61.438  -2.883  12.204
   42    HG2  PRO   6           HG2      PRO   6  61.586  -4.496   9.709
   43    HG3  PRO   6           HG1      PRO   6  62.861  -3.607  10.558
   44    HD2  PRO   6           HD2      PRO   6  62.572  -6.320  10.751
   45    HD3  PRO   6           HD1      PRO   6  63.249  -5.327  12.061
   46    H    LYS   7           HN       LYS   7  57.953  -3.494  12.256
   47    HA   LYS   7           HA       LYS   7  56.822  -5.028  10.017
   48    HB2  LYS   7           HB2      LYS   7  54.756  -5.467  11.672
   49    HB3  LYS   7           HB1      LYS   7  56.078  -6.620  11.516
   50    HG2  LYS   7           HG2      LYS   7  55.611  -6.169  13.890
   51    HG3  LYS   7           HG1      LYS   7  57.213  -5.573  13.454
   52    HD2  LYS   7           HD2      LYS   7  56.404  -3.307  13.286
   53    HD3  LYS   7           HD1      LYS   7  54.731  -3.836  13.462
   54    HE2  LYS   7           HE2      LYS   7  56.905  -4.070  15.564
   55    HE3  LYS   7           HE1      LYS   7  55.547  -2.945  15.594
   56    HZ1  LYS   7           HZ1      LYS   7  55.563  -5.852  15.995
   57    HZ2  LYS   7           HZ2      LYS   7  54.176  -5.125  15.336
   58    HZ3  LYS   7           HZ3      LYS   7  54.743  -4.648  16.865
   59    H    ALA   8           HN       ALA   8  57.253  -2.446   9.783
   60    HA   ALA   8           HA       ALA   8  54.606  -1.288   9.581
   61    HB1  ALA   8           HB1      ALA   8  54.977  -0.891  11.979
   62    HB2  ALA   8           HB2      ALA   8  55.008   0.635  11.096
   63    HB3  ALA   8           HB3      ALA   8  56.517  -0.109  11.623
   64    H    GLU   9           HN       GLU   9  55.025   1.266   9.079
   65    HA   GLU   9           HA       GLU   9  55.926   2.741   7.493
   66    HB2  GLU   9           HB2      GLU   9  57.879   2.382   9.181
   67    HB3  GLU   9           HB1      GLU   9  58.584   1.378   7.915
   68    HG2  GLU   9           HG2      GLU   9  58.512   3.239   6.339
   69    HG3  GLU   9           HG1      GLU   9  57.688   4.249   7.527
   70    H1U  RCY  10           H1U      RCY  10  63.212  -1.183   7.849
   71    H1S  RCY  10           H1S      RCY  10  59.546  -3.827   6.347
   72    HB1  RCY  10           HB1      RCY  10  58.155  -0.656   4.680
   73    HB2  RCY  10           HB2      RCY  10  57.432  -2.032   3.848
   74    HA   RCY  10           HA       RCY  10  55.850  -0.118   4.061
   75    HN1  RCY  10           HN1      RCY  10  55.440  -0.377   6.921
   76    H    ARG  11           HN       ARG  11  53.743  -0.804   3.742
   77    HA   ARG  11           HA       ARG  11  52.765  -3.231   5.108
   78    HE   ARG  11           HE       ARG  11  51.102   1.408   6.632
   79    HB2  ARG  11           HB2      ARG  11  51.526  -1.196   3.254
   80    HB3  ARG  11           HB1      ARG  11  50.698  -2.707   3.630
   81    HG2  ARG  11           HG2      ARG  11  49.996  -0.910   5.171
   82    HG3  ARG  11           HG1      ARG  11  50.841  -2.193   6.039
   83    HD2  ARG  11           HD2      ARG  11  52.816  -0.908   6.250
   84    HD3  ARG  11           HD1      ARG  11  52.316   0.223   4.993
   85   HH11  ARG  11          HH21      ARG  11  51.871  -1.796   7.648
   86   HH12  ARG  11          HH22      ARG  11  51.278  -1.570   9.260
   87   HH21  ARG  11          HH11      ARG  11  50.323   1.721   8.730
   88   HH22  ARG  11          HH12      ARG  11  50.401   0.422   9.872
   89    H    SER  12           HN       SER  12  54.842  -4.094   3.694
   90    HA   SER  12           HA       SER  12  55.507  -5.563   1.989
   91    HG   SER  12           HG       SER  12  53.657  -8.263   1.441
   92    HB2  SER  12           HB2      SER  12  53.436  -6.736   2.948
   93    HB3  SER  12           HB1      SER  12  52.554  -6.071   1.576
   94    H    ALA  13           HN       ALA  13  54.009  -2.740   1.420
   95    HA   ALA  13           HA       ALA  13  53.534  -1.474  -0.508
   96    HB1  ALA  13           HB1      ALA  13  55.962  -1.716  -0.744
   97    HB2  ALA  13           HB2      ALA  13  55.196  -1.792  -2.330
   98    HB3  ALA  13           HB3      ALA  13  55.747  -3.273  -1.546
   99    H    THR  14           HN       THR  14  53.612  -2.180  -3.232
  100    HA   THR  14           HA       THR  14  52.118  -4.653  -3.647
  101    HB   THR  14           HB       THR  14  50.665  -2.035  -4.113
  102    HG1  THR  14           HG1      THR  14  50.084  -2.159  -2.119
  103   HG21  THR  14          HG21      THR  14  49.936  -3.791  -5.601
  104   HG22  THR  14          HG22      THR  14  48.717  -3.618  -4.338
  105   HG23  THR  14          HG23      THR  14  49.869  -4.952  -4.275
  106    H    ARG  15           HN       ARG  15  53.848  -1.924  -4.727
  107    HA   ARG  15           HA       ARG  15  54.284  -3.129  -7.333
  108    HE   ARG  15           HE       ARG  15  53.521   1.126  -8.746
  109    HB2  ARG  15           HB2      ARG  15  52.038  -1.969  -7.585
  110    HB3  ARG  15           HB1      ARG  15  52.883  -0.444  -7.314
  111    HG2  ARG  15           HG2      ARG  15  54.448  -1.143  -9.217
  112    HG3  ARG  15           HG1      ARG  15  53.269  -2.404  -9.583
  113    HD2  ARG  15           HD2      ARG  15  52.850  -0.388 -10.943
  114    HD3  ARG  15           HD1      ARG  15  51.511  -0.691  -9.836
  115   HH11  ARG  15          HH21      ARG  15  50.695   0.733 -10.681
  116   HH12  ARG  15          HH22      ARG  15  50.149   2.361 -10.452
  117   HH21  ARG  15          HH11      ARG  15  52.825   3.254  -8.435
  118   HH22  ARG  15          HH12      ARG  15  51.355   3.788  -9.180
  119    H    VAL  16           HN       VAL  16  56.378  -2.660  -7.777
  120    HA   VAL  16           HA       VAL  16  57.420   0.053  -7.295
  121    HB   VAL  16           HB       VAL  16  57.954  -0.803  -5.152
  122   HG11  VAL  16          HG11      VAL  16  58.518  -3.364  -6.646
  123   HG12  VAL  16          HG12      VAL  16  57.391  -3.095  -5.317
  124   HG13  VAL  16          HG13      VAL  16  59.128  -3.106  -5.011
  125   HG21  VAL  16          HG21      VAL  16  60.296  -0.731  -5.137
  126   HG22  VAL  16          HG22      VAL  16  59.919   0.032  -6.682
  127   HG23  VAL  16          HG23      VAL  16  60.431  -1.655  -6.633
  128    H    MET  17           HN       MET  17  57.772   0.164  -9.539
  129    HA   MET  17           HA       MET  17  60.241  -0.978 -10.500
  130    HB2  MET  17           HB2      MET  17  58.828  -2.993 -10.703
  131    HB3  MET  17           HB1      MET  17  57.669  -2.085 -11.673
  132    HG2  MET  17           HG2      MET  17  59.196  -1.835 -13.469
  133    HG3  MET  17           HG1      MET  17  60.575  -2.285 -12.466
  134    HE1  MET  17           HE1      MET  17  56.943  -3.962 -12.871
  135    HE2  MET  17           HE2      MET  17  57.335  -4.956 -14.271
  136    HE3  MET  17           HE3      MET  17  57.511  -3.206 -14.364
  137    H    GLY  18           HN       GLY  18  60.864   0.949 -11.400
  138    HA2  GLY  18           HA2      GLY  18  58.955   2.663 -12.804
  139    HA3  GLY  18           HA1      GLY  18  60.682   2.970 -12.621
  140    H    GLY  19           HN       GLY  19  60.374   3.577 -14.990
  141    HA2  GLY  19           HA2      GLY  19  59.752   1.704 -17.014
  142    HA3  GLY  19           HA1      GLY  19  60.841   3.075 -17.235
  143    HA   PRO  20           HA       PRO  20  63.247  -0.870 -18.005
  144    HB2  PRO  20           HB2      PRO  20  64.829   1.266 -19.389
  145    HB3  PRO  20           HB1      PRO  20  64.441  -0.379 -19.931
  146    HG2  PRO  20           HG2      PRO  20  63.165   1.742 -20.909
  147    HG3  PRO  20           HG1      PRO  20  62.327   0.207 -20.624
  148    HD2  PRO  20           HD2      PRO  20  62.155   2.756 -19.086
  149    HD3  PRO  20           HD1      PRO  20  60.934   1.483 -19.303
  150    H1U  RCY  21           H1U      RCY  21  66.142  -5.228  -9.497
  151    H1S  RCY  21           H1S      RCY  21  66.413  -2.844 -13.212
  152    HB1  RCY  21           HB1      RCY  21  67.798  -2.041 -15.874
  153    HB2  RCY  21           HB2      RCY  21  66.147  -1.957 -15.260
  154    HA   RCY  21           HA       RCY  21  66.605   0.665 -15.411
  155    HN1  RCY  21           HN1      RCY  21  65.846  -0.958 -17.812
  156    H    THR  22           HN       THR  22  67.881   2.194 -16.466
  157    HA   THR  22           HA       THR  22  70.389   1.150 -17.680
  158    HB   THR  22           HB       THR  22  69.274   1.592 -19.682
  159    HG1  THR  22           HG1      THR  22  70.065   4.233 -19.187
  160   HG21  THR  22          HG21      THR  22  67.186   2.399 -18.827
  161   HG22  THR  22          HG22      THR  22  67.789   3.640 -19.925
  162   HG23  THR  22          HG23      THR  22  67.941   3.856 -18.182
  163    HA   PRO  23           HA       PRO  23  71.372   4.309 -14.478
  164    HB2  PRO  23           HB2      PRO  23  74.093   3.264 -15.122
  165    HB3  PRO  23           HB1      PRO  23  73.321   3.504 -13.543
  166    HG2  PRO  23           HG2      PRO  23  73.626   1.075 -14.598
  167    HG3  PRO  23           HG1      PRO  23  72.196   1.503 -13.642
  168    HD2  PRO  23           HD2      PRO  23  72.450   1.167 -16.606
  169    HD3  PRO  23           HD1      PRO  23  71.065   0.823 -15.545
  170    H    ARG  24           HN       ARG  24  74.178   5.257 -14.957
  171    HA   ARG  24           HA       ARG  24  74.266   6.406 -17.620
  172    HE   ARG  24           HE       ARG  24  70.491   9.291 -14.481
  173    HB2  ARG  24           HB2      ARG  24  74.060   8.803 -16.730
  174    HB3  ARG  24           HB1      ARG  24  72.557   7.890 -16.870
  175    HG2  ARG  24           HG2      ARG  24  72.565   7.383 -14.507
  176    HG3  ARG  24           HG1      ARG  24  74.177   8.073 -14.316
  177    HD2  ARG  24           HD2      ARG  24  72.649   9.750 -13.555
  178    HD3  ARG  24           HD1      ARG  24  73.194  10.274 -15.148
  179   HH11  ARG  24          HH21      ARG  24  72.865  10.181 -16.818
  180   HH12  ARG  24          HH22      ARG  24  71.713  10.437 -18.086
  181   HH21  ARG  24          HH11      ARG  24  68.973   9.619 -16.124
  182   HH22  ARG  24          HH12      ARG  24  69.510  10.119 -17.693
  183    H    LYS  25           HN       LYS  25  75.849   8.635 -17.111
  184    HA   LYS  25           HA       LYS  25  78.345   7.370 -16.322
  185    HB2  LYS  25           HB2      LYS  25  77.816  10.315 -16.810
  186    HB3  LYS  25           HB1      LYS  25  79.373   9.490 -16.882
  187    HG2  LYS  25           HG2      LYS  25  77.019   8.869 -18.689
  188    HG3  LYS  25           HG1      LYS  25  78.388   9.885 -19.144
  189    HD2  LYS  25           HD2      LYS  25  79.842   7.845 -18.435
  190    HD3  LYS  25           HD1      LYS  25  78.344   6.926 -18.582
  191    HE2  LYS  25           HE2      LYS  25  79.785   8.489 -20.731
  192    HE3  LYS  25           HE1      LYS  25  79.382   6.772 -20.720
  193    HZ1  LYS  25           HZ1      LYS  25  77.887   8.111 -22.120
  194    HZ2  LYS  25           HZ2      LYS  25  77.387   8.971 -20.743
  195    HZ3  LYS  25           HZ3      LYS  25  77.065   7.307 -20.872
  196    H    GLY  26           HN       GLY  26  76.311   9.957 -14.934
  197    HA2  GLY  26           HA2      GLY  26  76.132  10.692 -12.711
  198    HA3  GLY  26           HA1      GLY  26  76.908   9.182 -12.231
  199    HA   PRO  27           HA       PRO  27  79.740  12.960 -11.607
  200    HB2  PRO  27           HB2      PRO  27  79.922  11.808  -8.879
  201    HB3  PRO  27           HB1      PRO  27  79.675  13.491  -9.378
  202    HG2  PRO  27           HG2      PRO  27  77.708  12.017  -8.325
  203    HG3  PRO  27           HG1      PRO  27  77.406  13.242  -9.569
  204    HD2  PRO  27           HD2      PRO  27  77.478  10.258  -9.841
  205    HD3  PRO  27           HD1      PRO  27  76.455  11.444 -10.684
  206    HA   PRO  28           HA       PRO  28  83.002   9.940 -12.571
  207    HB2  PRO  28           HB2      PRO  28  84.689  12.386 -12.266
  208    HB3  PRO  28           HB1      PRO  28  84.631  11.214 -13.597
  209    HG2  PRO  28           HG2      PRO  28  83.536  13.639 -13.811
  210    HG3  PRO  28           HG1      PRO  28  82.812  12.215 -14.576
  211    HD2  PRO  28           HD2      PRO  28  81.912  13.711 -12.152
  212    HD3  PRO  28           HD1      PRO  28  80.949  12.820 -13.352
  213    H    LYS  29           HN       LYS  29  85.065   9.271 -11.506
  214    HA   LYS  29           HA       LYS  29  86.569   9.145  -9.655
  215    HB2  LYS  29           HB2      LYS  29  84.518  10.680  -8.035
  216    HB3  LYS  29           HB1      LYS  29  86.177  10.311  -7.584
  217    HG2  LYS  29           HG2      LYS  29  86.086  11.650 -10.162
  218    HG3  LYS  29           HG1      LYS  29  85.283  12.615  -8.923
  219    HD2  LYS  29           HD2      LYS  29  87.267  12.410  -7.471
  220    HD3  LYS  29           HD1      LYS  29  88.073  11.444  -8.707
  221    HE2  LYS  29           HE2      LYS  29  88.911  13.582  -9.148
  222    HE3  LYS  29           HE1      LYS  29  87.551  13.486 -10.266
  223    HZ1  LYS  29           HZ1      LYS  29  87.449  15.554  -9.103
  224    HZ2  LYS  29           HZ2      LYS  29  87.573  14.781  -7.596
  225    HZ3  LYS  29           HZ3      LYS  29  86.180  14.576  -8.546
  226    H1U  RCY  30           H1U      RCY  30  80.599   9.800  -7.479
  227    H1S  RCY  30           H1S      RCY  30  82.575   9.413  -4.934
  228    HB1  RCY  30           HB1      RCY  30  83.763   5.857  -5.725
  229    HB2  RCY  30           HB2      RCY  30  83.016   6.542  -7.168
  230    HA   RCY  30           HA       RCY  30  85.877   5.765  -6.696
  231    HN1  RCY  30           HN1      RCY  30  86.619   7.646  -7.888
  232    H    LYS  31           HN       LYS  31  85.470   6.300  -9.871
  233    HA   LYS  31           HA       LYS  31  84.056   3.710 -10.373
  234    HB2  LYS  31           HB2      LYS  31  83.696   4.565 -12.659
  235    HB3  LYS  31           HB1      LYS  31  83.038   5.680 -11.460
  236    HG2  LYS  31           HG2      LYS  31  85.227   6.950 -11.586
  237    HG3  LYS  31           HG1      LYS  31  85.651   5.938 -12.967
  238    HD2  LYS  31           HD2      LYS  31  83.023   7.404 -12.914
  239    HD3  LYS  31           HD1      LYS  31  84.496   8.237 -13.411
  240    HE2  LYS  31           HE2      LYS  31  83.402   5.686 -14.635
  241    HE3  LYS  31           HE1      LYS  31  83.349   7.289 -15.369
  242    HZ1  LYS  31           HZ1      LYS  31  85.982   6.782 -14.593
  243    HZ2  LYS  31           HZ2      LYS  31  85.365   6.943 -16.168
  244    HZ3  LYS  31           HZ3      LYS  31  85.433   5.414 -15.432
  245    H    GLN  32           HN       GLN  32  87.106   4.918 -10.061
  246    HA   GLN  32           HA       GLN  32  88.451   3.891 -12.377
  247    HB2  GLN  32           HB2      GLN  32  89.304   4.589  -9.574
  248    HB3  GLN  32           HB1      GLN  32  90.436   3.785 -10.662
  249    HG2  GLN  32           HG2      GLN  32  90.719   6.205 -10.845
  250    HG3  GLN  32           HG1      GLN  32  90.037   5.580 -12.347
  251   HE21  GLN  32          HE21      GLN  32  89.578   7.910  -9.893
  252   HE22  GLN  32          HE22      GLN  32  87.974   8.327 -10.259
  253    H    ARG  33           HN       ARG  33  86.568   2.177 -10.387
  254    HA   ARG  33           HA       ARG  33  86.453  -0.090  -9.780
  255    HE   ARG  33           HE       ARG  33  86.022  -1.217 -13.614
  256    HB2  ARG  33           HB2      ARG  33  86.904  -0.117 -12.339
  257    HB3  ARG  33           HB1      ARG  33  88.543  -0.593 -11.897
  258    HG2  ARG  33           HG2      ARG  33  87.653  -2.508 -10.626
  259    HG3  ARG  33           HG1      ARG  33  86.009  -2.032 -11.052
  260    HD2  ARG  33           HD2      ARG  33  88.184  -2.797 -13.024
  261    HD3  ARG  33           HD1      ARG  33  86.828  -3.820 -12.547
  262   HH11  ARG  33          HH21      ARG  33  86.866  -4.501 -14.236
  263   HH12  ARG  33          HH22      ARG  33  86.003  -4.579 -15.735
  264   HH21  ARG  33          HH11      ARG  33  84.890  -1.299 -15.569
  265   HH22  ARG  33          HH12      ARG  33  84.884  -2.766 -16.490
  266    H    GLN  34           HN       GLN  34  88.337   1.547  -8.347
  267    HA   GLN  34           HA       GLN  34  90.905   0.334  -8.085
  268    HB2  GLN  34           HB2      GLN  34  89.896   2.566  -7.073
  269    HB3  GLN  34           HB1      GLN  34  89.519   1.526  -5.700
  270    HG2  GLN  34           HG2      GLN  34  91.672   2.325  -5.182
  271    HG3  GLN  34           HG1      GLN  34  91.996   0.746  -5.898
  272   HE21  GLN  34          HE21      GLN  34  91.913   4.246  -6.681
  273   HE22  GLN  34          HE22      GLN  34  92.999   4.139  -7.981
  274    H    THR  35           HN       THR  35  90.632  -0.076  -5.094
  275    HA   THR  35           HA       THR  35  89.733  -2.909  -5.261
  276    HB   THR  35           HB       THR  35  91.195  -1.595  -2.962
  277    HG1  THR  35           HG1      THR  35  92.089  -2.462  -5.459
  278   HG21  THR  35          HG21      THR  35  90.112  -3.850  -2.674
  279   HG22  THR  35          HG22      THR  35  91.861  -3.858  -2.443
  280   HG23  THR  35          HG23      THR  35  91.167  -4.457  -3.950
  281    H    ARG  36           HN       ARG  36  87.767  -3.415  -4.436
  282    HA   ARG  36           HA       ARG  36  86.430  -1.459  -2.636
  283    HE   ARG  36           HE       ARG  36  84.783  -4.250  -6.917
  284    HB2  ARG  36           HB2      ARG  36  85.329  -3.886  -4.093
  285    HB3  ARG  36           HB1      ARG  36  84.380  -2.753  -3.131
  286    HG2  ARG  36           HG2      ARG  36  84.080  -1.808  -5.219
  287    HG3  ARG  36           HG1      ARG  36  85.557  -0.973  -4.737
  288    HD2  ARG  36           HD2      ARG  36  86.331  -1.760  -6.738
  289    HD3  ARG  36           HD1      ARG  36  86.619  -3.229  -5.805
  290   HH11  ARG  36          HH21      ARG  36  84.996  -0.855  -7.481
  291   HH12  ARG  36          HH22      ARG  36  83.811  -0.856  -8.744
  292   HH21  ARG  36          HH11      ARG  36  83.234  -4.270  -8.563
  293   HH22  ARG  36          HH12      ARG  36  82.813  -2.789  -9.357
  294    H    GLN  37           HN       GLN  37  88.459  -2.788  -1.342
  295    HA   GLN  37           HA       GLN  37  87.550  -5.233  -0.072
  296    HB2  GLN  37           HB2      GLN  37  89.476  -4.882   1.443
  297    HB3  GLN  37           HB1      GLN  37  89.947  -4.691  -0.247
  298    HG2  GLN  37           HG2      GLN  37  89.399  -2.162   0.153
  299    HG3  GLN  37           HG1      GLN  37  89.574  -2.575   1.859
  300   HE21  GLN  37          HE21      GLN  37  91.702  -3.996   2.259
  301   HE22  GLN  37          HE22      GLN  37  93.095  -3.434   1.468
  302    H1U  RCY  38           H1U      RCY  38  81.608   4.220   0.639
  303    H1S  RCY  38           H1S      RCY  38  83.108  -0.315   1.358
  304    HB1  RCY  38           HB1      RCY  38  84.470  -2.527   2.242
  305    HB2  RCY  38           HB2      RCY  38  84.968  -1.167   1.236
  306    HA   RCY  38           HA       RCY  38  86.859  -0.812   2.938
  307    HN1  RCY  38           HN1      RCY  38  87.849  -1.853   1.071
  308    H    LYS  39           HN       LYS  39  84.488  -2.585   4.129
  309    HA   LYS  39           HA       LYS  39  86.093  -3.567   6.357
  310    HB2  LYS  39           HB2      LYS  39  83.548  -2.656   6.179
  311    HB3  LYS  39           HB1      LYS  39  83.237  -4.387   6.097
  312    HG2  LYS  39           HG2      LYS  39  84.917  -3.052   8.241
  313    HG3  LYS  39           HG1      LYS  39  83.226  -3.512   8.442
  314    HD2  LYS  39           HD2      LYS  39  85.475  -5.423   7.740
  315    HD3  LYS  39           HD1      LYS  39  84.768  -5.239   9.346
  316    HE2  LYS  39           HE2      LYS  39  82.509  -5.639   7.949
  317    HE3  LYS  39           HE1      LYS  39  83.629  -6.518   6.908
  318    HZ1  LYS  39           HZ1      LYS  39  83.439  -8.185   8.338
  319    HZ2  LYS  39           HZ2      LYS  39  82.613  -7.228   9.473
  320    HZ3  LYS  39           HZ3      LYS  39  84.311  -7.253   9.455
  321    H    SER  40           HN       SER  40  87.349  -5.323   5.780
  322    HA   SER  40           HA       SER  40  86.008  -7.608   4.398
  323    HG   SER  40           HG       SER  40  89.361  -8.902   4.264
  324    HB2  SER  40           HB2      SER  40  88.039  -6.901   3.289
  325    HB3  SER  40           HB1      SER  40  88.932  -6.917   4.807
  326    H    LYS  41           HN       LYS  41  88.490  -7.155   6.951
  327    HA   LYS  41           HA       LYS  41  88.254  -9.694   8.126
  328    HB2  LYS  41           HB2      LYS  41  88.577  -7.446  10.044
  329    HB3  LYS  41           HB1      LYS  41  89.602  -8.855   9.784
  330    HG2  LYS  41           HG2      LYS  41  90.982  -7.202   8.931
  331    HG3  LYS  41           HG1      LYS  41  90.098  -7.642   7.469
  332    HD2  LYS  41           HD2      LYS  41  88.415  -5.821   8.125
  333    HD3  LYS  41           HD1      LYS  41  89.622  -5.277   9.290
  334    HE2  LYS  41           HE2      LYS  41  90.118  -5.593   6.315
  335    HE3  LYS  41           HE1      LYS  41  89.784  -4.060   7.120
  336    HZ1  LYS  41           HZ1      LYS  41  92.041  -4.053   7.179
  337    HZ2  LYS  41           HZ2      LYS  41  92.171  -5.746   7.239
  338    HZ3  LYS  41           HZ3      LYS  41  91.749  -4.874   8.634
  339    HA   PRO  42           HA       PRO  42  84.337 -10.280  10.057
  340    HB2  PRO  42           HB2      PRO  42  85.826 -10.117  12.664
  341    HB3  PRO  42           HB1      PRO  42  84.610 -11.299  12.140
  342    HG2  PRO  42           HG2      PRO  42  87.235 -11.837  12.099
  343    HG3  PRO  42           HG1      PRO  42  86.113 -12.497  10.899
  344    HD2  PRO  42           HD2      PRO  42  88.221 -10.467  10.541
  345    HD3  PRO  42           HD1      PRO  42  87.374 -11.435   9.316
  346    HA   PRO  43           HA       PRO  43  82.977  -6.221  11.231
  347    HB2  PRO  43           HB2      PRO  43  80.674  -6.804  12.599
  348    HB3  PRO  43           HB1      PRO  43  80.816  -6.921  10.834
  349    HG2  PRO  43           HG2      PRO  43  80.935  -9.077  12.882
  350    HG3  PRO  43           HG1      PRO  43  80.170  -9.077  11.284
  351    HD2  PRO  43           HD2      PRO  43  82.590 -10.263  11.769
  352    HD3  PRO  43           HD1      PRO  43  82.147  -9.583  10.188
  353    H    LYS  44           HN       LYS  44  83.769  -4.917  12.816
  354    HA   LYS  44           HA       LYS  44  83.622  -5.850  15.653
  355    HB2  LYS  44           HB2      LYS  44  85.995  -4.531  14.296
  356    HB3  LYS  44           HB1      LYS  44  85.871  -4.842  16.027
  357    HG2  LYS  44           HG2      LYS  44  85.568  -7.052  13.988
  358    HG3  LYS  44           HG1      LYS  44  87.143  -6.591  14.634
  359    HD2  LYS  44           HD2      LYS  44  86.045  -6.860  16.962
  360    HD3  LYS  44           HD1      LYS  44  84.775  -7.737  16.109
  361    HE2  LYS  44           HE2      LYS  44  86.342  -9.397  16.808
  362    HE3  LYS  44           HE1      LYS  44  86.636  -9.159  15.086
  363    HZ1  LYS  44           HZ1      LYS  44  88.718  -8.662  15.587
  364    HZ2  LYS  44           HZ2      LYS  44  88.397  -8.757  17.253
  365    HZ3  LYS  44           HZ3      LYS  44  88.179  -7.289  16.425
  366    H    LYS  45           HN       LYS  45  84.984  -2.920  14.156
  367    HA   LYS  45           HA       LYS  45  83.323  -1.278  15.956
  368    HB2  LYS  45           HB2      LYS  45  85.479  -0.589  13.940
  369    HB3  LYS  45           HB1      LYS  45  84.616   0.617  14.894
  370    HG2  LYS  45           HG2      LYS  45  85.491  -0.209  16.938
  371    HG3  LYS  45           HG1      LYS  45  86.016  -1.721  16.195
  372    HD2  LYS  45           HD2      LYS  45  87.149   0.768  15.035
  373    HD3  LYS  45           HD1      LYS  45  87.699   0.346  16.657
  374    HE2  LYS  45           HE2      LYS  45  89.140  -0.654  14.892
  375    HE3  LYS  45           HE1      LYS  45  88.358  -1.882  15.887
  376    HZ1  LYS  45           HZ1      LYS  45  86.652  -2.117  14.190
  377    HZ2  LYS  45           HZ2      LYS  45  88.194  -2.420  13.542
  378    HZ3  LYS  45           HZ3      LYS  45  87.414  -0.943  13.232
  379    H    GLY  46           HN       GLY  46  81.364  -2.201  14.682
  380    HA2  GLY  46           HA2      GLY  46  80.376  -0.112  12.950
  381    HA3  GLY  46           HA1      GLY  46  80.759  -1.565  12.025
  382    H    VAL  47           HN       VAL  47  79.411  -1.251  15.314
  383    HA   VAL  47           HA       VAL  47  77.493  -3.346  14.874
  384    HB   VAL  47           HB       VAL  47  77.579  -1.162  16.977
  385   HG11  VAL  47          HG11      VAL  47  75.334  -1.997  16.898
  386   HG12  VAL  47          HG12      VAL  47  76.122  -2.828  18.239
  387   HG13  VAL  47          HG13      VAL  47  75.891  -3.659  16.701
  388   HG21  VAL  47          HG21      VAL  47  79.521  -2.770  16.869
  389   HG22  VAL  47          HG22      VAL  47  78.376  -4.084  17.139
  390   HG23  VAL  47          HG23      VAL  47  78.610  -2.849  18.377
  391    H    GLN  48           HN       GLN  48  77.489   0.049  14.183
  392    HA   GLN  48           HA       GLN  48  74.765  -0.223  13.045
  393    HB2  GLN  48           HB2      GLN  48  74.811   0.784  15.486
  394    HB3  GLN  48           HB1      GLN  48  75.371   2.240  14.663
  395    HG2  GLN  48           HG2      GLN  48  72.810   0.719  14.088
  396    HG3  GLN  48           HG1      GLN  48  72.939   2.313  14.833
  397   HE21  GLN  48          HE21      GLN  48  72.788   0.637  11.805
  398   HE22  GLN  48          HE22      GLN  48  73.049   1.982  10.804
  399    H    GLY  49           HN       GLY  49  77.714   1.704  13.436
  400    HA2  GLY  49           HA2      GLY  49  78.068   2.183  10.673
  401    HA3  GLY  49           HA1      GLY  49  77.191   3.569  11.325
  402    H1U  RCY  50           H1U      RCY  50  80.811   5.020   6.081
  403    H1S  RCY  50           H1S      RCY  50  81.259   7.276  10.142
  404    HB1  RCY  50           HB1      RCY  50  81.926   3.717  10.483
  405    HB2  RCY  50           HB2      RCY  50  83.269   4.011  11.584
  406    HA   RCY  50           HA       RCY  50  82.216   2.251  12.671
  407    HN1  RCY  50           HN1      RCY  50  80.191   1.722  11.567
  408    H    GLY  51           HN       GLY  51  79.723   2.771  14.244
  409    HA2  GLY  51           HA2      GLY  51  79.716   3.432  16.582
  410    HA3  GLY  51           HA1      GLY  51  80.951   4.637  16.212
  411    H    ASP  52           HN       ASP  52  77.882   4.004  14.520
  412    HA   ASP  52           HA       ASP  52  77.235   6.887  14.771
  413    HB2  ASP  52           HB2      ASP  52  77.082   5.537  12.579
  414    HB3  ASP  52           HB1      ASP  52  75.630   4.813  13.270
  415    H    ASP  53           HN       ASP  53  74.467   6.808  14.683
  416    HA   ASP  53           HA       ASP  53  73.297   5.059  16.648
  417    HB2  ASP  53           HB2      ASP  53  73.011   6.670  18.476
  418    HB3  ASP  53           HB1      ASP  53  74.729   6.427  18.157
  419    H    ILE  54           HN       ILE  54  72.961   6.706  14.023
  420    HA   ILE  54           HA       ILE  54  70.091   7.260  14.476
  421    HB   ILE  54           HB       ILE  54  70.435   9.476  13.177
  422   HG12  ILE  54          HG12      ILE  54  73.194   9.268  14.395
  423   HG13  ILE  54          HG11      ILE  54  72.885   8.828  12.715
  424   HG21  ILE  54          HG21      ILE  54  69.796   9.278  15.587
  425   HG22  ILE  54          HG22      ILE  54  70.791  10.696  15.259
  426   HG23  ILE  54          HG23      ILE  54  71.509   9.269  16.007
  427   HD11  ILE  54          HD11      ILE  54  72.057  11.058  12.226
  428   HD12  ILE  54          HD12      ILE  54  73.637  11.206  12.996
  429   HD13  ILE  54          HD13      ILE  54  72.171  11.514  13.926
  430    HA   PRO  55           HA       PRO  55  71.066   5.383  10.363
  431    HB2  PRO  55           HB2      PRO  55  69.419   3.235  10.553
  432    HB3  PRO  55           HB1      PRO  55  71.041   3.253  11.272
  433    HG2  PRO  55           HG2      PRO  55  68.396   3.595  12.574
  434    HG3  PRO  55           HG1      PRO  55  69.855   2.788  13.170
  435    HD2  PRO  55           HD2      PRO  55  69.044   5.357  13.897
  436    HD3  PRO  55           HD1      PRO  55  70.694   4.723  14.070
  437    H    GLY  56           HN       GLY  56  69.759   7.505   9.934
  438    HA2  GLY  56           HA2      GLY  56  67.650   7.001   8.146
  439    HA3  GLY  56           HA1      GLY  56  66.894   7.373   9.696
  440    H    MET  57           HN       MET  57  68.142   9.384  10.784
  441    HA   MET  57           HA       MET  57  67.580  11.643   9.093
  442    HB2  MET  57           HB2      MET  57  67.508  11.572  11.644
  443    HB3  MET  57           HB1      MET  57  69.268  11.686  11.604
  444    HG2  MET  57           HG2      MET  57  68.924  13.746  10.095
  445    HG3  MET  57           HG1      MET  57  67.243  13.701  10.627
  446    HE1  MET  57           HE1      MET  57  66.726  13.198  13.206
  447    HE2  MET  57           HE2      MET  57  66.409  14.847  12.672
  448    HE3  MET  57           HE3      MET  57  67.178  14.565  14.233
  449    H    GLU  58           HN       GLU  58  68.935  11.255   7.218
  450    HA   GLU  58           HA       GLU  58  71.844  11.197   7.558
  451    HB2  GLU  58           HB2      GLU  58  71.954  10.976   5.185
  452    HB3  GLU  58           HB1      GLU  58  70.539  10.048   5.677
  453    HG2  GLU  58           HG2      GLU  58  70.592  12.826   4.473
  454    HG3  GLU  58           HG1      GLU  58  69.857  11.374   3.793
  455    H    GLY  59           HN       GLY  59  72.782  12.880   5.596
  456    HA2  GLY  59           HA2      GLY  59  71.653  15.559   5.902
  457    HA3  GLY  59           HA1      GLY  59  73.168  15.330   6.778
  458    H1U  RCY  60           H1U      RCY  60  76.117   7.795  -1.993
  459    H1S  RCY  60           H1S      RCY  60  73.952  11.625  -0.104
  460    HB1  RCY  60           HB1      RCY  60  73.355  12.715   1.426
  461    HB2  RCY  60           HB2      RCY  60  74.606  12.262   2.583
  462    HA   RCY  60           HA       RCY  60  75.162  14.760   2.732
  463    HN1  RCY  60           HN1      RCY  60  72.979  13.370   4.016
  464    H    GLY  61           HN       GLY  61  74.701  15.007   0.114
  465    HA2  GLY  61           HA2      GLY  61  72.873  17.283  -0.028
  466    HA3  GLY  61           HA1      GLY  61  73.898  16.694  -1.337
  467    H    THR  62           HN       THR  62  71.459  14.947   0.581
  468    HA   THR  62           HA       THR  62  69.529  13.806  -0.101
  469    HB   THR  62           HB       THR  62  68.131  14.908  -1.589
  470    HG1  THR  62           HG1      THR  62  69.738  14.474  -3.321
  471   HG21  THR  62          HG21      THR  62  70.017  17.213  -1.462
  472   HG22  THR  62          HG22      THR  62  69.499  16.507   0.069
  473   HG23  THR  62          HG23      THR  62  68.301  17.140  -1.060
  474    H    ASP  63           HN       ASP  63  72.367  13.178  -1.130
  475    HA   ASP  63           HA       ASP  63  72.031  11.992  -3.744
  476    HB2  ASP  63           HB2      ASP  63  74.237  12.628  -2.630
  477    HB3  ASP  63           HB1      ASP  63  74.057  11.173  -1.650
  478    H    ILE  64           HN       ILE  64  70.096  11.261  -1.498
  479    HA   ILE  64           HA       ILE  64  70.020   8.389  -2.119
  480    HB   ILE  64           HB       ILE  64  71.504   8.546  -0.111
  481   HG12  ILE  64          HG12      ILE  64  68.803   7.369   0.595
  482   HG13  ILE  64          HG11      ILE  64  69.898   6.617  -0.566
  483   HG21  ILE  64          HG21      ILE  64  70.682   9.396   1.963
  484   HG22  ILE  64          HG22      ILE  64  69.035   9.515   1.343
  485   HG23  ILE  64          HG23      ILE  64  70.280  10.619   0.758
  486   HD11  ILE  64          HD11      ILE  64  70.126   5.717   1.774
  487   HD12  ILE  64          HD12      ILE  64  70.679   7.314   2.278
  488   HD13  ILE  64          HD13      ILE  64  71.622   6.380   1.116
  489    H    THR  65           HN       THR  65  68.596  11.319  -0.985
  490    HA   THR  65           HA       THR  65  66.023  10.096  -0.279
  491    HB   THR  65           HB       THR  65  66.587  13.029  -0.778
  492    HG1  THR  65           HG1      THR  65  67.472  11.343   1.179
  493   HG21  THR  65          HG21      THR  65  64.679  13.406   0.596
  494   HG22  THR  65          HG22      THR  65  64.655  11.732   1.150
  495   HG23  THR  65          HG23      THR  65  64.209  12.118  -0.512
  496    H    VAL  66           HN       VAL  66  67.528  11.550  -3.085
  497    HA   VAL  66           HA       VAL  66  65.070  10.910  -4.652
  498    HB   VAL  66           HB       VAL  66  66.680  13.477  -4.801
  499   HG11  VAL  66          HG11      VAL  66  66.179  12.883  -7.055
  500   HG12  VAL  66          HG12      VAL  66  64.922  14.027  -6.583
  501   HG13  VAL  66          HG13      VAL  66  64.572  12.298  -6.621
  502   HG21  VAL  66          HG21      VAL  66  64.930  13.299  -3.008
  503   HG22  VAL  66          HG22      VAL  66  63.732  12.995  -4.267
  504   HG23  VAL  66          HG23      VAL  66  64.574  14.544  -4.206
  505    H    ILE  67           HN       ILE  67  68.521  11.092  -4.379
  506    HA   ILE  67           HA       ILE  67  68.755   9.640  -6.980
  507    HB   ILE  67           HB       ILE  67  70.749  11.710  -6.015
  508   HG12  ILE  67          HG12      ILE  67  69.669  12.802  -8.242
  509   HG13  ILE  67          HG11      ILE  67  68.253  11.959  -7.613
  510   HG21  ILE  67          HG21      ILE  67  71.524   9.852  -7.535
  511   HG22  ILE  67          HG22      ILE  67  71.700  11.466  -8.226
  512   HG23  ILE  67          HG23      ILE  67  70.367  10.429  -8.735
  513   HD11  ILE  67          HD11      ILE  67  68.914  13.038  -5.335
  514   HD12  ILE  67          HD12      ILE  67  68.126  14.049  -6.547
  515   HD13  ILE  67          HD13      ILE  67  69.872  14.143  -6.320
  516    H1U  RCY  68           H1U      RCY  68  72.285   1.548   0.638
  517    H1S  RCY  68           H1S      RCY  68  71.843   3.105  -3.328
  518    HB1  RCY  68           HB1      RCY  68  68.677   6.142  -4.219
  519    HB2  RCY  68           HB2      RCY  68  69.770   6.119  -2.840
  520    HA   RCY  68           HA       RCY  68  71.229   7.479  -3.898
  521    HN1  RCY  68           HN1      RCY  68  68.977   7.664  -5.830
  522    HA   PRO  69           HA       PRO  69  74.318   5.630  -6.405
  523    HB2  PRO  69           HB2      PRO  69  73.769   3.117  -4.852
  524    HB3  PRO  69           HB1      PRO  69  75.325   3.859  -5.275
  525    HG2  PRO  69           HG2      PRO  69  74.223   4.143  -2.849
  526    HG3  PRO  69           HG1      PRO  69  75.183   5.423  -3.607
  527    HD2  PRO  69           HD2      PRO  69  72.284   5.351  -3.080
  528    HD3  PRO  69           HD1      PRO  69  73.324   6.743  -3.453
  529    H    TRP  70           HN       TRP  70  71.278   3.813  -6.037
  530    HA   TRP  70           HA       TRP  70  71.775   2.034  -8.245
  531    HD1  TRP  70           HD1      TRP  70  69.625   5.017  -7.753
  532    HE1  TRP  70           HE1      TRP  70  67.910   6.154  -6.203
  533    HE3  TRP  70           HE3      TRP  70  67.868   0.934  -5.241
  534    HZ2  TRP  70           HZ2      TRP  70  66.035   5.427  -4.162
  535    HZ3  TRP  70           HZ3      TRP  70  66.122   1.183  -3.504
  536    HH2  TRP  70           HH2      TRP  70  65.204   3.419  -2.960
  537    HB2  TRP  70           HB2      TRP  70  69.255   1.754  -8.258
  538    HB3  TRP  70           HB1      TRP  70  70.043   1.396  -6.727
  539    H    GLU  71           HN       GLU  71  71.945   5.160  -8.455
  540    HA   GLU  71           HA       GLU  71  70.722   5.256 -11.174
  541    HB2  GLU  71           HB2      GLU  71  70.370   7.220  -8.906
  542    HB3  GLU  71           HB1      GLU  71  70.200   7.730 -10.586
  543    HG2  GLU  71           HG2      GLU  71  68.748   5.249  -9.895
  544    HG3  GLU  71           HG1      GLU  71  68.154   6.703  -9.090
  545    H    ALA  72           HN       ALA  72  73.239   6.133  -8.944
  546    HA   ALA  72           HA       ALA  72  74.553   8.040 -10.712
  547    HB1  ALA  72           HB1      ALA  72  75.797   6.488  -8.427
  548    HB2  ALA  72           HB2      ALA  72  74.830   7.943  -8.188
  549    HB3  ALA  72           HB3      ALA  72  76.339   8.026  -9.098
  550    H1U  RCY  73           H1U      RCY  73  79.538   4.194  -4.989
  551    H1S  RCY  73           H1S      RCY  73  78.094   6.513  -8.137
  552    HB1  RCY  73           HB1      RCY  73  79.422   5.939 -12.347
  553    HB2  RCY  73           HB2      RCY  73  79.691   4.555 -11.295
  554    HA   RCY  73           HA       RCY  73  77.320   5.133 -12.605
  555    HN1  RCY  73           HN1      RCY  73  77.196   6.515 -10.025
  556    H    ASN  74           HN       ASN  74  76.471   4.271  -9.433
  557    HA   ASN  74           HA       ASN  74  76.131   2.198  -8.390
  558    HB2  ASN  74           HB2      ASN  74  76.009   1.057 -11.186
  559    HB3  ASN  74           HB1      ASN  74  75.118   0.541  -9.755
  560   HD21  ASN  74          HD21      ASN  74  73.031   1.372  -9.565
  561   HD22  ASN  74          HD22      ASN  74  72.453   2.742 -10.383
  562    H    HIS  75           HN       HIS  75  77.679   0.786 -11.251
  563    HA   HIS  75           HA       HIS  75  79.514  -0.688 -11.337
  564    HD1  HIS  75           HD1      HIS  75  81.200  -1.851 -10.716
  565    HD2  HIS  75           HD2      HIS  75  83.562   1.564 -11.120
  566    HE1  HIS  75           HE1      HIS  75  83.537  -2.658 -11.264
  567    HE2  HIS  75           HE2      HIS  75  84.985  -0.590 -11.513
  568    HB2  HIS  75           HB2      HIS  75  80.525   1.645 -11.272
  569    HB3  HIS  75           HB1      HIS  75  80.792   1.392  -9.547
  570    H1U  RCY  76           H1U      RCY  76  75.586  -5.417  -2.927
  571    H1S  RCY  76           H1S      RCY  76  74.987  -2.097  -6.404
  572    HB1  RCY  76           HB1      RCY  76  78.305  -1.763  -6.599
  573    HB2  RCY  76           HB2      RCY  76  77.924  -3.473  -6.402
  574    HA   RCY  76           HA       RCY  76  80.130  -2.920  -7.599
  575    HN1  RCY  76           HN1      RCY  76  78.724  -2.463 -10.117
  576    H    GLU  77           HN       GLU  77  79.277  -4.003 -10.448
  577    HA   GLU  77           HA       GLU  77  78.073  -6.575  -9.894
  578    HB2  GLU  77           HB2      GLU  77  79.625  -5.516 -12.271
  579    HB3  GLU  77           HB1      GLU  77  78.882  -7.115 -12.230
  580    HG2  GLU  77           HG2      GLU  77  77.347  -4.555 -11.722
  581    HG3  GLU  77           HG1      GLU  77  77.452  -5.326 -13.305
  582    H    LEU  78           HN       LEU  78  80.261  -6.120  -8.130
  583    HA   LEU  78           HA       LEU  78  81.905  -8.486  -8.807
  584    HG   LEU  78           HG       LEU  78  84.217  -8.367  -7.732
  585    HB2  LEU  78           HB2      LEU  78  83.068  -6.345  -9.634
  586    HB3  LEU  78           HB1      LEU  78  83.244  -5.920  -7.932
  587   HD11  LEU  78          HD11      LEU  78  83.737  -9.055 -10.020
  588   HD12  LEU  78          HD12      LEU  78  85.485  -8.963  -9.807
  589   HD13  LEU  78          HD13      LEU  78  84.630  -7.675 -10.656
  590   HD21  LEU  78          HD21      LEU  78  86.477  -7.444  -8.176
  591   HD22  LEU  78          HD22      LEU  78  85.479  -6.303  -7.275
  592   HD23  LEU  78          HD23      LEU  78  85.743  -6.070  -9.003
  593    H    HIS  79           HN       HIS  79  82.133  -9.715  -6.992
  594    HA   HIS  79           HA       HIS  79  82.281  -8.427  -4.341
  595    HD1  HIS  79           HD1      HIS  79  79.441  -7.076  -3.647
  596    HD2  HIS  79           HD2      HIS  79  79.029  -9.335  -7.129
  597    HE1  HIS  79           HE1      HIS  79  77.919  -5.755  -5.181
  598    HE2  HIS  79           HE2      HIS  79  77.660  -7.119  -7.305
  599    HB2  HIS  79           HB2      HIS  79  80.184 -10.554  -4.793
  600    HB3  HIS  79           HB1      HIS  79  80.362  -9.466  -3.416
  601    H    GLU  80           HN       GLU  80  83.441  -9.695  -2.895
  602    HA   GLU  80           HA       GLU  80  83.915 -12.547  -3.528
  603    HB2  GLU  80           HB2      GLU  80  86.167 -10.524  -3.294
  604    HB3  GLU  80           HB1      GLU  80  86.369 -12.271  -3.431
  605    HG2  GLU  80           HG2      GLU  80  85.037 -12.120  -5.605
  606    HG3  GLU  80           HG1      GLU  80  85.236 -10.371  -5.494
  607    H    LEU  81           HN       LEU  81  84.757  -9.808  -1.394
  608    HA   LEU  81           HA       LEU  81  85.326 -11.578   0.853
  609    HG   LEU  81           HG       LEU  81  84.038  -8.465  -0.217
  610    HB2  LEU  81           HB2      LEU  81  85.495  -9.475   2.153
  611    HB3  LEU  81           HB1      LEU  81  86.448  -9.403   0.672
  612   HD11  LEU  81          HD11      LEU  81  82.990  -7.098   1.387
  613   HD12  LEU  81          HD12      LEU  81  84.386  -7.134   2.464
  614   HD13  LEU  81          HD13      LEU  81  83.363  -8.561   2.298
  615   HD21  LEU  81          HD21      LEU  81  86.370  -6.964   1.008
  616   HD22  LEU  81          HD22      LEU  81  85.101  -6.183   0.065
  617   HD23  LEU  81          HD23      LEU  81  86.147  -7.386  -0.689
  618    H    ALA  82           HN       ALA  82  82.550  -9.751  -0.318
  619    HA   ALA  82           HA       ALA  82  80.959  -9.850   2.046
  620    HB1  ALA  82           HB1      ALA  82  80.427  -8.528  -0.032
  621    HB2  ALA  82           HB2      ALA  82  79.062  -9.453   0.594
  622    HB3  ALA  82           HB3      ALA  82  79.955 -10.039  -0.809
  623    H    GLN  83           HN       GLN  83  81.100 -11.897   3.043
  624    HA   GLN  83           HA       GLN  83  79.342 -13.941   1.920
  625    HB2  GLN  83           HB2      GLN  83  81.376 -14.523   0.721
  626    HB3  GLN  83           HB1      GLN  83  82.316 -14.460   2.210
  627    HG2  GLN  83           HG2      GLN  83  81.696 -16.796   1.515
  628    HG3  GLN  83           HG1      GLN  83  81.111 -16.360   3.122
  629   HE21  GLN  83          HE21      GLN  83  80.120 -17.222  -0.124
  630   HE22  GLN  83          HE22      GLN  83  78.448 -17.186   0.167
  631    H    TYR  84           HN       TYR  84  81.188 -12.549   4.460
  632    HA   TYR  84           HA       TYR  84  79.744 -14.265   6.420
  633    HD1  TYR  84           HD2      TYR  84  83.359 -12.163   5.936
  634    HD2  TYR  84           HD1      TYR  84  82.695 -16.319   5.076
  635    HE1  TYR  84           HE2      TYR  84  85.065 -12.065   4.138
  636    HE2  TYR  84           HE1      TYR  84  84.401 -16.220   3.279
  637    HH   TYR  84           HH       TYR  84  85.998 -14.981   2.329
  638    HB2  TYR  84           HB2      TYR  84  82.255 -13.808   7.597
  639    HB3  TYR  84           HB1      TYR  84  81.668 -15.341   6.953
  640    H    GLY  85           HN       GLY  85  79.825 -11.352   5.340
  641    HA2  GLY  85           HA2      GLY  85  79.231 -10.111   7.900
  642    HA3  GLY  85           HA1      GLY  85  80.731  -9.504   7.200
  643    H    ILE  86           HN       ILE  86  79.584  -9.977   4.432
  644    HA   ILE  86           HA       ILE  86  78.653  -8.517   2.832
  645    HB   ILE  86           HB       ILE  86  76.393  -8.483   4.856
  646   HG12  ILE  86          HG12      ILE  86  77.012 -10.484   2.657
  647   HG13  ILE  86          HG11      ILE  86  77.192 -10.786   4.386
  648   HG21  ILE  86          HG21      ILE  86  74.976  -8.121   2.923
  649   HG22  ILE  86          HG22      ILE  86  76.347  -8.310   1.829
  650   HG23  ILE  86          HG23      ILE  86  76.256  -6.908   2.896
  651   HD11  ILE  86          HD11      ILE  86  74.613 -10.146   2.925
  652   HD12  ILE  86          HD12      ILE  86  74.756 -10.284   4.677
  653   HD13  ILE  86          HD13      ILE  86  75.054 -11.690   3.654
  654    H1U  RCY  87           H1U      RCY  87  80.224  -6.854   2.347
  655    H1S  RCY  87           H1S      RCY  87  76.468  -5.889   3.427
  656    HB1  RCY  87           HB1      RCY  87  76.268  -3.323   5.914
  657    HB2  RCY  87           HB2      RCY  87  75.545  -4.929   5.828
  658    HA   RCY  87           HA       RCY  87  78.148  -4.314   4.432
  659    HN1  RCY  87           HN1      RCY  87  76.619  -6.756   4.941
  Start of MODEL   16
    1    HA   MET   1           HA       MET   1  60.610  14.313  23.040
    2    HB2  MET   1           HB2      MET   1  58.521  14.755  20.903
    3    HB3  MET   1           HB1      MET   1  58.294  14.171  22.553
    4    HG2  MET   1           HG2      MET   1  59.109  16.424  23.365
    5    HG3  MET   1           HG1      MET   1  59.050  16.975  21.690
    6    HE1  MET   1           HE1      MET   1  57.635  18.853  22.748
    7    HE2  MET   1           HE2      MET   1  55.923  18.792  22.338
    8    HE3  MET   1           HE3      MET   1  57.131  18.464  21.098
    9    H    ASN   2           HN       ASN   2  62.366  14.013  20.536
   10    HA   ASN   2           HA       ASN   2  63.034  12.249  19.143
   11    HB2  ASN   2           HB2      ASN   2  62.747  11.073  21.426
   12    HB3  ASN   2           HB1      ASN   2  61.219  10.474  20.780
   13   HD21  ASN   2          HD21      ASN   2  61.459   8.429  19.883
   14   HD22  ASN   2          HD22      ASN   2  62.841   7.873  19.068
   15    H    LEU   3           HN       LEU   3  62.226  10.873  17.391
   16    HA   LEU   3           HA       LEU   3  59.335  10.764  16.921
   17    HG   LEU   3           HG       LEU   3  58.644  11.111  14.537
   18    HB2  LEU   3           HB2      LEU   3  60.155  13.098  16.193
   19    HB3  LEU   3           HB1      LEU   3  61.012  12.260  14.901
   20   HD11  LEU   3          HD11      LEU   3  57.816  13.837  15.545
   21   HD12  LEU   3          HD12      LEU   3  57.774  12.409  16.580
   22   HD13  LEU   3          HD13      LEU   3  56.784  12.471  15.122
   23   HD21  LEU   3          HD21      LEU   3  58.104  12.983  12.936
   24   HD22  LEU   3          HD22      LEU   3  59.767  12.405  12.822
   25   HD23  LEU   3          HD23      LEU   3  59.413  13.913  13.666
   26    H    GLU   4           HN       GLU   4  60.324   8.494  17.069
   27    HA   GLU   4           HA       GLU   4  62.096   7.383  15.216
   28    HB2  GLU   4           HB2      GLU   4  59.625   6.273  16.551
   29    HB3  GLU   4           HB1      GLU   4  60.592   5.280  15.462
   30    HG2  GLU   4           HG2      GLU   4  61.775   6.772  17.814
   31    HG3  GLU   4           HG1      GLU   4  61.219   5.101  17.917
   32    HA   PRO   5           HA       PRO   5  60.209   7.777  11.246
   33    HB2  PRO   5           HB2      PRO   5  60.862   5.313  10.126
   34    HB3  PRO   5           HB1      PRO   5  61.956   6.706  10.219
   35    HG2  PRO   5           HG2      PRO   5  61.813   4.297  11.949
   36    HG3  PRO   5           HG1      PRO   5  63.224   5.216  11.399
   37    HD2  PRO   5           HD2      PRO   5  62.233   5.454  13.923
   38    HD3  PRO   5           HD1      PRO   5  63.010   6.811  13.077
   39    HA   PRO   6           HA       PRO   6  56.258   5.792  11.295
   40    HB2  PRO   6           HB2      PRO   6  55.633   5.659   8.636
   41    HB3  PRO   6           HB1      PRO   6  55.652   7.179   9.551
   42    HG2  PRO   6           HG2      PRO   6  57.704   6.061   7.707
   43    HG3  PRO   6           HG1      PRO   6  57.146   7.732   7.898
   44    HD2  PRO   6           HD2      PRO   6  59.486   6.810   8.987
   45    HD3  PRO   6           HD1      PRO   6  58.540   8.136   9.699
   46    H    LYS   7           HN       LYS   7  55.643   3.699  11.578
   47    HA   LYS   7           HA       LYS   7  56.239   1.347  11.667
   48    HB2  LYS   7           HB2      LYS   7  55.099   0.341   9.652
   49    HB3  LYS   7           HB1      LYS   7  54.125   1.513  10.537
   50    HG2  LYS   7           HG2      LYS   7  55.827   2.619   8.368
   51    HG3  LYS   7           HG1      LYS   7  54.472   1.616   7.849
   52    HD2  LYS   7           HD2      LYS   7  52.945   2.999   9.241
   53    HD3  LYS   7           HD1      LYS   7  54.308   4.031   9.678
   54    HE2  LYS   7           HE2      LYS   7  53.357   5.187   7.871
   55    HE3  LYS   7           HE1      LYS   7  54.644   4.261   7.098
   56    HZ1  LYS   7           HZ1      LYS   7  53.021   2.552   6.543
   57    HZ2  LYS   7           HZ2      LYS   7  52.582   4.052   5.878
   58    HZ3  LYS   7           HZ3      LYS   7  51.787   3.467   7.261
   59    H    ALA   8           HN       ALA   8  56.433   0.607   8.461
   60    HA   ALA   8           HA       ALA   8  59.296   1.084   8.071
   61    HB1  ALA   8           HB1      ALA   8  59.843  -1.357   7.951
   62    HB2  ALA   8           HB2      ALA   8  58.243  -1.711   8.603
   63    HB3  ALA   8           HB3      ALA   8  59.416  -0.828   9.579
   64    H    GLU   9           HN       GLU   9  58.077  -1.839   6.746
   65    HA   GLU   9           HA       GLU   9  56.687  -0.744   4.470
   66    HB2  GLU   9           HB2      GLU   9  58.397  -1.095   2.760
   67    HB3  GLU   9           HB1      GLU   9  59.000   0.047   3.962
   68    HG2  GLU   9           HG2      GLU   9  60.067  -1.954   5.134
   69    HG3  GLU   9           HG1      GLU   9  59.691  -2.885   3.684
   70    H1U  RCY  10           H1U      RCY  10  61.579  -4.902  12.130
   71    H1S  RCY  10           H1S      RCY  10  58.982  -4.760   9.060
   72    HB1  RCY  10           HB1      RCY  10  56.615  -6.633   6.843
   73    HB2  RCY  10           HB2      RCY  10  56.786  -5.037   7.575
   74    HA   RCY  10           HA       RCY  10  57.809  -5.543   4.788
   75    HN1  RCY  10           HN1      RCY  10  57.778  -3.256   6.395
   76    H    ARG  11           HN       ARG  11  55.167  -3.402   5.423
   77    HA   ARG  11           HA       ARG  11  52.911  -5.024   5.090
   78    HE   ARG  11           HE       ARG  11  52.069  -0.146   4.310
   79    HB2  ARG  11           HB2      ARG  11  53.028  -2.478   5.441
   80    HB3  ARG  11           HB1      ARG  11  53.200  -2.361   3.689
   81    HG2  ARG  11           HG2      ARG  11  51.095  -3.818   3.539
   82    HG3  ARG  11           HG1      ARG  11  50.877  -3.490   5.258
   83    HD2  ARG  11           HD2      ARG  11  50.769  -1.577   2.942
   84    HD3  ARG  11           HD1      ARG  11  49.635  -1.767   4.279
   85   HH11  ARG  11          HH21      ARG  11  49.721  -1.925   6.101
   86   HH12  ARG  11          HH22      ARG  11  49.979  -1.044   7.570
   87   HH21  ARG  11          HH11      ARG  11  52.419   1.016   6.217
   88   HH22  ARG  11          HH12      ARG  11  51.507   0.621   7.636
   89    H    SER  12           HN       SER  12  55.407  -4.313   2.802
   90    HA   SER  12           HA       SER  12  54.012  -4.696   0.356
   91    HG   SER  12           HG       SER  12  57.044  -5.973   1.837
   92    HB2  SER  12           HB2      SER  12  56.123  -4.951  -0.638
   93    HB3  SER  12           HB1      SER  12  56.494  -4.013   0.806
   94    H    ALA  13           HN       ALA  13  55.122  -6.888  -0.923
   95    HA   ALA  13           HA       ALA  13  54.716  -9.305   0.672
   96    HB1  ALA  13           HB1      ALA  13  52.766  -8.769  -1.581
   97    HB2  ALA  13           HB2      ALA  13  52.377  -8.465   0.113
   98    HB3  ALA  13           HB3      ALA  13  52.741 -10.104  -0.429
   99    H    THR  14           HN       THR  14  56.997  -8.819  -0.545
  100    HA   THR  14           HA       THR  14  57.022 -10.736  -2.792
  101    HB   THR  14           HB       THR  14  58.497  -9.108  -4.112
  102    HG1  THR  14           HG1      THR  14  58.797  -7.233  -3.257
  103   HG21  THR  14          HG21      THR  14  56.583  -8.056  -5.160
  104   HG22  THR  14          HG22      THR  14  55.610  -8.283  -3.707
  105   HG23  THR  14          HG23      THR  14  56.113  -9.680  -4.659
  106    H    ARG  15           HN       ARG  15  58.122 -11.902  -0.995
  107    HA   ARG  15           HA       ARG  15  60.700 -10.884  -0.067
  108    HE   ARG  15           HE       ARG  15  61.767 -14.642   0.756
  109    HB2  ARG  15           HB2      ARG  15  58.904 -12.722   0.917
  110    HB3  ARG  15           HB1      ARG  15  60.148 -13.776   0.249
  111    HG2  ARG  15           HG2      ARG  15  60.674 -11.475   2.157
  112    HG3  ARG  15           HG1      ARG  15  60.602 -13.174   2.625
  113    HD2  ARG  15           HD2      ARG  15  62.599 -11.856   0.771
  114    HD3  ARG  15           HD1      ARG  15  62.923 -12.657   2.309
  115   HH11  ARG  15          HH21      ARG  15  64.388 -12.423   0.449
  116   HH12  ARG  15          HH22      ARG  15  65.334 -13.474  -0.552
  117   HH21  ARG  15          HH11      ARG  15  62.987 -16.027  -0.548
  118   HH22  ARG  15          HH12      ARG  15  64.541 -15.514  -1.116
  119    H    VAL  16           HN       VAL  16  59.548 -12.752  -2.740
  120    HA   VAL  16           HA       VAL  16  62.315 -12.974  -3.755
  121    HB   VAL  16           HB       VAL  16  62.010 -15.094  -2.563
  122   HG11  VAL  16          HG11      VAL  16  60.179 -16.599  -3.099
  123   HG12  VAL  16          HG12      VAL  16  59.587 -15.497  -4.342
  124   HG13  VAL  16          HG13      VAL  16  59.502 -15.036  -2.642
  125   HG21  VAL  16          HG21      VAL  16  63.108 -14.974  -4.877
  126   HG22  VAL  16          HG22      VAL  16  61.599 -15.628  -5.513
  127   HG23  VAL  16          HG23      VAL  16  62.552 -16.567  -4.364
  128    H    MET  17           HN       MET  17  62.372 -13.165  -6.053
  129    HA   MET  17           HA       MET  17  61.566 -12.828  -8.228
  130    HB2  MET  17           HB2      MET  17  60.270 -14.954  -7.497
  131    HB3  MET  17           HB1      MET  17  58.894 -13.871  -7.287
  132    HG2  MET  17           HG2      MET  17  59.291 -13.067  -9.657
  133    HG3  MET  17           HG1      MET  17  60.462 -14.375  -9.829
  134    HE1  MET  17           HE1      MET  17  59.221 -15.585 -11.815
  135    HE2  MET  17           HE2      MET  17  58.299 -14.084 -11.782
  136    HE3  MET  17           HE3      MET  17  57.455 -15.626 -11.901
  137    H    GLY  18           HN       GLY  18  60.958 -10.909  -9.107
  138    HA2  GLY  18           HA2      GLY  18  58.574  -9.501  -8.080
  139    HA3  GLY  18           HA1      GLY  18  60.110  -8.651  -7.902
  140    H    GLY  19           HN       GLY  19  57.526  -9.250 -10.006
  141    HA2  GLY  19           HA2      GLY  19  58.977  -8.878 -12.507
  142    HA3  GLY  19           HA1      GLY  19  57.224  -8.853 -12.316
  143    HA   PRO  20           HA       PRO  20  56.830  -4.464 -12.101
  144    HB2  PRO  20           HB2      PRO  20  56.699  -4.353  -9.120
  145    HB3  PRO  20           HB1      PRO  20  55.541  -3.756 -10.324
  146    HG2  PRO  20           HG2      PRO  20  55.065  -5.956  -8.907
  147    HG3  PRO  20           HG1      PRO  20  54.567  -5.819 -10.602
  148    HD2  PRO  20           HD2      PRO  20  56.852  -7.360  -9.428
  149    HD3  PRO  20           HD1      PRO  20  55.822  -7.755 -10.822
  150    H1U  RCY  21           H1U      RCY  21  61.890  -0.605  -5.085
  151    H1S  RCY  21           H1S      RCY  21  62.323  -1.963  -9.450
  152    HB1  RCY  21           HB1      RCY  21  62.219  -5.268 -11.848
  153    HB2  RCY  21           HB2      RCY  21  61.339  -5.410 -10.326
  154    HA   RCY  21           HA       RCY  21  60.750  -2.896 -10.707
  155    HN1  RCY  21           HN1      RCY  21  59.368  -4.797 -12.540
  156    H    THR  22           HN       THR  22  60.866  -1.195 -12.157
  157    HA   THR  22           HA       THR  22  61.645  -1.732 -14.955
  158    HB   THR  22           HB       THR  22  59.986  -0.083 -14.895
  159    HG1  THR  22           HG1      THR  22  62.205   1.615 -14.613
  160   HG21  THR  22          HG21      THR  22  61.425   0.942 -12.442
  161   HG22  THR  22          HG22      THR  22  59.798   0.269 -12.540
  162   HG23  THR  22          HG23      THR  22  60.142   1.851 -13.240
  163    HA   PRO  23           HA       PRO  23  65.913  -0.780 -14.161
  164    HB2  PRO  23           HB2      PRO  23  66.748  -0.132 -16.665
  165    HB3  PRO  23           HB1      PRO  23  66.310  -1.791 -16.210
  166    HG2  PRO  23           HG2      PRO  23  64.711   0.236 -17.696
  167    HG3  PRO  23           HG1      PRO  23  64.878  -1.504 -17.986
  168    HD2  PRO  23           HD2      PRO  23  62.719  -0.389 -16.694
  169    HD3  PRO  23           HD1      PRO  23  63.275  -2.055 -16.416
  170    H    ARG  24           HN       ARG  24  64.069   1.428 -13.607
  171    HA   ARG  24           HA       ARG  24  65.951   3.668 -14.105
  172    HE   ARG  24           HE       ARG  24  67.340   6.110 -16.877
  173    HB2  ARG  24           HB2      ARG  24  63.226   3.411 -15.236
  174    HB3  ARG  24           HB1      ARG  24  63.546   4.953 -14.445
  175    HG2  ARG  24           HG2      ARG  24  65.573   3.819 -16.354
  176    HG3  ARG  24           HG1      ARG  24  64.155   4.658 -16.985
  177    HD2  ARG  24           HD2      ARG  24  64.707   6.656 -15.718
  178    HD3  ARG  24           HD1      ARG  24  66.039   5.824 -14.916
  179   HH11  ARG  24          HH21      ARG  24  63.996   6.780 -17.381
  180   HH12  ARG  24          HH22      ARG  24  64.231   7.445 -18.963
  181   HH21  ARG  24          HH11      ARG  24  67.667   6.975 -18.939
  182   HH22  ARG  24          HH12      ARG  24  66.310   7.555 -19.845
  183    H    LYS  25           HN       LYS  25  66.375   3.405 -11.816
  184    HA   LYS  25           HA       LYS  25  64.135   3.850  -9.949
  185    HB2  LYS  25           HB2      LYS  25  66.469   2.429  -9.735
  186    HB3  LYS  25           HB1      LYS  25  66.915   3.920  -8.913
  187    HG2  LYS  25           HG2      LYS  25  65.982   2.647  -7.176
  188    HG3  LYS  25           HG1      LYS  25  64.620   3.643  -7.691
  189    HD2  LYS  25           HD2      LYS  25  63.626   1.544  -7.677
  190    HD3  LYS  25           HD1      LYS  25  64.184   1.626  -9.349
  191    HE2  LYS  25           HE2      LYS  25  64.801  -0.530  -8.312
  192    HE3  LYS  25           HE1      LYS  25  66.235   0.407  -8.732
  193    HZ1  LYS  25           HZ1      LYS  25  66.664   0.905  -6.550
  194    HZ2  LYS  25           HZ2      LYS  25  66.025  -0.661  -6.395
  195    HZ3  LYS  25           HZ3      LYS  25  65.056   0.692  -6.055
  196    H    GLY  26           HN       GLY  26  63.566   6.017 -10.645
  197    HA2  GLY  26           HA2      GLY  26  63.597   8.327 -10.107
  198    HA3  GLY  26           HA1      GLY  26  65.132   8.080  -9.272
  199    HA   PRO  27           HA       PRO  27  65.817  10.089 -13.482
  200    HB2  PRO  27           HB2      PRO  27  66.957  12.407 -12.551
  201    HB3  PRO  27           HB1      PRO  27  65.216  12.218 -12.837
  202    HG2  PRO  27           HG2      PRO  27  66.736  12.103 -10.284
  203    HG3  PRO  27           HG1      PRO  27  65.140  12.796 -10.621
  204    HD2  PRO  27           HD2      PRO  27  65.492  10.356  -9.412
  205    HD3  PRO  27           HD1      PRO  27  64.061  10.766 -10.383
  206    HA   PRO  28           HA       PRO  28  70.022   8.882 -14.062
  207    HB2  PRO  28           HB2      PRO  28  70.598  11.773 -14.641
  208    HB3  PRO  28           HB1      PRO  28  71.085  10.327 -15.547
  209    HG2  PRO  28           HG2      PRO  28  69.041  11.877 -16.323
  210    HG3  PRO  28           HG1      PRO  28  69.055  10.126 -16.581
  211    HD2  PRO  28           HD2      PRO  28  67.391  11.714 -14.733
  212    HD3  PRO  28           HD1      PRO  28  67.143  10.059 -15.329
  213    H    LYS  29           HN       LYS  29  71.946   8.790 -12.844
  214    HA   LYS  29           HA       LYS  29  72.813  10.890 -11.073
  215    HB2  LYS  29           HB2      LYS  29  72.381   9.452  -8.955
  216    HB3  LYS  29           HB1      LYS  29  71.027  10.369  -9.617
  217    HG2  LYS  29           HG2      LYS  29  70.175   8.403 -10.754
  218    HG3  LYS  29           HG1      LYS  29  71.597   7.469 -10.289
  219    HD2  LYS  29           HD2      LYS  29  70.927   7.287  -8.075
  220    HD3  LYS  29           HD1      LYS  29  69.975   8.771  -8.134
  221    HE2  LYS  29           HE2      LYS  29  69.169   6.404  -9.806
  222    HE3  LYS  29           HE1      LYS  29  68.730   6.469  -8.099
  223    HZ1  LYS  29           HZ1      LYS  29  67.189   7.499  -9.922
  224    HZ2  LYS  29           HZ2      LYS  29  68.235   8.829  -9.764
  225    HZ3  LYS  29           HZ3      LYS  29  67.375   8.256  -8.415
  226    H1U  RCY  30           H1U      RCY  30  78.167   5.826  -7.540
  227    H1S  RCY  30           H1S      RCY  30  75.781   5.331 -11.463
  228    HB1  RCY  30           HB1      RCY  30  75.187   7.210 -14.388
  229    HB2  RCY  30           HB2      RCY  30  74.323   6.023 -13.410
  230    HA   RCY  30           HA       RCY  30  75.400   6.951 -11.372
  231    HN1  RCY  30           HN1      RCY  30  73.559   8.542 -12.996
  232    H    LYS  31           HN       LYS  31  75.514  10.086 -12.148
  233    HA   LYS  31           HA       LYS  31  78.177  10.316 -13.268
  234    HB2  LYS  31           HB2      LYS  31  75.992  12.047 -12.771
  235    HB3  LYS  31           HB1      LYS  31  77.323  12.675 -11.801
  236    HG2  LYS  31           HG2      LYS  31  77.515  11.989 -14.750
  237    HG3  LYS  31           HG1      LYS  31  77.302  13.619 -14.110
  238    HD2  LYS  31           HD2      LYS  31  79.519  12.146 -12.862
  239    HD3  LYS  31           HD1      LYS  31  79.738  12.424 -14.590
  240    HE2  LYS  31           HE2      LYS  31  80.628  14.280 -13.133
  241    HE3  LYS  31           HE1      LYS  31  79.428  14.805 -14.315
  242    HZ1  LYS  31           HZ1      LYS  31  77.808  15.021 -12.704
  243    HZ2  LYS  31           HZ2      LYS  31  79.194  15.569 -11.889
  244    HZ3  LYS  31           HZ3      LYS  31  78.601  14.003 -11.603
  245    H    GLN  32           HN       GLN  32  80.012   9.928 -12.127
  246    HA   GLN  32           HA       GLN  32  80.306  10.921  -9.394
  247    HB2  GLN  32           HB2      GLN  32  79.101   8.680  -9.187
  248    HB3  GLN  32           HB1      GLN  32  80.572   7.937  -9.818
  249    HG2  GLN  32           HG2      GLN  32  81.877   8.839  -7.973
  250    HG3  GLN  32           HG1      GLN  32  80.478   9.731  -7.376
  251   HE21  GLN  32          HE21      GLN  32  80.936   8.371  -5.337
  252   HE22  GLN  32          HE22      GLN  32  80.251   6.820  -5.260
  253    H    ARG  33           HN       ARG  33  82.525  10.877  -8.715
  254    HA   ARG  33           HA       ARG  33  84.417  10.808 -10.955
  255    HE   ARG  33           HE       ARG  33  84.865   9.454  -5.790
  256    HB2  ARG  33           HB2      ARG  33  86.043  11.613  -9.254
  257    HB3  ARG  33           HB1      ARG  33  84.582  12.596  -9.288
  258    HG2  ARG  33           HG2      ARG  33  84.392  12.214  -7.070
  259    HG3  ARG  33           HG1      ARG  33  83.999  10.542  -7.474
  260    HD2  ARG  33           HD2      ARG  33  86.669  10.380  -7.666
  261    HD3  ARG  33           HD1      ARG  33  86.569  11.706  -6.507
  262   HH11  ARG  33          HH21      ARG  33  88.029  10.821  -5.727
  263   HH12  ARG  33          HH22      ARG  33  88.521   9.951  -4.313
  264   HH21  ARG  33          HH11      ARG  33  85.489   8.310  -3.944
  265   HH22  ARG  33          HH12      ARG  33  87.083   8.529  -3.303
  266    H    GLN  34           HN       GLN  34  83.171   8.271  -9.980
  267    HA   GLN  34           HA       GLN  34  85.124   6.768  -8.495
  268    HB2  GLN  34           HB2      GLN  34  83.863   4.791  -9.254
  269    HB3  GLN  34           HB1      GLN  34  82.764   6.058  -8.707
  270    HG2  GLN  34           HG2      GLN  34  82.569   6.805 -11.113
  271    HG3  GLN  34           HG1      GLN  34  83.470   5.359 -11.568
  272   HE21  GLN  34          HE21      GLN  34  82.442   3.236 -11.093
  273   HE22  GLN  34          HE22      GLN  34  80.760   3.133 -10.896
  274    H    THR  35           HN       THR  35  86.329   8.253 -10.702
  275    HA   THR  35           HA       THR  35  87.059   6.189 -12.686
  276    HB   THR  35           HB       THR  35  88.190   8.986 -12.422
  277    HG1  THR  35           HG1      THR  35  86.522   9.283 -14.168
  278   HG21  THR  35          HG21      THR  35  89.417   7.469 -13.905
  279   HG22  THR  35          HG22      THR  35  88.567   8.688 -14.855
  280   HG23  THR  35          HG23      THR  35  87.921   7.051 -14.740
  281    H    ARG  36           HN       ARG  36  88.235   7.501  -9.715
  282    HA   ARG  36           HA       ARG  36  90.999   6.569 -10.199
  283    HE   ARG  36           HE       ARG  36  89.134  11.634  -7.404
  284    HB2  ARG  36           HB2      ARG  36  90.009   7.509  -7.523
  285    HB3  ARG  36           HB1      ARG  36  91.590   7.739  -8.272
  286    HG2  ARG  36           HG2      ARG  36  90.477   9.231  -9.974
  287    HG3  ARG  36           HG1      ARG  36  88.999   9.120  -9.018
  288    HD2  ARG  36           HD2      ARG  36  90.595   9.830  -7.036
  289    HD3  ARG  36           HD1      ARG  36  91.595  10.462  -8.344
  290   HH11  ARG  36          HH21      ARG  36  91.030  10.940 -10.198
  291   HH12  ARG  36          HH22      ARG  36  90.414  12.276 -11.112
  292   HH21  ARG  36          HH11      ARG  36  88.319  13.384  -8.581
  293   HH22  ARG  36          HH12      ARG  36  88.879  13.660 -10.196
  294    H    GLN  37           HN       GLN  37  88.096   5.205  -9.207
  295    HA   GLN  37           HA       GLN  37  87.572   3.205  -8.091
  296    HB2  GLN  37           HB2      GLN  37  90.457   2.478  -8.662
  297    HB3  GLN  37           HB1      GLN  37  89.091   1.379  -8.464
  298    HG2  GLN  37           HG2      GLN  37  88.032   2.464 -10.483
  299    HG3  GLN  37           HG1      GLN  37  89.543   3.342 -10.727
  300   HE21  GLN  37          HE21      GLN  37  88.104   0.082 -10.722
  301   HE22  GLN  37          HE22      GLN  37  89.371  -0.659 -11.575
  302    H1U  RCY  38           H1U      RCY  38  84.727   5.041   1.155
  303    H1S  RCY  38           H1S      RCY  38  87.077   5.676  -2.641
  304    HB1  RCY  38           HB1      RCY  38  88.852   4.708  -2.828
  305    HB2  RCY  38           HB2      RCY  38  89.074   3.171  -3.663
  306    HA   RCY  38           HA       RCY  38  89.883   5.928  -4.508
  307    HN1  RCY  38           HN1      RCY  38  89.146   5.514  -6.695
  308    H    LYS  39           HN       LYS  39  92.098   5.977  -4.539
  309    HA   LYS  39           HA       LYS  39  93.583   3.394  -4.681
  310    HB2  LYS  39           HB2      LYS  39  95.577   4.948  -4.985
  311    HB3  LYS  39           HB1      LYS  39  94.385   4.984  -6.285
  312    HG2  LYS  39           HG2      LYS  39  93.524   7.058  -5.615
  313    HG3  LYS  39           HG1      LYS  39  94.154   6.898  -3.975
  314    HD2  LYS  39           HD2      LYS  39  96.448   7.156  -4.806
  315    HD3  LYS  39           HD1      LYS  39  95.850   7.264  -6.463
  316    HE2  LYS  39           HE2      LYS  39  94.987   9.167  -4.272
  317    HE3  LYS  39           HE1      LYS  39  96.340   9.495  -5.354
  318    HZ1  LYS  39           HZ1      LYS  39  94.428   8.788  -7.085
  319    HZ2  LYS  39           HZ2      LYS  39  94.758  10.393  -6.637
  320    HZ3  LYS  39           HZ3      LYS  39  93.496   9.541  -5.884
  321    H    SER  40           HN       SER  40  92.210   4.093  -2.250
  322    HA   SER  40           HA       SER  40  94.563   4.239  -0.436
  323    HG   SER  40           HG       SER  40  93.358   5.186   1.841
  324    HB2  SER  40           HB2      SER  40  93.505   6.529  -0.646
  325    HB3  SER  40           HB1      SER  40  92.035   5.842   0.039
  326    H    LYS  41           HN       LYS  41  92.155   4.597   1.611
  327    HA   LYS  41           HA       LYS  41  91.188   1.779   1.533
  328    HB2  LYS  41           HB2      LYS  41  91.595   1.826   4.109
  329    HB3  LYS  41           HB1      LYS  41  92.972   1.525   3.050
  330    HG2  LYS  41           HG2      LYS  41  92.391   4.377   3.632
  331    HG3  LYS  41           HG1      LYS  41  92.987   3.421   4.989
  332    HD2  LYS  41           HD2      LYS  41  94.922   2.704   3.666
  333    HD3  LYS  41           HD1      LYS  41  94.318   3.595   2.269
  334    HE2  LYS  41           HE2      LYS  41  95.993   4.964   3.358
  335    HE3  LYS  41           HE1      LYS  41  94.415   5.693   3.656
  336    HZ1  LYS  41           HZ1      LYS  41  96.172   4.242   5.504
  337    HZ2  LYS  41           HZ2      LYS  41  94.493   4.180   5.755
  338    HZ3  LYS  41           HZ3      LYS  41  95.299   5.675   5.749
  339    HA   PRO  42           HA       PRO  42  87.328   3.647   2.597
  340    HB2  PRO  42           HB2      PRO  42  86.192   1.630   4.110
  341    HB3  PRO  42           HB1      PRO  42  86.278   1.618   2.339
  342    HG2  PRO  42           HG2      PRO  42  87.997   0.225   4.323
  343    HG3  PRO  42           HG1      PRO  42  87.407  -0.331   2.748
  344    HD2  PRO  42           HD2      PRO  42  89.960   0.560   3.127
  345    HD3  PRO  42           HD1      PRO  42  89.100   0.745   1.582
  346    HA   PRO  43           HA       PRO  43  87.623   5.434   6.634
  347    HB2  PRO  43           HB2      PRO  43  84.997   5.898   7.261
  348    HB3  PRO  43           HB1      PRO  43  85.887   6.839   6.048
  349    HG2  PRO  43           HG2      PRO  43  83.960   4.604   5.660
  350    HG3  PRO  43           HG1      PRO  43  84.158   6.100   4.732
  351    HD2  PRO  43           HD2      PRO  43  85.139   3.685   3.887
  352    HD3  PRO  43           HD1      PRO  43  85.886   5.239   3.454
  353    H    LYS  44           HN       LYS  44  88.114   4.390   8.513
  354    HA   LYS  44           HA       LYS  44  86.464   2.041   9.324
  355    HB2  LYS  44           HB2      LYS  44  89.191   2.947  10.299
  356    HB3  LYS  44           HB1      LYS  44  88.374   1.457  10.765
  357    HG2  LYS  44           HG2      LYS  44  88.850   2.057   7.856
  358    HG3  LYS  44           HG1      LYS  44  90.148   1.380   8.839
  359    HD2  LYS  44           HD2      LYS  44  88.575  -0.452   9.538
  360    HD3  LYS  44           HD1      LYS  44  87.404   0.180   8.380
  361    HE2  LYS  44           HE2      LYS  44  88.768  -1.693   7.445
  362    HE3  LYS  44           HE1      LYS  44  88.958  -0.192   6.539
  363    HZ1  LYS  44           HZ1      LYS  44  91.057  -1.446   7.137
  364    HZ2  LYS  44           HZ2      LYS  44  90.790  -0.939   8.737
  365    HZ3  LYS  44           HZ3      LYS  44  91.031   0.209   7.508
  366    H    LYS  45           HN       LYS  45  86.907   5.319  10.030
  367    HA   LYS  45           HA       LYS  45  86.706   5.452  12.840
  368    HB2  LYS  45           HB2      LYS  45  85.406   7.617  12.371
  369    HB3  LYS  45           HB1      LYS  45  87.018   7.500  11.663
  370    HG2  LYS  45           HG2      LYS  45  86.116   6.918   9.509
  371    HG3  LYS  45           HG1      LYS  45  84.494   6.731  10.177
  372    HD2  LYS  45           HD2      LYS  45  84.502   9.148  10.786
  373    HD3  LYS  45           HD1      LYS  45  86.076   9.313  10.007
  374    HE2  LYS  45           HE2      LYS  45  83.656   8.225   8.555
  375    HE3  LYS  45           HE1      LYS  45  84.055   9.943   8.575
  376    HZ1  LYS  45           HZ1      LYS  45  86.222   8.124   7.906
  377    HZ2  LYS  45           HZ2      LYS  45  85.834   9.643   7.252
  378    HZ3  LYS  45           HZ3      LYS  45  84.984   8.258   6.754
  379    H    GLY  46           HN       GLY  46  84.243   4.729  10.424
  380    HA2  GLY  46           HA2      GLY  46  82.001   4.073  10.670
  381    HA3  GLY  46           HA1      GLY  46  82.555   3.303  12.157
  382    H    VAL  47           HN       VAL  47  82.070   6.689  11.078
  383    HA   VAL  47           HA       VAL  47  81.283   7.543  13.727
  384    HB   VAL  47           HB       VAL  47  82.277   9.146  12.202
  385   HG11  VAL  47          HG11      VAL  47  79.901   8.518  10.424
  386   HG12  VAL  47          HG12      VAL  47  81.589   8.134  10.088
  387   HG13  VAL  47          HG13      VAL  47  81.059   9.815  10.129
  388   HG21  VAL  47          HG21      VAL  47  79.350   9.885  12.347
  389   HG22  VAL  47          HG22      VAL  47  80.752  10.946  12.489
  390   HG23  VAL  47          HG23      VAL  47  80.360   9.822  13.791
  391    H    GLN  48           HN       GLN  48  79.663   5.843  11.287
  392    HA   GLN  48           HA       GLN  48  77.411   5.253  11.007
  393    HB2  GLN  48           HB2      GLN  48  76.953   6.334  13.791
  394    HB3  GLN  48           HB1      GLN  48  76.130   4.997  12.986
  395    HG2  GLN  48           HG2      GLN  48  78.395   3.818  12.924
  396    HG3  GLN  48           HG1      GLN  48  78.966   5.065  14.034
  397   HE21  GLN  48          HE21      GLN  48  76.109   5.158  15.222
  398   HE22  GLN  48          HE22      GLN  48  76.057   3.810  16.252
  399    H    GLY  49           HN       GLY  49  76.371   6.558   9.570
  400    HA2  GLY  49           HA2      GLY  49  74.686   8.214   9.096
  401    HA3  GLY  49           HA1      GLY  49  75.098   9.029  10.607
  402    H1U  RCY  50           H1U      RCY  50  73.984   6.293   3.466
  403    H1S  RCY  50           H1S      RCY  50  77.807   5.548   6.361
  404    HB1  RCY  50           HB1      RCY  50  79.364   9.611   5.545
  405    HB2  RCY  50           HB2      RCY  50  77.750   8.987   5.204
  406    HA   RCY  50           HA       RCY  50  78.778  10.186   7.783
  407    HN1  RCY  50           HN1      RCY  50  76.894   8.066   7.656
  408    H    GLY  51           HN       GLY  51  76.052   9.988   5.461
  409    HA2  GLY  51           HA2      GLY  51  74.787  11.706   4.484
  410    HA3  GLY  51           HA1      GLY  51  74.923  12.516   6.045
  411    H    ASP  52           HN       ASP  52  77.418  11.675   3.630
  412    HA   ASP  52           HA       ASP  52  78.624  14.320   3.929
  413    HB2  ASP  52           HB2      ASP  52  79.247  12.097   1.959
  414    HB3  ASP  52           HB1      ASP  52  80.258  13.507   2.279
  415    H    ASP  53           HN       ASP  53  77.297  12.556   1.102
  416    HA   ASP  53           HA       ASP  53  76.022  15.050   0.169
  417    HB2  ASP  53           HB2      ASP  53  78.308  15.174  -0.771
  418    HB3  ASP  53           HB1      ASP  53  78.089  13.583  -1.500
  419    H    ILE  54           HN       ILE  54  74.266  13.443   0.792
  420    HA   ILE  54           HA       ILE  54  73.714  11.001  -0.392
  421    HB   ILE  54           HB       ILE  54  71.871  13.311   0.241
  422   HG12  ILE  54          HG12      ILE  54  72.170  10.623   1.600
  423   HG13  ILE  54          HG11      ILE  54  73.156  12.017   2.045
  424   HG21  ILE  54          HG21      ILE  54  71.250  10.542  -0.799
  425   HG22  ILE  54          HG22      ILE  54  70.653  12.091  -1.395
  426   HG23  ILE  54          HG23      ILE  54  70.082  11.462   0.151
  427   HD11  ILE  54          HD11      ILE  54  70.129  12.077   1.983
  428   HD12  ILE  54          HD12      ILE  54  71.210  13.296   2.658
  429   HD13  ILE  54          HD13      ILE  54  71.060  11.720   3.437
  430    HA   PRO  55           HA       PRO  55  73.551  12.546  -4.676
  431    HB2  PRO  55           HB2      PRO  55  74.515  10.353  -5.888
  432    HB3  PRO  55           HB1      PRO  55  75.575  11.417  -4.942
  433    HG2  PRO  55           HG2      PRO  55  74.421   8.780  -4.210
  434    HG3  PRO  55           HG1      PRO  55  76.008   9.466  -3.828
  435    HD2  PRO  55           HD2      PRO  55  73.779   9.430  -2.107
  436    HD3  PRO  55           HD1      PRO  55  75.236  10.427  -1.900
  437    H    GLY  56           HN       GLY  56  71.191  11.362  -3.264
  438    HA2  GLY  56           HA2      GLY  56  69.765  10.452  -5.666
  439    HA3  GLY  56           HA1      GLY  56  69.882   9.245  -4.386
  440    H    MET  57           HN       MET  57  69.651  10.942  -2.143
  441    HA   MET  57           HA       MET  57  67.968  11.848  -0.785
  442    HB2  MET  57           HB2      MET  57  67.215  13.201  -3.396
  443    HB3  MET  57           HB1      MET  57  66.638  13.674  -1.799
  444    HG2  MET  57           HG2      MET  57  68.462  15.125  -2.194
  445    HG3  MET  57           HG1      MET  57  69.139  13.862  -1.165
  446    HE1  MET  57           HE1      MET  57  68.442  15.095  -4.655
  447    HE2  MET  57           HE2      MET  57  69.960  14.846  -5.515
  448    HE3  MET  57           HE3      MET  57  69.899  15.961  -4.152
  449    H    GLU  58           HN       GLU  58  67.463   9.389  -2.597
  450    HA   GLU  58           HA       GLU  58  64.568   9.483  -3.020
  451    HB2  GLU  58           HB2      GLU  58  64.786   7.229  -3.838
  452    HB3  GLU  58           HB1      GLU  58  66.163   8.141  -4.454
  453    HG2  GLU  58           HG2      GLU  58  66.184   6.346  -2.006
  454    HG3  GLU  58           HG1      GLU  58  66.898   5.959  -3.572
  455    H    GLY  59           HN       GLY  59  66.727   8.569  -0.458
  456    HA2  GLY  59           HA2      GLY  59  64.917   8.486   1.603
  457    HA3  GLY  59           HA1      GLY  59  64.777   6.870   0.910
  458    H1U  RCY  60           H1U      RCY  60  75.214   4.796  -2.144
  459    H1S  RCY  60           H1S      RCY  60  72.297   8.142  -0.209
  460    HB1  RCY  60           HB1      RCY  60  70.002   7.751   0.172
  461    HB2  RCY  60           HB2      RCY  60  70.473   6.063   0.356
  462    HA   RCY  60           HA       RCY  60  68.981   5.692   2.057
  463    HN1  RCY  60           HN1      RCY  60  67.807   7.359   0.160
  464    H    GLY  61           HN       GLY  61  69.371   5.912   4.202
  465    HA2  GLY  61           HA2      GLY  61  70.581   7.879   5.631
  466    HA3  GLY  61           HA1      GLY  61  68.946   8.525   5.482
  467    H    THR  62           HN       THR  62  68.240   5.430   5.416
  468    HA   THR  62           HA       THR  62  68.636   4.770   8.264
  469    HB   THR  62           HB       THR  62  66.146   4.455   8.577
  470    HG1  THR  62           HG1      THR  62  65.433   6.280   6.756
  471   HG21  THR  62          HG21      THR  62  67.488   6.460   9.379
  472   HG22  THR  62          HG22      THR  62  65.761   6.744   9.167
  473   HG23  THR  62          HG23      THR  62  66.904   7.316   7.952
  474    H    ASP  63           HN       ASP  63  67.157   3.936   5.146
  475    HA   ASP  63           HA       ASP  63  66.504   1.250   5.599
  476    HB2  ASP  63           HB2      ASP  63  66.919   0.899   3.184
  477    HB3  ASP  63           HB1      ASP  63  66.047   2.405   3.471
  478    H    ILE  64           HN       ILE  64  69.549   2.685   5.906
  479    HA   ILE  64           HA       ILE  64  71.102   0.294   5.182
  480    HB   ILE  64           HB       ILE  64  72.030   2.750   6.694
  481   HG12  ILE  64          HG12      ILE  64  72.060   2.232   3.703
  482   HG13  ILE  64          HG11      ILE  64  70.951   3.337   4.518
  483   HG21  ILE  64          HG21      ILE  64  73.511   0.744   4.965
  484   HG22  ILE  64          HG22      ILE  64  73.517   0.753   6.729
  485   HG23  ILE  64          HG23      ILE  64  74.230   2.098   5.838
  486   HD11  ILE  64          HD11      ILE  64  73.945   3.562   4.227
  487   HD12  ILE  64          HD12      ILE  64  73.080   4.445   5.485
  488   HD13  ILE  64          HD13      ILE  64  72.707   4.739   3.787
  489    H    THR  65           HN       THR  65  71.000   2.193   8.190
  490    HA   THR  65           HA       THR  65  70.789   1.489  10.420
  491    HB   THR  65           HB       THR  65  70.519  -1.384   9.593
  492    HG1  THR  65           HG1      THR  65  69.205  -0.279   8.141
  493   HG21  THR  65          HG21      THR  65  68.991  -1.442  11.474
  494   HG22  THR  65          HG22      THR  65  69.022   0.316  11.605
  495   HG23  THR  65          HG23      THR  65  70.466  -0.622  11.984
  496    H    VAL  66           HN       VAL  66  73.207   2.028   9.790
  497    HA   VAL  66           HA       VAL  66  75.461   1.575  10.227
  498    HB   VAL  66           HB       VAL  66  74.507  -0.905  11.671
  499   HG11  VAL  66          HG11      VAL  66  76.475  -0.405  13.093
  500   HG12  VAL  66          HG12      VAL  66  76.839   0.993  12.081
  501   HG13  VAL  66          HG13      VAL  66  76.937  -0.634  11.407
  502   HG21  VAL  66          HG21      VAL  66  74.550   1.973  12.632
  503   HG22  VAL  66          HG22      VAL  66  74.311   0.574  13.678
  504   HG23  VAL  66          HG23      VAL  66  73.121   0.958  12.434
  505    H    ILE  67           HN       ILE  67  74.044  -1.692   9.933
  506    HA   ILE  67           HA       ILE  67  75.649  -2.063   7.453
  507    HB   ILE  67           HB       ILE  67  76.740  -3.052   9.593
  508   HG12  ILE  67          HG12      ILE  67  76.148  -5.078   7.431
  509   HG13  ILE  67          HG11      ILE  67  77.156  -3.664   7.117
  510   HG21  ILE  67          HG21      ILE  67  75.819  -4.997  10.532
  511   HG22  ILE  67          HG22      ILE  67  74.783  -5.294   9.136
  512   HG23  ILE  67          HG23      ILE  67  74.395  -3.992  10.260
  513   HD11  ILE  67          HD11      ILE  67  78.703  -5.338   7.748
  514   HD12  ILE  67          HD12      ILE  67  77.660  -5.935   9.039
  515   HD13  ILE  67          HD13      ILE  67  78.483  -4.384   9.216
  516    H1U  RCY  68           H1U      RCY  68  76.597  -3.549   1.438
  517    H1S  RCY  68           H1S      RCY  68  72.936  -4.964   2.437
  518    HB1  RCY  68           HB1      RCY  68  72.864  -2.414   4.165
  519    HB2  RCY  68           HB2      RCY  68  71.268  -1.949   4.748
  520    HA   RCY  68           HA       RCY  68  71.411  -3.283   6.613
  521    HN1  RCY  68           HN1      RCY  68  73.997  -2.209   6.010
  522    HA   PRO  69           HA       PRO  69  71.750  -7.677   6.694
  523    HB2  PRO  69           HB2      PRO  69  69.826  -7.545   4.391
  524    HB3  PRO  69           HB1      PRO  69  69.774  -8.565   5.843
  525    HG2  PRO  69           HG2      PRO  69  68.292  -6.335   5.586
  526    HG3  PRO  69           HG1      PRO  69  68.908  -6.902   7.145
  527    HD2  PRO  69           HD2      PRO  69  69.697  -4.523   5.610
  528    HD3  PRO  69           HD1      PRO  69  70.036  -4.925   7.307
  529    H    TRP  70           HN       TRP  70  71.633  -6.303   3.384
  530    HA   TRP  70           HA       TRP  70  73.067  -8.493   2.189
  531    HD1  TRP  70           HD1      TRP  70  73.242  -8.832  -0.721
  532    HE1  TRP  70           HE1      TRP  70  71.129  -9.883  -1.756
  533    HE3  TRP  70           HE3      TRP  70  69.651  -5.961   1.500
  534    HZ2  TRP  70           HZ2      TRP  70  68.286  -9.550  -1.656
  535    HZ3  TRP  70           HZ3      TRP  70  67.254  -6.347   1.014
  536    HH2  TRP  70           HH2      TRP  70  66.566  -8.134  -0.558
  537    HB2  TRP  70           HB2      TRP  70  72.183  -5.779   1.367
  538    HB3  TRP  70           HB1      TRP  70  73.577  -6.417   0.496
  539    H    GLU  71           HN       GLU  71  74.207  -6.818   4.605
  540    HA   GLU  71           HA       GLU  71  76.991  -6.913   3.585
  541    HB2  GLU  71           HB2      GLU  71  76.052  -4.525   5.178
  542    HB3  GLU  71           HB1      GLU  71  77.540  -4.706   4.248
  543    HG2  GLU  71           HG2      GLU  71  76.168  -4.841   2.163
  544    HG3  GLU  71           HG1      GLU  71  74.729  -4.516   3.129
  545    H    ALA  72           HN       ALA  72  74.904  -8.035   5.730
  546    HA   ALA  72           HA       ALA  72  76.181  -7.558   8.270
  547    HB1  ALA  72           HB1      ALA  72  74.809  -9.402   9.085
  548    HB2  ALA  72           HB2      ALA  72  74.479  -9.923   7.432
  549    HB3  ALA  72           HB3      ALA  72  73.839  -8.387   8.017
  550    H1U  RCY  73           H1U      RCY  73  75.728  -5.217   5.390
  551    H1S  RCY  73           H1S      RCY  73  79.688  -5.965   5.173
  552    HB1  RCY  73           HB1      RCY  73  79.773  -9.632   4.652
  553    HB2  RCY  73           HB2      RCY  73  81.126 -10.176   5.644
  554    HA   RCY  73           HA       RCY  73  78.909 -11.023   6.453
  555    HN1  RCY  73           HN1      RCY  73  78.103  -8.281   6.223
  556    H    ASN  74           HN       ASN  74  80.077  -8.083   8.114
  557    HA   ASN  74           HA       ASN  74  80.263  -9.015  10.699
  558    HB2  ASN  74           HB2      ASN  74  82.342 -10.247   8.983
  559    HB3  ASN  74           HB1      ASN  74  82.964  -9.517  10.460
  560   HD21  ASN  74          HD21      ASN  74  79.666 -10.669  10.537
  561   HD22  ASN  74          HD22      ASN  74  79.964 -12.066  11.455
  562    H    HIS  75           HN       HIS  75  79.831  -6.612  10.338
  563    HA   HIS  75           HA       HIS  75  80.537  -4.364  10.385
  564    HD1  HIS  75           HD1      HIS  75  80.149  -2.866  12.106
  565    HD2  HIS  75           HD2      HIS  75  84.290  -3.129  12.531
  566    HE1  HIS  75           HE1      HIS  75  80.953  -0.547  12.733
  567    HE2  HIS  75           HE2      HIS  75  83.472  -0.694  12.995
  568    HB2  HIS  75           HB2      HIS  75  81.378  -5.444  12.580
  569    HB3  HIS  75           HB1      HIS  75  82.969  -5.439  11.821
  570    H1U  RCY  76           H1U      RCY  76  78.231  -1.333   3.707
  571    H1S  RCY  76           H1S      RCY  76  80.454  -2.137   7.957
  572    HB1  RCY  76           HB1      RCY  76  81.937  -3.674   5.851
  573    HB2  RCY  76           HB2      RCY  76  83.677  -3.391   5.793
  574    HA   RCY  76           HA       RCY  76  82.947  -5.788   6.300
  575    HN1  RCY  76           HN1      RCY  76  81.297  -5.747   8.006
  576    H    GLU  77           HN       GLU  77  84.523  -7.089   7.502
  577    HA   GLU  77           HA       GLU  77  86.567  -5.821   9.116
  578    HB2  GLU  77           HB2      GLU  77  86.014  -8.203   9.385
  579    HB3  GLU  77           HB1      GLU  77  86.544  -8.521   7.733
  580    HG2  GLU  77           HG2      GLU  77  88.817  -7.918   8.265
  581    HG3  GLU  77           HG1      GLU  77  88.342  -7.327   9.858
  582    H    LEU  78           HN       LEU  78  87.059  -7.611   6.060
  583    HA   LEU  78           HA       LEU  78  88.788  -5.376   5.106
  584    HG   LEU  78           HG       LEU  78  91.902  -6.996   5.480
  585    HB2  LEU  78           HB2      LEU  78  89.694  -7.935   6.021
  586    HB3  LEU  78           HB1      LEU  78  89.922  -7.887   4.276
  587   HD11  LEU  78          HD11      LEU  78  90.598  -4.609   4.218
  588   HD12  LEU  78          HD12      LEU  78  90.877  -6.045   3.233
  589   HD13  LEU  78          HD13      LEU  78  92.236  -5.229   4.006
  590   HD21  LEU  78          HD21      LEU  78  90.113  -5.966   7.247
  591   HD22  LEU  78          HD22      LEU  78  90.447  -4.534   6.273
  592   HD23  LEU  78          HD23      LEU  78  91.766  -5.373   7.089
  593    H    HIS  79           HN       HIS  79  89.293  -5.699   2.702
  594    HA   HIS  79           HA       HIS  79  86.798  -6.577   1.354
  595    HD1  HIS  79           HD1      HIS  79  86.158  -6.988  -0.530
  596    HD2  HIS  79           HD2      HIS  79  88.450  -4.032  -2.377
  597    HE1  HIS  79           HE1      HIS  79  85.467  -6.965  -2.967
  598    HE2  HIS  79           HE2      HIS  79  86.854  -5.170  -4.103
  599    HB2  HIS  79           HB2      HIS  79  87.693  -4.330   0.831
  600    HB3  HIS  79           HB1      HIS  79  89.197  -5.065   0.274
  601    H    GLU  80           HN       GLU  80  88.091  -8.777   2.219
  602    HA   GLU  80           HA       GLU  80  89.312  -9.880  -0.280
  603    HB2  GLU  80           HB2      GLU  80  90.229 -10.303   2.579
  604    HB3  GLU  80           HB1      GLU  80  90.783 -11.276   1.214
  605    HG2  GLU  80           HG2      GLU  80  91.476  -9.093   0.098
  606    HG3  GLU  80           HG1      GLU  80  91.184  -8.308   1.650
  607    H    LEU  81           HN       LEU  81  87.801 -10.705   2.857
  608    HA   LEU  81           HA       LEU  81  87.146 -13.388   2.189
  609    HG   LEU  81           HG       LEU  81  84.562 -11.058   3.283
  610    HB2  LEU  81           HB2      LEU  81  85.521 -13.287   4.001
  611    HB3  LEU  81           HB1      LEU  81  86.981 -12.432   4.489
  612   HD11  LEU  81          HD11      LEU  81  83.983 -12.075   5.455
  613   HD12  LEU  81          HD12      LEU  81  84.067 -10.318   5.589
  614   HD13  LEU  81          HD13      LEU  81  85.393 -11.314   6.190
  615   HD21  LEU  81          HD21      LEU  81  86.353  -9.601   2.982
  616   HD22  LEU  81          HD22      LEU  81  87.209 -10.196   4.405
  617   HD23  LEU  81          HD23      LEU  81  85.817  -9.130   4.595
  618    H    ALA  82           HN       ALA  82  86.168 -10.650   0.619
  619    HA   ALA  82           HA       ALA  82  83.419 -10.863   0.167
  620    HB1  ALA  82           HB1      ALA  82  84.977  -9.147  -0.841
  621    HB2  ALA  82           HB2      ALA  82  83.796  -9.805  -1.974
  622    HB3  ALA  82           HB3      ALA  82  85.467 -10.370  -2.013
  623    H    GLN  83           HN       GLN  83  86.014 -12.901  -1.088
  624    HA   GLN  83           HA       GLN  83  84.677 -14.292  -3.119
  625    HB2  GLN  83           HB2      GLN  83  86.484 -15.565  -1.041
  626    HB3  GLN  83           HB1      GLN  83  86.190 -16.138  -2.684
  627    HG2  GLN  83           HG2      GLN  83  87.089 -13.881  -3.481
  628    HG3  GLN  83           HG1      GLN  83  87.649 -13.633  -1.827
  629   HE21  GLN  83          HE21      GLN  83  89.844 -14.125  -1.736
  630   HE22  GLN  83          HE22      GLN  83  90.577 -15.454  -2.496
  631    H    TYR  84           HN       TYR  84  84.199 -14.427   0.341
  632    HA   TYR  84           HA       TYR  84  82.596 -16.869   0.264
  633    HD1  TYR  84           HD2      TYR  84  82.977 -18.449   2.514
  634    HD2  TYR  84           HD1      TYR  84  80.507 -15.017   3.269
  635    HE1  TYR  84           HE2      TYR  84  81.342 -19.887   3.702
  636    HE2  TYR  84           HE1      TYR  84  78.872 -16.454   4.457
  637    HH   TYR  84           HH       TYR  84  78.781 -18.584   5.589
  638    HB2  TYR  84           HB2      TYR  84  83.845 -16.106   2.304
  639    HB3  TYR  84           HB1      TYR  84  82.733 -14.744   2.425
  640    H    GLY  85           HN       GLY  85  81.971 -13.372   0.382
  641    HA2  GLY  85           HA2      GLY  85  79.088 -13.669   0.497
  642    HA3  GLY  85           HA1      GLY  85  79.956 -12.180   0.119
  643    H    ILE  86           HN       ILE  86  80.092 -15.330  -1.525
  644    HA   ILE  86           HA       ILE  86  80.268 -14.463  -4.135
  645    HB   ILE  86           HB       ILE  86  80.107 -16.885  -3.136
  646   HG12  ILE  86          HG12      ILE  86  80.671 -16.433  -5.469
  647   HG13  ILE  86          HG11      ILE  86  79.508 -17.758  -5.405
  648   HG21  ILE  86          HG21      ILE  86  77.980 -17.953  -3.306
  649   HG22  ILE  86          HG22      ILE  86  77.275 -16.575  -4.152
  650   HG23  ILE  86          HG23      ILE  86  77.682 -16.445  -2.441
  651   HD11  ILE  86          HD11      ILE  86  77.708 -15.907  -5.665
  652   HD12  ILE  86          HD12      ILE  86  78.643 -16.356  -7.091
  653   HD13  ILE  86          HD13      ILE  86  79.044 -14.887  -6.200
  654    H1U  RCY  87           H1U      RCY  87  77.051  -8.718  -1.195
  655    H1S  RCY  87           H1S      RCY  87  77.553  -9.657  -5.074
  656    HB1  RCY  87           HB1      RCY  87  77.322 -12.175  -7.374
  657    HB2  RCY  87           HB2      RCY  87  78.231 -11.158  -6.257
  658    HA   RCY  87           HA       RCY  87  76.556 -12.034  -4.463
  659    HN1  RCY  87           HN1      RCY  87  79.045 -13.097  -5.321
  Start of MODEL   17
    1    HA   MET   1           HA       MET   1  49.191   6.475  -2.688
    2    HB2  MET   1           HB2      MET   1  48.988   5.100   0.008
    3    HB3  MET   1           HB1      MET   1  50.086   6.435  -0.344
    4    HG2  MET   1           HG2      MET   1  48.127   7.409   0.643
    5    HG3  MET   1           HG1      MET   1  48.050   7.766  -1.083
    6    HE1  MET   1           HE1      MET   1  45.441   5.008   1.433
    7    HE2  MET   1           HE2      MET   1  46.213   6.518   1.911
    8    HE3  MET   1           HE3      MET   1  47.202   5.100   1.569
    9    H    ASN   2           HN       ASN   2  50.762   4.487  -0.433
   10    HA   ASN   2           HA       ASN   2  52.835   3.808  -2.363
   11    HB2  ASN   2           HB2      ASN   2  52.417   3.186   0.567
   12    HB3  ASN   2           HB1      ASN   2  53.782   2.538  -0.343
   13   HD21  ASN   2          HD21      ASN   2  52.240   5.785  -0.552
   14   HD22  ASN   2          HD22      ASN   2  53.656   6.646  -0.187
   15    H    LEU   3           HN       LEU   3  50.851   2.628  -3.563
   16    HA   LEU   3           HA       LEU   3  50.123   0.012  -2.600
   17    HG   LEU   3           HG       LEU   3  48.010  -0.493  -5.467
   18    HB2  LEU   3           HB2      LEU   3  49.084   1.564  -4.503
   19    HB3  LEU   3           HB1      LEU   3  50.163   0.634  -5.537
   20   HD11  LEU   3          HD11      LEU   3  48.725  -2.674  -4.765
   21   HD12  LEU   3          HD12      LEU   3  49.870  -1.994  -3.609
   22   HD13  LEU   3          HD13      LEU   3  50.167  -1.837  -5.340
   23   HD21  LEU   3          HD21      LEU   3  48.179  -1.068  -2.557
   24   HD22  LEU   3          HD22      LEU   3  46.761  -0.785  -3.566
   25   HD23  LEU   3          HD23      LEU   3  47.722   0.578  -2.994
   26    H    GLU   4           HN       GLU   4  52.401  -0.604  -1.985
   27    HA   GLU   4           HA       GLU   4  53.940  -1.632  -4.336
   28    HB2  GLU   4           HB2      GLU   4  54.986  -1.180  -1.534
   29    HB3  GLU   4           HB1      GLU   4  55.926  -1.483  -2.995
   30    HG2  GLU   4           HG2      GLU   4  54.221   0.963  -2.442
   31    HG3  GLU   4           HG1      GLU   4  55.984   0.905  -2.464
   32    HA   PRO   5           HA       PRO   5  52.520  -5.733  -3.169
   33    HB2  PRO   5           HB2      PRO   5  55.293  -6.393  -4.106
   34    HB3  PRO   5           HB1      PRO   5  53.756  -7.192  -4.492
   35    HG2  PRO   5           HG2      PRO   5  54.931  -5.513  -6.202
   36    HG3  PRO   5           HG1      PRO   5  53.169  -5.604  -6.046
   37    HD2  PRO   5           HD2      PRO   5  55.014  -3.451  -5.171
   38    HD3  PRO   5           HD1      PRO   5  53.278  -3.367  -5.542
   39    HA   PRO   6           HA       PRO   6  54.885  -5.645   0.746
   40    HB2  PRO   6           HB2      PRO   6  52.897  -6.541   2.358
   41    HB3  PRO   6           HB1      PRO   6  52.959  -4.867   1.774
   42    HG2  PRO   6           HG2      PRO   6  51.279  -7.129   0.840
   43    HG3  PRO   6           HG1      PRO   6  50.887  -5.408   0.971
   44    HD2  PRO   6           HD2      PRO   6  51.592  -6.710  -1.397
   45    HD3  PRO   6           HD1      PRO   6  51.668  -4.954  -1.136
   46    H    LYS   7           HN       LYS   7  55.826  -7.327   2.024
   47    HA   LYS   7           HA       LYS   7  55.036 -10.126   1.341
   48    HB2  LYS   7           HB2      LYS   7  57.428 -10.729   1.140
   49    HB3  LYS   7           HB1      LYS   7  56.965  -9.533  -0.071
   50    HG2  LYS   7           HG2      LYS   7  57.712  -7.891   1.963
   51    HG3  LYS   7           HG1      LYS   7  58.788  -9.259   2.252
   52    HD2  LYS   7           HD2      LYS   7  59.501  -9.162  -0.133
   53    HD3  LYS   7           HD1      LYS   7  58.492  -7.732  -0.351
   54    HE2  LYS   7           HE2      LYS   7  61.040  -8.037   1.192
   55    HE3  LYS   7           HE1      LYS   7  60.525  -6.727   0.131
   56    HZ1  LYS   7           HZ1      LYS   7  58.852  -6.133   1.824
   57    HZ2  LYS   7           HZ2      LYS   7  60.448  -5.978   2.385
   58    HZ3  LYS   7           HZ3      LYS   7  59.505  -7.311   2.856
   59    H    ALA   8           HN       ALA   8  54.049  -9.598   3.588
   60    HA   ALA   8           HA       ALA   8  54.122  -9.831   5.927
   61    HB1  ALA   8           HB1      ALA   8  56.427 -11.651   5.164
   62    HB2  ALA   8           HB2      ALA   8  54.731 -12.125   5.261
   63    HB3  ALA   8           HB3      ALA   8  55.600 -11.651   6.721
   64    H    GLU   9           HN       GLU   9  56.057  -7.881   4.444
   65    HA   GLU   9           HA       GLU   9  58.458  -7.602   5.897
   66    HB2  GLU   9           HB2      GLU   9  58.384  -5.225   5.240
   67    HB3  GLU   9           HB1      GLU   9  57.915  -6.262   3.893
   68    HG2  GLU   9           HG2      GLU   9  56.242  -4.623   3.855
   69    HG3  GLU   9           HG1      GLU   9  55.484  -5.905   4.801
   70    H1U  RCY  10           H1U      RCY  10  53.758  -8.649   5.388
   71    H1S  RCY  10           H1S      RCY  10  54.675  -7.443   9.166
   72    HB1  RCY  10           HB1      RCY  10  58.039  -5.735  11.165
   73    HB2  RCY  10           HB2      RCY  10  58.843  -6.708   9.934
   74    HA   RCY  10           HA       RCY  10  56.477  -4.999   9.197
   75    HN1  RCY  10           HN1      RCY  10  58.695  -5.422   7.344
   76    H    ARG  11           HN       ARG  11  57.022  -3.305  10.784
   77    HA   ARG  11           HA       ARG  11  58.781  -1.301   9.648
   78    HE   ARG  11           HE       ARG  11  53.616  -0.866  10.007
   79    HB2  ARG  11           HB2      ARG  11  57.177  -1.484  12.201
   80    HB3  ARG  11           HB1      ARG  11  58.250  -0.120  11.886
   81    HG2  ARG  11           HG2      ARG  11  55.965   0.400  11.140
   82    HG3  ARG  11           HG1      ARG  11  57.058   0.314   9.759
   83    HD2  ARG  11           HD2      ARG  11  56.230  -1.782   9.077
   84    HD3  ARG  11           HD1      ARG  11  55.518  -2.116  10.655
   85   HH11  ARG  11          HH21      ARG  11  56.312  -0.352   7.921
   86   HH12  ARG  11          HH22      ARG  11  55.406   0.550   6.752
   87   HH21  ARG  11          HH11      ARG  11  52.416   0.308   8.493
   88   HH22  ARG  11          HH12      ARG  11  53.200   0.924   7.076
   89    H    SER  12           HN       SER  12  60.956  -1.698   9.739
   90    HA   SER  12           HA       SER  12  63.056  -2.278  10.628
   91    HG   SER  12           HG       SER  12  64.473  -0.863  12.147
   92    HB2  SER  12           HB2      SER  12  62.428  -0.160  11.883
   93    HB3  SER  12           HB1      SER  12  61.872  -1.193  13.197
   94    H    ALA  13           HN       ALA  13  63.891  -3.226  13.061
   95    HA   ALA  13           HA       ALA  13  62.763  -5.931  13.044
   96    HB1  ALA  13           HB1      ALA  13  64.960  -4.661  14.707
   97    HB2  ALA  13           HB2      ALA  13  65.176  -5.675  13.280
   98    HB3  ALA  13           HB3      ALA  13  64.527  -6.370  14.766
   99    H    THR  14           HN       THR  14  63.697  -4.277  16.018
  100    HA   THR  14           HA       THR  14  60.882  -4.234  16.945
  101    HB   THR  14           HB       THR  14  61.742  -6.492  17.528
  102    HG1  THR  14           HG1      THR  14  60.449  -6.070  19.120
  103   HG21  THR  14          HG21      THR  14  63.641  -6.795  18.925
  104   HG22  THR  14          HG22      THR  14  63.723  -5.077  19.315
  105   HG23  THR  14          HG23      THR  14  64.152  -5.636  17.699
  106    H    ARG  15           HN       ARG  15  63.422  -2.461  16.462
  107    HA   ARG  15           HA       ARG  15  62.908  -0.727  18.776
  108    HE   ARG  15           HE       ARG  15  66.965  -1.089  20.165
  109    HB2  ARG  15           HB2      ARG  15  65.310  -0.568  19.392
  110    HB3  ARG  15           HB1      ARG  15  64.668  -2.188  19.662
  111    HG2  ARG  15           HG2      ARG  15  65.521  -2.736  17.297
  112    HG3  ARG  15           HG1      ARG  15  66.442  -1.236  17.410
  113    HD2  ARG  15           HD2      ARG  15  66.728  -3.756  19.020
  114    HD3  ARG  15           HD1      ARG  15  67.977  -2.790  18.236
  115   HH11  ARG  15          HH21      ARG  15  68.172  -4.317  20.084
  116   HH12  ARG  15          HH22      ARG  15  68.799  -4.265  21.698
  117   HH21  ARG  15          HH11      ARG  15  67.777  -1.001  22.273
  118   HH22  ARG  15          HH12      ARG  15  68.575  -2.387  22.937
  119    H    VAL  16           HN       VAL  16  62.900   1.336  18.027
  120    HA   VAL  16           HA       VAL  16  63.769   1.882  15.293
  121    HB   VAL  16           HB       VAL  16  62.894   3.934  17.333
  122   HG11  VAL  16          HG11      VAL  16  63.795   4.616  15.067
  123   HG12  VAL  16          HG12      VAL  16  62.146   5.152  15.392
  124   HG13  VAL  16          HG13      VAL  16  62.432   3.762  14.344
  125   HG21  VAL  16          HG21      VAL  16  60.569   3.479  16.437
  126   HG22  VAL  16          HG22      VAL  16  61.226   2.190  17.446
  127   HG23  VAL  16          HG23      VAL  16  61.214   2.017  15.691
  128    H    MET  17           HN       MET  17  65.556   3.117  14.674
  129    HA   MET  17           HA       MET  17  67.680   3.386  16.704
  130    HB2  MET  17           HB2      MET  17  68.080   2.462  14.376
  131    HB3  MET  17           HB1      MET  17  67.806   4.090  13.759
  132    HG2  MET  17           HG2      MET  17  69.602   4.820  15.484
  133    HG3  MET  17           HG1      MET  17  70.028   3.109  15.546
  134    HE1  MET  17           HE1      MET  17  72.907   4.352  13.388
  135    HE2  MET  17           HE2      MET  17  72.392   3.316  14.716
  136    HE3  MET  17           HE3      MET  17  72.176   5.061  14.833
  137    H    GLY  18           HN       GLY  18  68.079   5.703  14.300
  138    HA2  GLY  18           HA2      GLY  18  67.751   7.872  16.215
  139    HA3  GLY  18           HA1      GLY  18  68.239   8.047  14.529
  140    H    GLY  19           HN       GLY  19  65.338   7.152  16.428
  141    HA2  GLY  19           HA2      GLY  19  63.121   7.902  16.185
  142    HA3  GLY  19           HA1      GLY  19  63.722   9.151  15.094
  143    HA   PRO  20           HA       PRO  20  61.104   5.834  12.858
  144    HB2  PRO  20           HB2      PRO  20  60.274   8.411  11.578
  145    HB3  PRO  20           HB1      PRO  20  59.289   7.002  12.018
  146    HG2  PRO  20           HG2      PRO  20  59.263   9.234  13.473
  147    HG3  PRO  20           HG1      PRO  20  59.128   7.633  14.219
  148    HD2  PRO  20           HD2      PRO  20  61.435   9.519  14.222
  149    HD3  PRO  20           HD1      PRO  20  60.979   8.289  15.422
  150    H1U  RCY  21           H1U      RCY  21  65.023   2.043   4.061
  151    H1S  RCY  21           H1S      RCY  21  61.903   2.368   7.546
  152    HB1  RCY  21           HB1      RCY  21  64.791   4.123  10.545
  153    HB2  RCY  21           HB2      RCY  21  64.934   4.264   8.793
  154    HA   RCY  21           HA       RCY  21  64.260   6.421   9.717
  155    HN1  RCY  21           HN1      RCY  21  62.390   4.860  11.336
  156    H    THR  22           HN       THR  22  63.533   7.522   7.972
  157    HA   THR  22           HA       THR  22  61.255   6.373   6.403
  158    HB   THR  22           HB       THR  22  60.774   8.653   5.692
  159    HG1  THR  22           HG1      THR  22  62.498   9.853   5.635
  160   HG21  THR  22          HG21      THR  22  61.288   8.680   8.674
  161   HG22  THR  22          HG22      THR  22  59.954   7.798   7.932
  162   HG23  THR  22          HG23      THR  22  60.035   9.554   7.793
  163    HA   PRO  23           HA       PRO  23  64.832   5.576   3.619
  164    HB2  PRO  23           HB2      PRO  23  62.504   4.588   2.012
  165    HB3  PRO  23           HB1      PRO  23  64.079   3.822   2.303
  166    HG2  PRO  23           HG2      PRO  23  61.885   3.004   3.567
  167    HG3  PRO  23           HG1      PRO  23  63.460   3.040   4.378
  168    HD2  PRO  23           HD2      PRO  23  61.121   4.861   4.733
  169    HD3  PRO  23           HD1      PRO  23  62.368   4.382   5.906
  170    H    ARG  24           HN       ARG  24  61.725   7.090   2.809
  171    HA   ARG  24           HA       ARG  24  62.751   8.317   0.368
  172    HE   ARG  24           HE       ARG  24  58.371   8.882   4.315
  173    HB2  ARG  24           HB2      ARG  24  60.573   9.712   0.661
  174    HB3  ARG  24           HB1      ARG  24  60.417   7.987   0.330
  175    HG2  ARG  24           HG2      ARG  24  60.013   7.494   2.648
  176    HG3  ARG  24           HG1      ARG  24  60.443   9.135   3.132
  177    HD2  ARG  24           HD2      ARG  24  58.510   9.938   1.680
  178    HD3  ARG  24           HD1      ARG  24  58.015   8.250   1.559
  179   HH11  ARG  24          HH21      ARG  24  56.387   9.614   1.592
  180   HH12  ARG  24          HH22      ARG  24  54.977   9.947   2.540
  181   HH21  ARG  24          HH11      ARG  24  56.541   9.313   5.570
  182   HH22  ARG  24          HH12      ARG  24  55.064   9.777   4.793
  183    H    LYS  25           HN       LYS  25  64.676   9.324   1.347
  184    HA   LYS  25           HA       LYS  25  64.539  11.282   3.416
  185    HB2  LYS  25           HB2      LYS  25  66.619  10.154   2.369
  186    HB3  LYS  25           HB1      LYS  25  66.504  11.398   1.126
  187    HG2  LYS  25           HG2      LYS  25  67.972  12.325   2.739
  188    HG3  LYS  25           HG1      LYS  25  66.417  13.084   3.081
  189    HD2  LYS  25           HD2      LYS  25  66.058  11.795   4.996
  190    HD3  LYS  25           HD1      LYS  25  67.153  10.519   4.463
  191    HE2  LYS  25           HE2      LYS  25  69.081  11.993   4.817
  192    HE3  LYS  25           HE1      LYS  25  68.007  13.309   5.291
  193    HZ1  LYS  25           HZ1      LYS  25  68.137  10.690   6.679
  194    HZ2  LYS  25           HZ2      LYS  25  67.283  12.072   7.176
  195    HZ3  LYS  25           HZ3      LYS  25  68.982  12.073   7.183
  196    H    GLY  26           HN       GLY  26  65.264  12.110   0.018
  197    HA2  GLY  26           HA2      GLY  26  63.172  13.651  -0.779
  198    HA3  GLY  26           HA1      GLY  26  63.943  14.711   0.402
  199    HA   PRO  27           HA       PRO  27  65.738  15.603  -3.838
  200    HB2  PRO  27           HB2      PRO  27  66.158  18.149  -2.316
  201    HB3  PRO  27           HB1      PRO  27  65.600  17.914  -3.984
  202    HG2  PRO  27           HG2      PRO  27  63.916  18.572  -2.034
  203    HG3  PRO  27           HG1      PRO  27  63.440  17.477  -3.343
  204    HD2  PRO  27           HD2      PRO  27  64.058  16.845  -0.493
  205    HD3  PRO  27           HD1      PRO  27  62.957  16.022  -1.620
  206    HA   PRO  28           HA       PRO  28  70.037  14.838  -3.162
  207    HB2  PRO  28           HB2      PRO  28  70.499  17.654  -4.109
  208    HB3  PRO  28           HB1      PRO  28  71.340  16.161  -4.573
  209    HG2  PRO  28           HG2      PRO  28  69.454  17.266  -6.117
  210    HG3  PRO  28           HG1      PRO  28  69.678  15.513  -6.012
  211    HD2  PRO  28           HD2      PRO  28  67.458  17.163  -4.981
  212    HD3  PRO  28           HD1      PRO  28  67.513  15.413  -5.281
  213    H    LYS  29           HN       LYS  29  71.115  14.894  -1.231
  214    HA   LYS  29           HA       LYS  29  71.758  17.343   0.153
  215    HB2  LYS  29           HB2      LYS  29  69.264  17.019   0.650
  216    HB3  LYS  29           HB1      LYS  29  69.741  15.596   1.576
  217    HG2  LYS  29           HG2      LYS  29  71.390  17.160   2.793
  218    HG3  LYS  29           HG1      LYS  29  70.464  18.483   2.083
  219    HD2  LYS  29           HD2      LYS  29  68.417  17.666   3.132
  220    HD3  LYS  29           HD1      LYS  29  69.272  16.260   3.767
  221    HE2  LYS  29           HE2      LYS  29  69.120  17.881   5.550
  222    HE3  LYS  29           HE1      LYS  29  70.796  17.849   5.002
  223    HZ1  LYS  29           HZ1      LYS  29  70.538  19.840   3.854
  224    HZ2  LYS  29           HZ2      LYS  29  69.696  20.106   5.306
  225    HZ3  LYS  29           HZ3      LYS  29  68.843  19.759   3.878
  226    H1U  RCY  30           H1U      RCY  30  76.591  11.707  -6.376
  227    H1S  RCY  30           H1S      RCY  30  74.727  14.141  -2.620
  228    HB1  RCY  30           HB1      RCY  30  74.447  13.047  -0.941
  229    HB2  RCY  30           HB2      RCY  30  75.720  12.659   0.216
  230    HA   RCY  30           HA       RCY  30  73.816  13.391   1.491
  231    HN1  RCY  30           HN1      RCY  30  73.451  15.390  -0.617
  232    H    LYS  31           HN       LYS  31  75.362  13.462   3.134
  233    HA   LYS  31           HA       LYS  31  77.034  15.932   3.334
  234    HB2  LYS  31           HB2      LYS  31  76.459  15.581   5.927
  235    HB3  LYS  31           HB1      LYS  31  75.422  16.549   4.878
  236    HG2  LYS  31           HG2      LYS  31  73.882  14.750   4.577
  237    HG3  LYS  31           HG1      LYS  31  75.000  13.582   5.280
  238    HD2  LYS  31           HD2      LYS  31  74.744  14.507   7.468
  239    HD3  LYS  31           HD1      LYS  31  73.920  15.936   6.841
  240    HE2  LYS  31           HE2      LYS  31  72.101  14.383   5.991
  241    HE3  LYS  31           HE1      LYS  31  72.878  13.094   6.911
  242    HZ1  LYS  31           HZ1      LYS  31  71.421  15.441   7.860
  243    HZ2  LYS  31           HZ2      LYS  31  72.741  14.914   8.791
  244    HZ3  LYS  31           HZ3      LYS  31  71.447  13.860   8.474
  245    H    GLN  32           HN       GLN  32  78.601  14.223   2.508
  246    HA   GLN  32           HA       GLN  32  79.974  13.022   4.829
  247    HB2  GLN  32           HB2      GLN  32  78.414  11.249   4.010
  248    HB3  GLN  32           HB1      GLN  32  79.189  11.341   2.428
  249    HG2  GLN  32           HG2      GLN  32  81.323  10.666   3.373
  250    HG3  GLN  32           HG1      GLN  32  80.658  10.720   5.006
  251   HE21  GLN  32          HE21      GLN  32  78.569   9.516   2.476
  252   HE22  GLN  32          HE22      GLN  32  78.671   7.875   2.899
  253    H    ARG  33           HN       ARG  33  81.894  14.079   4.523
  254    HA   ARG  33           HA       ARG  33  82.962  14.450   1.796
  255    HE   ARG  33           HE       ARG  33  82.305  19.591   4.165
  256    HB2  ARG  33           HB2      ARG  33  84.266  15.197   4.426
  257    HB3  ARG  33           HB1      ARG  33  84.628  15.845   2.826
  258    HG2  ARG  33           HG2      ARG  33  82.408  16.863   2.698
  259    HG3  ARG  33           HG1      ARG  33  81.968  16.151   4.251
  260    HD2  ARG  33           HD2      ARG  33  83.837  17.417   5.317
  261    HD3  ARG  33           HD1      ARG  33  84.157  18.192   3.766
  262   HH11  ARG  33          HH21      ARG  33  82.194  16.726   6.080
  263   HH12  ARG  33          HH22      ARG  33  80.798  17.221   6.979
  264   HH21  ARG  33          HH11      ARG  33  80.483  20.254   5.328
  265   HH22  ARG  33          HH12      ARG  33  79.830  19.219   6.553
  266    H    GLN  34           HN       GLN  34  84.845  13.435   1.032
  267    HA   GLN  34           HA       GLN  34  85.440  10.833   2.152
  268    HB2  GLN  34           HB2      GLN  34  86.914  12.434   0.036
  269    HB3  GLN  34           HB1      GLN  34  87.156  10.720   0.376
  270    HG2  GLN  34           HG2      GLN  34  84.760  10.306  -0.157
  271    HG3  GLN  34           HG1      GLN  34  84.584  12.009  -0.583
  272   HE21  GLN  34          HE21      GLN  34  84.624  12.222  -2.821
  273   HE22  GLN  34          HE22      GLN  34  85.651  11.364  -3.866
  274    H    THR  35           HN       THR  35  88.011  10.365   2.334
  275    HA   THR  35           HA       THR  35  89.219  12.513   4.029
  276    HB   THR  35           HB       THR  35  89.297   9.560   4.699
  277    HG1  THR  35           HG1      THR  35  87.238  10.134   5.072
  278   HG21  THR  35          HG21      THR  35  89.940  12.002   6.371
  279   HG22  THR  35          HG22      THR  35  91.152  11.048   5.516
  280   HG23  THR  35          HG23      THR  35  90.205  10.314   6.810
  281    H    ARG  36           HN       ARG  36  89.921   9.324   2.543
  282    HA   ARG  36           HA       ARG  36  92.476  10.496   1.518
  283    HE   ARG  36           HE       ARG  36  95.865   8.166   2.433
  284    HB2  ARG  36           HB2      ARG  36  92.077   7.844   2.925
  285    HB3  ARG  36           HB1      ARG  36  93.513   8.223   1.974
  286    HG2  ARG  36           HG2      ARG  36  92.771  10.310   3.921
  287    HG3  ARG  36           HG1      ARG  36  93.240   8.773   4.650
  288    HD2  ARG  36           HD2      ARG  36  94.864  10.290   2.586
  289    HD3  ARG  36           HD1      ARG  36  95.197  10.260   4.317
  290   HH11  ARG  36          HH21      ARG  36  94.836   8.874   5.647
  291   HH12  ARG  36          HH22      ARG  36  95.522   7.436   6.326
  292   HH21  ARG  36          HH11      ARG  36  96.766   6.283   3.301
  293   HH22  ARG  36          HH12      ARG  36  96.614   5.969   4.998
  294    H    GLN  37           HN       GLN  37  90.155  10.306  -0.002
  295    HA   GLN  37           HA       GLN  37  89.377   9.459  -2.047
  296    HB2  GLN  37           HB2      GLN  37  92.084   8.129  -2.289
  297    HB3  GLN  37           HB1      GLN  37  91.029   8.685  -3.587
  298    HG2  GLN  37           HG2      GLN  37  92.351  10.492  -1.541
  299    HG3  GLN  37           HG1      GLN  37  92.928  10.245  -3.189
  300   HE21  GLN  37          HE21      GLN  37  90.687  12.028  -1.242
  301   HE22  GLN  37          HE22      GLN  37  89.871  12.803  -2.513
  302    H1U  RCY  38           H1U      RCY  38  82.817   1.374   0.710
  303    H1S  RCY  38           H1S      RCY  38  85.943   3.651  -0.423
  304    HB1  RCY  38           HB1      RCY  38  87.444   5.727  -2.822
  305    HB2  RCY  38           HB2      RCY  38  87.642   5.528  -1.081
  306    HA   RCY  38           HA       RCY  38  89.903   4.762  -1.342
  307    HN1  RCY  38           HN1      RCY  38  90.256   6.900  -3.227
  308    H    LYS  39           HN       LYS  39  91.740   4.333  -2.898
  309    HA   LYS  39           HA       LYS  39  90.926   2.397  -4.871
  310    HB2  LYS  39           HB2      LYS  39  91.875   3.614  -6.857
  311    HB3  LYS  39           HB1      LYS  39  90.389   4.330  -6.233
  312    HG2  LYS  39           HG2      LYS  39  91.755   5.956  -4.931
  313    HG3  LYS  39           HG1      LYS  39  93.212   5.277  -5.658
  314    HD2  LYS  39           HD2      LYS  39  90.963   6.246  -7.406
  315    HD3  LYS  39           HD1      LYS  39  92.134   7.391  -6.752
  316    HE2  LYS  39           HE2      LYS  39  93.967   5.953  -7.700
  317    HE3  LYS  39           HE1      LYS  39  92.726   4.977  -8.485
  318    HZ1  LYS  39           HZ1      LYS  39  91.951   6.943  -9.643
  319    HZ2  LYS  39           HZ2      LYS  39  93.597   6.679  -9.966
  320    HZ3  LYS  39           HZ3      LYS  39  93.127   7.894  -8.876
  321    H    SER  40           HN       SER  40  93.147   3.860  -2.865
  322    HA   SER  40           HA       SER  40  95.622   3.106  -4.143
  323    HG   SER  40           HG       SER  40  94.882   2.790  -0.526
  324    HB2  SER  40           HB2      SER  40  96.550   3.330  -1.798
  325    HB3  SER  40           HB1      SER  40  95.689   4.751  -2.383
  326    H    LYS  41           HN       LYS  41  93.219   1.375  -2.327
  327    HA   LYS  41           HA       LYS  41  94.878  -1.096  -2.576
  328    HB2  LYS  41           HB2      LYS  41  93.250  -0.340  -0.128
  329    HB3  LYS  41           HB1      LYS  41  94.189  -1.818  -0.342
  330    HG2  LYS  41           HG2      LYS  41  96.259  -0.549  -0.457
  331    HG3  LYS  41           HG1      LYS  41  95.370   0.974  -0.413
  332    HD2  LYS  41           HD2      LYS  41  94.493   0.377   1.831
  333    HD3  LYS  41           HD1      LYS  41  95.445  -1.108   1.792
  334    HE2  LYS  41           HE2      LYS  41  96.608   1.683   1.564
  335    HE3  LYS  41           HE1      LYS  41  96.582   0.728   3.046
  336    HZ1  LYS  41           HZ1      LYS  41  98.489  -0.139   2.355
  337    HZ2  LYS  41           HZ2      LYS  41  98.338   0.546   0.807
  338    HZ3  LYS  41           HZ3      LYS  41  97.614  -0.952   1.150
  339    HA   PRO  42           HA       PRO  42  90.584  -1.788  -4.085
  340    HB2  PRO  42           HB2      PRO  42  91.190  -2.667  -6.567
  341    HB3  PRO  42           HB1      PRO  42  91.180  -0.939  -6.164
  342    HG2  PRO  42           HG2      PRO  42  93.475  -2.779  -6.525
  343    HG3  PRO  42           HG1      PRO  42  93.330  -1.059  -6.916
  344    HD2  PRO  42           HD2      PRO  42  94.579  -2.126  -4.628
  345    HD3  PRO  42           HD1      PRO  42  94.107  -0.429  -4.862
  346    HA   PRO  43           HA       PRO  43  90.046  -6.093  -3.203
  347    HB2  PRO  43           HB2      PRO  43  89.017  -6.363  -6.009
  348    HB3  PRO  43           HB1      PRO  43  88.310  -6.949  -4.491
  349    HG2  PRO  43           HG2      PRO  43  87.410  -4.750  -5.728
  350    HG3  PRO  43           HG1      PRO  43  87.412  -4.912  -3.965
  351    HD2  PRO  43           HD2      PRO  43  89.096  -3.186  -5.674
  352    HD3  PRO  43           HD1      PRO  43  88.734  -3.044  -3.941
  353    H    LYS  44           HN       LYS  44  90.798  -8.284  -3.917
  354    HA   LYS  44           HA       LYS  44  93.367  -8.055  -5.369
  355    HB2  LYS  44           HB2      LYS  44  93.870 -10.236  -4.481
  356    HB3  LYS  44           HB1      LYS  44  93.143  -9.303  -3.173
  357    HG2  LYS  44           HG2      LYS  44  90.903 -10.322  -3.906
  358    HG3  LYS  44           HG1      LYS  44  91.859 -11.454  -4.862
  359    HD2  LYS  44           HD2      LYS  44  93.146 -11.980  -2.729
  360    HD3  LYS  44           HD1      LYS  44  91.909 -11.070  -1.861
  361    HE2  LYS  44           HE2      LYS  44  91.648 -13.663  -3.356
  362    HE3  LYS  44           HE1      LYS  44  91.058 -13.242  -1.748
  363    HZ1  LYS  44           HZ1      LYS  44  89.997 -12.273  -4.345
  364    HZ2  LYS  44           HZ2      LYS  44  89.497 -11.687  -2.830
  365    HZ3  LYS  44           HZ3      LYS  44  89.220 -13.310  -3.250
  366    H    LYS  45           HN       LYS  45  90.165  -9.434  -5.756
  367    HA   LYS  45           HA       LYS  45  91.016 -10.773  -8.280
  368    HB2  LYS  45           HB2      LYS  45  89.633 -12.001  -6.525
  369    HB3  LYS  45           HB1      LYS  45  88.308 -10.912  -6.934
  370    HG2  LYS  45           HG2      LYS  45  87.860 -12.663  -8.388
  371    HG3  LYS  45           HG1      LYS  45  88.894 -11.665  -9.411
  372    HD2  LYS  45           HD2      LYS  45  90.847 -13.007  -8.797
  373    HD3  LYS  45           HD1      LYS  45  89.861 -13.975  -7.700
  374    HE2  LYS  45           HE2      LYS  45  88.500 -14.765  -9.578
  375    HE3  LYS  45           HE1      LYS  45  89.418 -13.752 -10.692
  376    HZ1  LYS  45           HZ1      LYS  45  90.001 -16.322 -10.040
  377    HZ2  LYS  45           HZ2      LYS  45  91.082 -15.434  -9.076
  378    HZ3  LYS  45           HZ3      LYS  45  91.070 -15.220 -10.761
  379    H    GLY  46           HN       GLY  46  87.944  -9.197  -7.385
  380    HA2  GLY  46           HA2      GLY  46  87.376  -8.255  -9.991
  381    HA3  GLY  46           HA1      GLY  46  86.693  -7.567  -8.518
  382    H    VAL  47           HN       VAL  47  89.380  -7.347 -10.794
  383    HA   VAL  47           HA       VAL  47  90.811  -5.225  -9.551
  384    HB   VAL  47           HB       VAL  47  91.560  -4.697 -11.916
  385   HG11  VAL  47          HG11      VAL  47  92.729  -6.351 -10.502
  386   HG12  VAL  47          HG12      VAL  47  92.739  -6.847 -12.195
  387   HG13  VAL  47          HG13      VAL  47  91.623  -7.607 -11.060
  388   HG21  VAL  47          HG21      VAL  47  90.806  -6.203 -13.696
  389   HG22  VAL  47          HG22      VAL  47  89.417  -5.371 -12.998
  390   HG23  VAL  47          HG23      VAL  47  89.751  -7.047 -12.563
  391    H    GLN  48           HN       GLN  48  90.847  -3.070 -11.277
  392    HA   GLN  48           HA       GLN  48  88.240  -1.819 -10.657
  393    HB2  GLN  48           HB2      GLN  48  89.584   0.214 -11.729
  394    HB3  GLN  48           HB1      GLN  48  89.910  -0.315 -10.078
  395    HG2  GLN  48           HG2      GLN  48  91.990  -0.017 -11.445
  396    HG3  GLN  48           HG1      GLN  48  91.796  -1.657 -10.824
  397   HE21  GLN  48          HE21      GLN  48  90.498   0.099 -13.710
  398   HE22  GLN  48          HE22      GLN  48  90.935  -1.111 -14.818
  399    H    GLY  49           HN       GLY  49  86.968  -0.764 -12.294
  400    HA2  GLY  49           HA2      GLY  49  87.236  -0.325 -14.924
  401    HA3  GLY  49           HA1      GLY  49  87.181  -2.089 -14.933
  402    H1U  RCY  50           H1U      RCY  50  82.101   0.466  -6.795
  403    H1S  RCY  50           H1S      RCY  50  85.262  -1.566  -9.852
  404    HB1  RCY  50           HB1      RCY  50  82.418  -2.277 -13.304
  405    HB2  RCY  50           HB2      RCY  50  82.014  -1.311 -11.887
  406    HA   RCY  50           HA       RCY  50  82.887  -0.261 -14.267
  407    HN1  RCY  50           HN1      RCY  50  85.377   0.099 -12.793
  408    H    GLY  51           HN       GLY  51  81.096   0.289 -12.218
  409    HA2  GLY  51           HA2      GLY  51  80.251   2.138 -11.043
  410    HA3  GLY  51           HA1      GLY  51  81.850   2.214 -10.301
  411    H    ASP  52           HN       ASP  52  80.155   3.121 -13.316
  412    HA   ASP  52           HA       ASP  52  81.491   5.748 -13.229
  413    HB2  ASP  52           HB2      ASP  52  83.011   4.124 -14.495
  414    HB3  ASP  52           HB1      ASP  52  81.744   4.050 -15.721
  415    H    ASP  53           HN       ASP  53  79.136   3.543 -14.598
  416    HA   ASP  53           HA       ASP  53  77.847   5.609 -16.224
  417    HB2  ASP  53           HB2      ASP  53  76.718   2.925 -15.387
  418    HB3  ASP  53           HB1      ASP  53  76.229   3.909 -16.767
  419    H    ILE  54           HN       ILE  54  75.233   5.570 -15.757
  420    HA   ILE  54           HA       ILE  54  74.977   6.950 -13.209
  421    HB   ILE  54           HB       ILE  54  72.788   6.119 -15.135
  422   HG12  ILE  54          HG12      ILE  54  74.430   8.671 -15.035
  423   HG13  ILE  54          HG11      ILE  54  74.569   7.418 -16.269
  424   HG21  ILE  54          HG21      ILE  54  72.929   8.400 -13.141
  425   HG22  ILE  54          HG22      ILE  54  72.105   6.870 -12.839
  426   HG23  ILE  54          HG23      ILE  54  71.537   7.939 -14.121
  427   HD11  ILE  54          HD11      ILE  54  72.179   9.187 -15.703
  428   HD12  ILE  54          HD12      ILE  54  72.099   7.766 -16.745
  429   HD13  ILE  54          HD13      ILE  54  73.141   9.121 -17.180
  430    HA   PRO  55           HA       PRO  55  73.856   3.207 -11.008
  431    HB2  PRO  55           HB2      PRO  55  73.150   4.328  -8.631
  432    HB3  PRO  55           HB1      PRO  55  74.839   4.204  -9.162
  433    HG2  PRO  55           HG2      PRO  55  73.010   6.551  -9.241
  434    HG3  PRO  55           HG1      PRO  55  74.733   6.475  -8.834
  435    HD2  PRO  55           HD2      PRO  55  73.788   7.290 -11.291
  436    HD3  PRO  55           HD1      PRO  55  75.394   6.568 -11.045
  437    H    GLY  56           HN       GLY  56  71.645   5.976 -10.438
  438    HA2  GLY  56           HA2      GLY  56  69.370   4.475 -11.470
  439    HA3  GLY  56           HA1      GLY  56  69.328   4.665  -9.716
  440    H    MET  57           HN       MET  57  69.743   6.586 -12.692
  441    HA   MET  57           HA       MET  57  69.294   8.855 -13.092
  442    HB2  MET  57           HB2      MET  57  67.029   9.150 -13.251
  443    HB3  MET  57           HB1      MET  57  67.015   7.434 -12.869
  444    HG2  MET  57           HG2      MET  57  65.613   8.082 -11.176
  445    HG3  MET  57           HG1      MET  57  67.120   8.493 -10.357
  446    HE1  MET  57           HE1      MET  57  64.368  11.239  -9.621
  447    HE2  MET  57           HE2      MET  57  65.684  10.396  -8.807
  448    HE3  MET  57           HE3      MET  57  64.442   9.473  -9.649
  449    H    GLU  58           HN       GLU  58  70.438   8.070 -10.301
  450    HA   GLU  58           HA       GLU  58  71.082   9.246  -8.376
  451    HB2  GLU  58           HB2      GLU  58  71.616  10.906 -10.318
  452    HB3  GLU  58           HB1      GLU  58  70.188  11.774  -9.757
  453    HG2  GLU  58           HG2      GLU  58  71.868  12.790  -8.493
  454    HG3  GLU  58           HG1      GLU  58  71.319  11.526  -7.391
  455    H    GLY  59           HN       GLY  59  70.171  10.451  -6.529
  456    HA2  GLY  59           HA2      GLY  59  68.315  11.496  -5.377
  457    HA3  GLY  59           HA1      GLY  59  67.244  10.957  -6.671
  458    H1U  RCY  60           H1U      RCY  60  75.134   5.236  -1.054
  459    H1S  RCY  60           H1S      RCY  60  70.724   6.739  -1.351
  460    HB1  RCY  60           HB1      RCY  60  68.525   6.469  -2.542
  461    HB2  RCY  60           HB2      RCY  60  67.680   8.013  -2.655
  462    HA   RCY  60           HA       RCY  60  68.872   6.374  -4.898
  463    HN1  RCY  60           HN1      RCY  60  69.321   8.461  -5.884
  464    H    GLY  61           HN       GLY  61  66.640   5.968  -2.950
  465    HA2  GLY  61           HA2      GLY  61  64.333   5.469  -2.972
  466    HA3  GLY  61           HA1      GLY  61  64.165   6.532  -4.371
  467    H    THR  62           HN       THR  62  65.877   5.382  -6.183
  468    HA   THR  62           HA       THR  62  64.414   3.398  -7.434
  469    HB   THR  62           HB       THR  62  66.395   2.889  -8.722
  470    HG1  THR  62           HG1      THR  62  67.598   3.566  -6.350
  471   HG21  THR  62          HG21      THR  62  67.060   5.101  -9.398
  472   HG22  THR  62          HG22      THR  62  66.639   5.769  -7.820
  473   HG23  THR  62          HG23      THR  62  65.370   5.194  -8.902
  474    H    ASP  63           HN       ASP  63  64.028   1.306  -7.045
  475    HA   ASP  63           HA       ASP  63  64.552  -0.002  -4.646
  476    HB2  ASP  63           HB2      ASP  63  64.322  -1.370  -7.342
  477    HB3  ASP  63           HB1      ASP  63  63.963  -2.080  -5.767
  478    H    ILE  64           HN       ILE  64  66.519  -0.197  -7.634
  479    HA   ILE  64           HA       ILE  64  68.396  -2.093  -6.972
  480    HB   ILE  64           HB       ILE  64  69.126  -1.212  -8.942
  481   HG12  ILE  64          HG12      ILE  64  70.924  -0.551  -7.210
  482   HG13  ILE  64          HG11      ILE  64  70.972   0.274  -8.769
  483   HG21  ILE  64          HG21      ILE  64  68.688   1.241  -9.507
  484   HG22  ILE  64          HG22      ILE  64  67.848   1.348  -7.959
  485   HG23  ILE  64          HG23      ILE  64  67.257   0.255  -9.210
  486   HD11  ILE  64          HD11      ILE  64  70.581   2.276  -7.809
  487   HD12  ILE  64          HD12      ILE  64  70.827   1.490  -6.249
  488   HD13  ILE  64          HD13      ILE  64  69.200   1.641  -6.913
  489    H    THR  65           HN       THR  65  67.844   0.934  -5.367
  490    HA   THR  65           HA       THR  65  70.375   1.119  -4.020
  491    HB   THR  65           HB       THR  65  67.729   2.098  -2.928
  492    HG1  THR  65           HG1      THR  65  69.376   3.645  -4.579
  493   HG21  THR  65          HG21      THR  65  69.059   3.762  -1.842
  494   HG22  THR  65          HG22      THR  65  70.483   3.340  -2.793
  495   HG23  THR  65          HG23      THR  65  69.879   2.225  -1.567
  496    H    VAL  66           HN       VAL  66  67.297  -0.465  -3.216
  497    HA   VAL  66           HA       VAL  66  68.352  -1.423  -0.640
  498    HB   VAL  66           HB       VAL  66  65.808  -2.363  -1.967
  499   HG11  VAL  66          HG11      VAL  66  66.546  -1.858   0.932
  500   HG12  VAL  66          HG12      VAL  66  66.622  -3.434   0.145
  501   HG13  VAL  66          HG13      VAL  66  65.070  -2.621   0.341
  502   HG21  VAL  66          HG21      VAL  66  64.696  -0.432  -0.813
  503   HG22  VAL  66          HG22      VAL  66  65.763   0.067  -2.126
  504   HG23  VAL  66          HG23      VAL  66  66.294   0.221  -0.451
  505    H    ILE  67           HN       ILE  67  67.243  -2.932  -3.694
  506    HA   ILE  67           HA       ILE  67  69.144  -5.174  -3.149
  507    HB   ILE  67           HB       ILE  67  66.257  -5.387  -4.055
  508   HG12  ILE  67          HG12      ILE  67  67.715  -6.707  -1.747
  509   HG13  ILE  67          HG11      ILE  67  66.770  -5.226  -1.585
  510   HG21  ILE  67          HG21      ILE  67  68.503  -7.418  -4.059
  511   HG22  ILE  67          HG22      ILE  67  67.514  -6.907  -5.426
  512   HG23  ILE  67          HG23      ILE  67  66.800  -7.870  -4.132
  513   HD11  ILE  67          HD11      ILE  67  65.428  -7.218  -0.988
  514   HD12  ILE  67          HD12      ILE  67  65.706  -7.879  -2.600
  515   HD13  ILE  67          HD13      ILE  67  64.768  -6.399  -2.404
  516    H1U  RCY  68           H1U      RCY  68  75.548  -0.628  -1.945
  517    H1S  RCY  68           H1S      RCY  68  74.645  -2.730  -5.260
  518    HB1  RCY  68           HB1      RCY  68  71.307  -2.533  -6.611
  519    HB2  RCY  68           HB2      RCY  68  72.078  -3.509  -7.858
  520    HA   RCY  68           HA       RCY  68  69.650  -4.070  -7.453
  521    HN1  RCY  68           HN1      RCY  68  70.632  -4.772  -4.729
  522    HA   PRO  69           HA       PRO  69  70.298  -8.028  -9.278
  523    HB2  PRO  69           HB2      PRO  69  72.275  -6.643 -11.053
  524    HB3  PRO  69           HB1      PRO  69  70.943  -7.730 -11.485
  525    HG2  PRO  69           HG2      PRO  69  70.776  -5.059 -11.750
  526    HG3  PRO  69           HG1      PRO  69  69.377  -6.076 -11.379
  527    HD2  PRO  69           HD2      PRO  69  70.773  -4.142  -9.646
  528    HD3  PRO  69           HD1      PRO  69  69.155  -4.852  -9.462
  529    H    TRP  70           HN       TRP  70  73.250  -6.112  -8.629
  530    HA   TRP  70           HA       TRP  70  74.925  -8.502  -8.571
  531    HD1  TRP  70           HD1      TRP  70  75.448  -4.310  -6.442
  532    HE1  TRP  70           HE1      TRP  70  74.297  -2.297  -7.566
  533    HE3  TRP  70           HE3      TRP  70  74.695  -6.223 -11.116
  534    HZ2  TRP  70           HZ2      TRP  70  73.199  -1.589 -10.115
  535    HZ3  TRP  70           HZ3      TRP  70  73.597  -4.863 -12.868
  536    HH2  TRP  70           HH2      TRP  70  72.848  -2.552 -12.378
  537    HB2  TRP  70           HB2      TRP  70  76.387  -6.552  -7.264
  538    HB3  TRP  70           HB1      TRP  70  76.406  -6.838  -9.001
  539    H    GLU  71           HN       GLU  71  72.882  -6.897  -6.302
  540    HA   GLU  71           HA       GLU  71  74.272  -7.758  -3.907
  541    HB2  GLU  71           HB2      GLU  71  71.881  -6.269  -4.543
  542    HB3  GLU  71           HB1      GLU  71  71.492  -7.499  -3.345
  543    HG2  GLU  71           HG2      GLU  71  73.830  -5.583  -3.112
  544    HG3  GLU  71           HG1      GLU  71  72.265  -5.332  -2.337
  545    H    ALA  72           HN       ALA  72  72.678  -9.480  -6.288
  546    HA   ALA  72           HA       ALA  72  71.256 -11.427  -4.716
  547    HB1  ALA  72           HB1      ALA  72  71.350 -12.817  -6.763
  548    HB2  ALA  72           HB2      ALA  72  72.514 -11.693  -7.465
  549    HB3  ALA  72           HB3      ALA  72  70.865 -11.162  -7.135
  550    H1U  RCY  73           H1U      RCY  73  75.535  -7.718  -0.136
  551    H1S  RCY  73           H1S      RCY  73  77.966  -8.589  -3.985
  552    HB1  RCY  73           HB1      RCY  73  77.335 -12.175  -2.995
  553    HB2  RCY  73           HB2      RCY  73  76.125 -10.922  -2.722
  554    HA   RCY  73           HA       RCY  73  75.895 -13.068  -4.852
  555    HN1  RCY  73           HN1      RCY  73  74.428 -10.699  -4.574
  556    H    ASN  74           HN       ASN  74  73.533 -12.214  -2.414
  557    HA   ASN  74           HA       ASN  74  72.507 -13.540  -0.776
  558    HB2  ASN  74           HB2      ASN  74  72.763 -15.283  -2.704
  559    HB3  ASN  74           HB1      ASN  74  74.092 -15.920  -1.734
  560   HD21  ASN  74          HD21      ASN  74  73.390 -16.131   0.758
  561   HD22  ASN  74          HD22      ASN  74  71.868 -16.840   1.007
  562    H    HIS  75           HN       HIS  75  75.987 -13.913  -1.256
  563    HA   HIS  75           HA       HIS  75  76.404 -14.734   1.535
  564    HD1  HIS  75           HD1      HIS  75  77.760 -16.779   1.929
  565    HD2  HIS  75           HD2      HIS  75  80.701 -13.871   1.388
  566    HE1  HIS  75           HE1      HIS  75  79.556 -17.249   3.652
  567    HE2  HIS  75           HE2      HIS  75  81.353 -15.485   3.333
  568    HB2  HIS  75           HB2      HIS  75  77.828 -15.416  -0.529
  569    HB3  HIS  75           HB1      HIS  75  78.569 -13.825  -0.362
  570    H1U  RCY  76           H1U      RCY  76  76.207  -3.805   3.445
  571    H1S  RCY  76           H1S      RCY  76  75.827  -8.076   4.465
  572    HB1  RCY  76           HB1      RCY  76  75.827 -10.238   0.903
  573    HB2  RCY  76           HB2      RCY  76  76.683  -8.724   1.182
  574    HA   RCY  76           HA       RCY  76  78.465  -9.895   0.351
  575    HN1  RCY  76           HN1      RCY  76  78.037 -12.116  -0.253
  576    H    GLU  77           HN       GLU  77  78.130 -12.306   2.882
  577    HA   GLU  77           HA       GLU  77  79.252 -10.970   5.075
  578    HB2  GLU  77           HB2      GLU  77  79.565 -13.835   4.152
  579    HB3  GLU  77           HB1      GLU  77  80.194 -13.255   5.695
  580    HG2  GLU  77           HG2      GLU  77  77.302 -12.923   4.861
  581    HG3  GLU  77           HG1      GLU  77  77.881 -14.293   5.809
  582    H    LEU  78           HN       LEU  78  81.454 -13.377   3.877
  583    HA   LEU  78           HA       LEU  78  83.720 -13.235   3.295
  584    HG   LEU  78           HG       LEU  78  84.675 -11.249   0.500
  585    HB2  LEU  78           HB2      LEU  78  82.445 -11.444   1.657
  586    HB3  LEU  78           HB1      LEU  78  83.582 -10.384   2.483
  587   HD11  LEU  78          HD11      LEU  78  85.851 -13.034   2.584
  588   HD12  LEU  78          HD12      LEU  78  85.779 -11.308   2.936
  589   HD13  LEU  78          HD13      LEU  78  86.649 -11.883   1.513
  590   HD21  LEU  78          HD21      LEU  78  83.058 -13.412   0.764
  591   HD22  LEU  78          HD22      LEU  78  84.562 -14.077   1.401
  592   HD23  LEU  78          HD23      LEU  78  84.514 -13.415  -0.233
  593    H    HIS  79           HN       HIS  79  85.368 -12.969   4.729
  594    HA   HIS  79           HA       HIS  79  85.054 -10.912   6.846
  595    HD1  HIS  79           HD1      HIS  79  88.375 -12.732   5.280
  596    HD2  HIS  79           HD2      HIS  79  85.662 -15.537   6.755
  597    HE1  HIS  79           HE1      HIS  79  88.877 -14.908   4.086
  598    HE2  HIS  79           HE2      HIS  79  87.232 -16.624   4.975
  599    HB2  HIS  79           HB2      HIS  79  87.105 -12.228   7.783
  600    HB3  HIS  79           HB1      HIS  79  85.519 -13.000   7.815
  601    H    GLU  80           HN       GLU  80  86.015  -8.985   6.434
  602    HA   GLU  80           HA       GLU  80  88.812  -8.976   5.440
  603    HB2  GLU  80           HB2      GLU  80  86.459  -7.596   4.147
  604    HB3  GLU  80           HB1      GLU  80  88.084  -6.926   4.002
  605    HG2  GLU  80           HG2      GLU  80  87.467  -9.811   3.339
  606    HG3  GLU  80           HG1      GLU  80  87.355  -8.524   2.138
  607    H    LEU  81           HN       LEU  81  86.767  -6.138   5.572
  608    HA   LEU  81           HA       LEU  81  88.384  -5.153   7.864
  609    HG   LEU  81           HG       LEU  81  87.529  -4.538   4.578
  610    HB2  LEU  81           HB2      LEU  81  86.351  -3.485   6.404
  611    HB3  LEU  81           HB1      LEU  81  87.866  -2.987   7.158
  612   HD11  LEU  81          HD11      LEU  81  88.544  -2.629   3.548
  613   HD12  LEU  81          HD12      LEU  81  88.988  -1.940   5.110
  614   HD13  LEU  81          HD13      LEU  81  87.295  -1.998   4.621
  615   HD21  LEU  81          HD21      LEU  81  90.162  -4.150   4.676
  616   HD22  LEU  81          HD22      LEU  81  89.428  -5.570   5.422
  617   HD23  LEU  81          HD23      LEU  81  89.868  -4.181   6.415
  618    H    ALA  82           HN       ALA  82  85.112  -6.047   6.974
  619    HA   ALA  82           HA       ALA  82  83.761  -4.853   9.206
  620    HB1  ALA  82           HB1      ALA  82  82.957  -7.425   7.828
  621    HB2  ALA  82           HB2      ALA  82  82.699  -5.838   7.103
  622    HB3  ALA  82           HB3      ALA  82  81.907  -6.252   8.623
  623    H    GLN  83           HN       GLN  83  82.491  -7.486  10.014
  624    HA   GLN  83           HA       GLN  83  82.781  -9.118  11.670
  625    HB2  GLN  83           HB2      GLN  83  85.192  -9.153  10.177
  626    HB3  GLN  83           HB1      GLN  83  85.675  -9.149  11.872
  627    HG2  GLN  83           HG2      GLN  83  85.380 -11.448  11.259
  628    HG3  GLN  83           HG1      GLN  83  83.980 -11.010  12.239
  629   HE21  GLN  83          HE21      GLN  83  83.697  -9.446   9.265
  630   HE22  GLN  83          HE22      GLN  83  82.703 -10.572   8.475
  631    H    TYR  84           HN       TYR  84  84.806  -6.228  11.823
  632    HA   TYR  84           HA       TYR  84  84.809  -6.366  14.796
  633    HD1  TYR  84           HD1      TYR  84  86.941  -7.225  15.304
  634    HD2  TYR  84           HD2      TYR  84  87.735  -5.318  11.538
  635    HE1  TYR  84           HE1      TYR  84  88.618  -8.973  14.772
  636    HE2  TYR  84           HE2      TYR  84  89.411  -7.066  11.006
  637    HH   TYR  84           HH       TYR  84  89.621  -9.959  12.612
  638    HB2  TYR  84           HB2      TYR  84  86.186  -4.361  12.986
  639    HB3  TYR  84           HB1      TYR  84  86.475  -4.610  14.707
  640    H    GLY  85           HN       GLY  85  84.417  -3.699  12.434
  641    HA2  GLY  85           HA2      GLY  85  82.679  -2.266  14.287
  642    HA3  GLY  85           HA1      GLY  85  83.108  -1.745  12.658
  643    H    ILE  86           HN       ILE  86  81.704  -4.897  13.417
  644    HA   ILE  86           HA       ILE  86  79.761  -5.888  12.524
  645    HB   ILE  86           HB       ILE  86  78.666  -3.168  13.308
  646   HG12  ILE  86          HG12      ILE  86  78.553  -5.720  14.916
  647   HG13  ILE  86          HG11      ILE  86  79.930  -4.624  15.044
  648   HG21  ILE  86          HG21      ILE  86  76.576  -4.683  13.665
  649   HG22  ILE  86          HG22      ILE  86  77.397  -5.800  12.574
  650   HG23  ILE  86          HG23      ILE  86  76.976  -4.178  12.023
  651   HD11  ILE  86          HD11      ILE  86  78.647  -2.904  15.962
  652   HD12  ILE  86          HD12      ILE  86  77.883  -4.328  16.668
  653   HD13  ILE  86          HD13      ILE  86  77.144  -3.527  15.281
  654    H1U  RCY  87           H1U      RCY  87  75.262  -1.049   3.325
  655    H1S  RCY  87           H1S      RCY  87  77.068  -3.120   7.319
  656    HB1  RCY  87           HB1      RCY  87  77.615  -1.059   8.644
  657    HB2  RCY  87           HB2      RCY  87  77.469  -1.248  10.391
  658    HA   RCY  87           HA       RCY  87  78.408  -3.603   8.800
  659    HN1  RCY  87           HN1      RCY  87  78.575  -2.734  11.590
  Start of MODEL   18
    1    HA   MET   1           HA       MET   1  51.873 -15.342  -5.558
    2    HB2  MET   1           HB2      MET   1  49.900 -16.781  -4.877
    3    HB3  MET   1           HB1      MET   1  51.107 -16.540  -3.613
    4    HG2  MET   1           HG2      MET   1  49.755 -14.812  -2.574
    5    HG3  MET   1           HG1      MET   1  48.595 -14.868  -3.901
    6    HE1  MET   1           HE1      MET   1  50.298 -18.186  -2.142
    7    HE2  MET   1           HE2      MET   1  49.434 -17.911  -0.631
    8    HE3  MET   1           HE3      MET   1  50.470 -16.646  -1.289
    9    H    ASN   2           HN       ASN   2  49.298 -13.062  -4.827
   10    HA   ASN   2           HA       ASN   2  47.784 -13.707  -7.248
   11    HB2  ASN   2           HB2      ASN   2  46.757 -12.780  -5.127
   12    HB3  ASN   2           HB1      ASN   2  47.545 -11.245  -5.497
   13   HD21  ASN   2          HD21      ASN   2  46.882 -12.584  -8.462
   14   HD22  ASN   2          HD22      ASN   2  45.361 -11.889  -8.754
   15    H    LEU   3           HN       LEU   3  49.413 -10.691  -6.181
   16    HA   LEU   3           HA       LEU   3  49.418  -9.374  -8.642
   17    HG   LEU   3           HG       LEU   3  52.828  -9.794  -7.359
   18    HB2  LEU   3           HB2      LEU   3  51.201  -8.020  -7.810
   19    HB3  LEU   3           HB1      LEU   3  50.260  -8.494  -6.398
   20   HD11  LEU   3          HD11      LEU   3  52.143  -8.132  -4.916
   21   HD12  LEU   3          HD12      LEU   3  53.219  -7.668  -6.234
   22   HD13  LEU   3          HD13      LEU   3  53.671  -8.981  -5.147
   23   HD21  LEU   3          HD21      LEU   3  51.563 -11.559  -6.432
   24   HD22  LEU   3          HD22      LEU   3  50.829 -10.513  -5.217
   25   HD23  LEU   3          HD23      LEU   3  52.521 -10.985  -5.067
   26    H    GLU   4           HN       GLU   4  51.379  -9.031 -10.107
   27    HA   GLU   4           HA       GLU   4  52.349 -11.682 -10.956
   28    HB2  GLU   4           HB2      GLU   4  52.667  -8.927 -12.187
   29    HB3  GLU   4           HB1      GLU   4  53.222 -10.428 -12.928
   30    HG2  GLU   4           HG2      GLU   4  50.348  -9.937 -12.110
   31    HG3  GLU   4           HG1      GLU   4  50.960  -9.644 -13.738
   32    HA   PRO   5           HA       PRO   5  56.370 -11.790  -9.129
   33    HB2  PRO   5           HB2      PRO   5  57.326 -11.745 -11.976
   34    HB3  PRO   5           HB1      PRO   5  57.840 -12.788 -10.635
   35    HG2  PRO   5           HG2      PRO   5  56.121 -13.615 -12.528
   36    HG3  PRO   5           HG1      PRO   5  56.043 -14.183 -10.853
   37    HD2  PRO   5           HD2      PRO   5  54.166 -12.440 -12.296
   38    HD3  PRO   5           HD1      PRO   5  53.939 -13.302 -10.760
   39    HA   PRO   6           HA       PRO   6  57.206  -7.337  -9.857
   40    HB2  PRO   6           HB2      PRO   6  57.470  -6.604  -7.271
   41    HB3  PRO   6           HB1      PRO   6  55.878  -6.881  -8.005
   42    HG2  PRO   6           HG2      PRO   6  57.435  -8.612  -6.169
   43    HG3  PRO   6           HG1      PRO   6  55.685  -8.377  -6.291
   44    HD2  PRO   6           HD2      PRO   6  57.125 -10.538  -7.372
   45    HD3  PRO   6           HD1      PRO   6  55.462 -10.081  -7.799
   46    H    LYS   7           HN       LYS   7  59.225  -6.364 -10.074
   47    HA   LYS   7           HA       LYS   7  61.460  -6.884  -8.345
   48    HB2  LYS   7           HB2      LYS   7  62.851  -8.084 -10.117
   49    HB3  LYS   7           HB1      LYS   7  61.597  -9.056  -9.345
   50    HG2  LYS   7           HG2      LYS   7  60.135  -8.835 -11.222
   51    HG3  LYS   7           HG1      LYS   7  61.130  -7.565 -11.935
   52    HD2  LYS   7           HD2      LYS   7  62.979  -9.194 -12.220
   53    HD3  LYS   7           HD1      LYS   7  61.948 -10.462 -11.557
   54    HE2  LYS   7           HE2      LYS   7  61.905 -10.532 -14.012
   55    HE3  LYS   7           HE1      LYS   7  60.320 -10.079 -13.386
   56    HZ1  LYS   7           HZ1      LYS   7  61.815  -7.746 -13.693
   57    HZ2  LYS   7           HZ2      LYS   7  60.438  -8.228 -14.563
   58    HZ3  LYS   7           HZ3      LYS   7  61.988  -8.639 -15.125
   59    H    ALA   8           HN       ALA   8  59.966  -5.434 -11.042
   60    HA   ALA   8           HA       ALA   8  61.694  -3.157 -10.999
   61    HB1  ALA   8           HB1      ALA   8  63.389  -4.404 -12.086
   62    HB2  ALA   8           HB2      ALA   8  62.591  -3.536 -13.397
   63    HB3  ALA   8           HB3      ALA   8  62.229  -5.239 -13.119
   64    H    GLU   9           HN       GLU   9  60.666  -1.468 -12.050
   65    HA   GLU   9           HA       GLU   9  58.538  -2.122 -14.029
   66    HB2  GLU   9           HB2      GLU   9  58.111  -0.247 -11.685
   67    HB3  GLU   9           HB1      GLU   9  56.920  -0.714 -12.899
   68    HG2  GLU   9           HG2      GLU   9  58.250  -2.585 -10.915
   69    HG3  GLU   9           HG1      GLU   9  56.588  -2.001 -10.826
   70    H1U  RCY  10           H1U      RCY  10  62.847   5.047 -13.018
   71    H1S  RCY  10           H1S      RCY  10  62.846   3.757 -16.877
   72    HB1  RCY  10           HB1      RCY  10  61.547  -0.433 -17.241
   73    HB2  RCY  10           HB2      RCY  10  62.783   0.147 -16.126
   74    HA   RCY  10           HA       RCY  10  61.219   1.570 -14.995
   75    HN1  RCY  10           HN1      RCY  10  60.585  -1.220 -15.209
   76    H    ARG  11           HN       ARG  11  58.992   2.448 -14.849
   77    HA   ARG  11           HA       ARG  11  58.090   3.449 -17.414
   78    HE   ARG  11           HE       ARG  11  57.002  -0.990 -16.620
   79    HB2  ARG  11           HB2      ARG  11  55.814   2.448 -17.322
   80    HB3  ARG  11           HB1      ARG  11  57.066   1.225 -17.547
   81    HG2  ARG  11           HG2      ARG  11  57.053   0.852 -15.060
   82    HG3  ARG  11           HG1      ARG  11  55.667   1.938 -14.955
   83    HD2  ARG  11           HD2      ARG  11  54.837  -0.338 -15.057
   84    HD3  ARG  11           HD1      ARG  11  54.462   0.455 -16.587
   85   HH11  ARG  11          HH21      ARG  11  53.579  -1.101 -17.017
   86   HH12  ARG  11          HH22      ARG  11  53.612  -2.478 -18.066
   87   HH21  ARG  11          HH11      ARG  11  57.065  -2.787 -17.989
   88   HH22  ARG  11          HH12      ARG  11  55.585  -3.433 -18.617
   89    H    SER  12           HN       SER  12  58.911   4.587 -14.912
   90    HA   SER  12           HA       SER  12  56.690   6.406 -14.478
   91    HG   SER  12           HG       SER  12  56.819   6.976 -12.081
   92    HB2  SER  12           HB2      SER  12  55.831   4.685 -13.042
   93    HB3  SER  12           HB1      SER  12  57.418   4.393 -12.336
   94    H    ALA  13           HN       ALA  13  59.723   6.143 -14.996
   95    HA   ALA  13           HA       ALA  13  61.014   7.407 -12.733
   96    HB1  ALA  13           HB1      ALA  13  62.923   7.641 -14.185
   97    HB2  ALA  13           HB2      ALA  13  61.919   7.461 -15.624
   98    HB3  ALA  13           HB3      ALA  13  62.182   6.084 -14.555
   99    H    THR  14           HN       THR  14  62.046   9.642 -12.991
  100    HA   THR  14           HA       THR  14  60.766  11.535 -14.786
  101    HB   THR  14           HB       THR  14  60.148  11.960 -11.863
  102    HG1  THR  14           HG1      THR  14  58.149  11.038 -13.531
  103   HG21  THR  14          HG21      THR  14  58.624  13.573 -12.662
  104   HG22  THR  14          HG22      THR  14  58.611  12.884 -14.286
  105   HG23  THR  14          HG23      THR  14  60.027  13.766 -13.713
  106    H    ARG  15           HN       ARG  15  61.172  13.437 -12.256
  107    HA   ARG  15           HA       ARG  15  63.851  14.246 -13.043
  108    HE   ARG  15           HE       ARG  15  62.222  18.083 -10.303
  109    HB2  ARG  15           HB2      ARG  15  63.593  15.949 -11.255
  110    HB3  ARG  15           HB1      ARG  15  62.195  15.912 -12.329
  111    HG2  ARG  15           HG2      ARG  15  61.172  14.256 -10.627
  112    HG3  ARG  15           HG1      ARG  15  62.432  14.816  -9.528
  113    HD2  ARG  15           HD2      ARG  15  60.453  16.624 -10.945
  114    HD3  ARG  15           HD1      ARG  15  60.312  16.100  -9.267
  115   HH11  ARG  15          HH21      ARG  15  61.268  15.905  -7.807
  116   HH12  ARG  15          HH22      ARG  15  62.168  16.718  -6.570
  117   HH21  ARG  15          HH11      ARG  15  63.403  19.158  -8.703
  118   HH22  ARG  15          HH12      ARG  15  63.376  18.560  -7.077
  119    H    VAL  16           HN       VAL  16  63.218  11.555 -11.608
  120    HA   VAL  16           HA       VAL  16  64.205  10.226  -9.933
  121    HB   VAL  16           HB       VAL  16  66.591  12.015 -10.466
  122   HG11  VAL  16          HG11      VAL  16  66.337   9.094  -9.686
  123   HG12  VAL  16          HG12      VAL  16  66.823  10.403  -8.608
  124   HG13  VAL  16          HG13      VAL  16  67.852   9.953  -9.968
  125   HG21  VAL  16          HG21      VAL  16  65.557  11.250 -12.589
  126   HG22  VAL  16          HG22      VAL  16  65.629   9.585 -12.011
  127   HG23  VAL  16          HG23      VAL  16  67.119  10.478 -12.315
  128    H    MET  17           HN       MET  17  62.775  11.335  -8.308
  129    HA   MET  17           HA       MET  17  64.332  12.222  -6.051
  130    HB2  MET  17           HB2      MET  17  64.258  14.301  -7.532
  131    HB3  MET  17           HB1      MET  17  62.521  14.340  -7.232
  132    HG2  MET  17           HG2      MET  17  62.825  14.663  -4.894
  133    HG3  MET  17           HG1      MET  17  64.530  14.223  -4.978
  134    HE1  MET  17           HE1      MET  17  65.252  16.381  -3.647
  135    HE2  MET  17           HE2      MET  17  63.519  16.645  -3.472
  136    HE3  MET  17           HE3      MET  17  64.560  17.975  -3.972
  137    H    GLY  18           HN       GLY  18  62.851  12.789  -4.187
  138    HA2  GLY  18           HA2      GLY  18  60.080  12.628  -4.134
  139    HA3  GLY  18           HA1      GLY  18  60.608  10.944  -4.141
  140    H    GLY  19           HN       GLY  19  59.507  13.046  -2.032
  141    HA2  GLY  19           HA2      GLY  19  59.627  13.050   0.326
  142    HA3  GLY  19           HA1      GLY  19  60.881  11.813   0.220
  143    HA   PRO  20           HA       PRO  20  62.827  16.342  -0.608
  144    HB2  PRO  20           HB2      PRO  20  61.032  17.580   1.453
  145    HB3  PRO  20           HB1      PRO  20  61.738  18.302  -0.008
  146    HG2  PRO  20           HG2      PRO  20  59.186  17.562   0.075
  147    HG3  PRO  20           HG1      PRO  20  60.158  17.363  -1.393
  148    HD2  PRO  20           HD2      PRO  20  59.210  15.289   0.529
  149    HD3  PRO  20           HD1      PRO  20  59.552  15.146  -1.209
  150    H1U  RCY  21           H1U      RCY  21  66.917   7.242  -0.260
  151    H1S  RCY  21           H1S      RCY  21  65.945  11.318   0.341
  152    HB1  RCY  21           HB1      RCY  21  66.245  13.440   3.338
  153    HB2  RCY  21           HB2      RCY  21  66.532  13.870   1.652
  154    HA   RCY  21           HA       RCY  21  64.359  14.910   3.487
  155    HN1  RCY  21           HN1      RCY  21  64.296  14.780   0.564
  156    H    THR  22           HN       THR  22  66.385  15.673   4.618
  157    HA   THR  22           HA       THR  22  67.840  17.816   3.151
  158    HB   THR  22           HB       THR  22  66.561  18.285   5.855
  159    HG1  THR  22           HG1      THR  22  65.691  18.801   3.229
  160   HG21  THR  22          HG21      THR  22  67.146  20.619   5.402
  161   HG22  THR  22          HG22      THR  22  67.802  20.168   3.829
  162   HG23  THR  22          HG23      THR  22  68.589  19.609   5.305
  163    HA   PRO  23           HA       PRO  23  70.827  15.220   5.507
  164    HB2  PRO  23           HB2      PRO  23  72.665  16.938   3.899
  165    HB3  PRO  23           HB1      PRO  23  72.672  15.178   4.121
  166    HG2  PRO  23           HG2      PRO  23  71.837  16.294   1.852
  167    HG3  PRO  23           HG1      PRO  23  71.069  14.837   2.507
  168    HD2  PRO  23           HD2      PRO  23  70.063  17.657   2.501
  169    HD3  PRO  23           HD1      PRO  23  69.153  16.134   2.386
  170    H    ARG  24           HN       ARG  24  73.182  16.236   6.375
  171    HA   ARG  24           HA       ARG  24  73.071  18.961   7.297
  172    HE   ARG  24           HE       ARG  24  71.206  17.363  11.351
  173    HB2  ARG  24           HB2      ARG  24  71.260  17.924   8.702
  174    HB3  ARG  24           HB1      ARG  24  72.474  16.853   9.397
  175    HG2  ARG  24           HG2      ARG  24  73.424  18.518  10.651
  176    HG3  ARG  24           HG1      ARG  24  73.148  19.744   9.413
  177    HD2  ARG  24           HD2      ARG  24  71.765  20.076  11.489
  178    HD3  ARG  24           HD1      ARG  24  70.808  19.915  10.016
  179   HH11  ARG  24          HH21      ARG  24  69.409  20.304  11.249
  180   HH12  ARG  24          HH22      ARG  24  67.995  19.621  11.978
  181   HH21  ARG  24          HH11      ARG  24  69.369  16.454  12.304
  182   HH22  ARG  24          HH12      ARG  24  67.972  17.441  12.576
  183    H    LYS  25           HN       LYS  25  74.160  16.628   9.633
  184    HA   LYS  25           HA       LYS  25  76.851  16.420   8.471
  185    HB2  LYS  25           HB2      LYS  25  77.981  17.555  10.304
  186    HB3  LYS  25           HB1      LYS  25  76.823  18.666   9.575
  187    HG2  LYS  25           HG2      LYS  25  76.110  18.975  11.717
  188    HG3  LYS  25           HG1      LYS  25  75.266  17.445  11.470
  189    HD2  LYS  25           HD2      LYS  25  76.457  17.039  13.446
  190    HD3  LYS  25           HD1      LYS  25  77.532  16.369  12.218
  191    HE2  LYS  25           HE2      LYS  25  78.977  17.694  13.518
  192    HE3  LYS  25           HE1      LYS  25  78.581  18.750  12.163
  193    HZ1  LYS  25           HZ1      LYS  25  77.476  20.149  13.481
  194    HZ2  LYS  25           HZ2      LYS  25  78.284  19.387  14.767
  195    HZ3  LYS  25           HZ3      LYS  25  76.711  18.905  14.344
  196    H    GLY  26           HN       GLY  26  78.303  15.185  10.110
  197    HA2  GLY  26           HA2      GLY  26  76.939  13.671  12.189
  198    HA3  GLY  26           HA1      GLY  26  77.248  12.705  10.746
  199    HA   PRO  27           HA       PRO  27  81.024  12.727  13.562
  200    HB2  PRO  27           HB2      PRO  27  80.818   9.795  13.366
  201    HB3  PRO  27           HB1      PRO  27  80.898  10.816  14.812
  202    HG2  PRO  27           HG2      PRO  27  78.669   9.498  14.056
  203    HG3  PRO  27           HG1      PRO  27  78.638  11.027  14.949
  204    HD2  PRO  27           HD2      PRO  27  78.128  10.536  12.036
  205    HD3  PRO  27           HD1      PRO  27  77.360  11.705  13.135
  206    HA   PRO  28           HA       PRO  28  84.171  11.954  10.551
  207    HB2  PRO  28           HB2      PRO  28  85.083   9.536  12.068
  208    HB3  PRO  28           HB1      PRO  28  86.026  10.921  11.481
  209    HG2  PRO  28           HG2      PRO  28  85.362  10.677  14.049
  210    HG3  PRO  28           HG1      PRO  28  85.413  12.257  13.249
  211    HD2  PRO  28           HD2      PRO  28  83.045  10.657  14.098
  212    HD3  PRO  28           HD1      PRO  28  83.219  12.418  13.933
  213    H    LYS  29           HN       LYS  29  84.919  10.355   8.878
  214    HA   LYS  29           HA       LYS  29  82.866   9.017   7.569
  215    HB2  LYS  29           HB2      LYS  29  85.846   8.550   7.614
  216    HB3  LYS  29           HB1      LYS  29  84.793   7.524   6.639
  217    HG2  LYS  29           HG2      LYS  29  85.600   9.377   5.270
  218    HG3  LYS  29           HG1      LYS  29  83.869   9.571   5.549
  219    HD2  LYS  29           HD2      LYS  29  84.217  11.257   7.193
  220    HD3  LYS  29           HD1      LYS  29  85.936  10.882   7.322
  221    HE2  LYS  29           HE2      LYS  29  84.557  12.044   4.883
  222    HE3  LYS  29           HE1      LYS  29  85.598  12.930   5.997
  223    HZ1  LYS  29           HZ1      LYS  29  86.371  10.665   4.244
  224    HZ2  LYS  29           HZ2      LYS  29  87.380  11.324   5.441
  225    HZ3  LYS  29           HZ3      LYS  29  86.888  12.276   4.123
  226    H1U  RCY  30           H1U      RCY  30  78.106   2.067   9.259
  227    H1S  RCY  30           H1S      RCY  30  81.545   3.408  11.217
  228    HB1  RCY  30           HB1      RCY  30  85.527   4.894  10.429
  229    HB2  RCY  30           HB2      RCY  30  84.383   4.964   9.089
  230    HA   RCY  30           HA       RCY  30  82.699   5.836  10.876
  231    HN1  RCY  30           HN1      RCY  30  84.528   8.016  10.438
  232    H    LYS  31           HN       LYS  31  82.518   5.850  13.069
  233    HA   LYS  31           HA       LYS  31  84.817   5.626  14.799
  234    HB2  LYS  31           HB2      LYS  31  84.971   8.043  14.199
  235    HB3  LYS  31           HB1      LYS  31  83.351   8.283  14.851
  236    HG2  LYS  31           HG2      LYS  31  85.228   6.890  16.665
  237    HG3  LYS  31           HG1      LYS  31  85.635   8.571  16.321
  238    HD2  LYS  31           HD2      LYS  31  82.799   7.877  17.003
  239    HD3  LYS  31           HD1      LYS  31  83.988   7.990  18.302
  240    HE2  LYS  31           HE2      LYS  31  83.749  10.176  16.242
  241    HE3  LYS  31           HE1      LYS  31  82.685  10.142  17.647
  242    HZ1  LYS  31           HZ1      LYS  31  84.350  11.221  18.644
  243    HZ2  LYS  31           HZ2      LYS  31  85.497  10.759  17.480
  244    HZ3  LYS  31           HZ3      LYS  31  85.096   9.701  18.748
  245    H    GLN  32           HN       GLN  32  81.477   5.690  14.181
  246    HA   GLN  32           HA       GLN  32  80.616   5.583  16.972
  247    HB2  GLN  32           HB2      GLN  32  79.229   6.376  14.937
  248    HB3  GLN  32           HB1      GLN  32  78.982   4.662  14.611
  249    HG2  GLN  32           HG2      GLN  32  77.131   5.280  15.958
  250    HG3  GLN  32           HG1      GLN  32  78.241   4.481  17.072
  251   HE21  GLN  32          HE21      GLN  32  79.235   5.765  18.730
  252   HE22  GLN  32          HE22      GLN  32  78.842   7.396  18.985
  253    H    ARG  33           HN       ARG  33  79.957   3.188  14.455
  254    HA   ARG  33           HA       ARG  33  80.233   0.858  14.445
  255    HE   ARG  33           HE       ARG  33  83.584  -2.964  16.716
  256    HB2  ARG  33           HB2      ARG  33  82.517   1.577  15.489
  257    HB3  ARG  33           HB1      ARG  33  81.814   1.008  17.001
  258    HG2  ARG  33           HG2      ARG  33  81.342  -1.181  15.949
  259    HG3  ARG  33           HG1      ARG  33  82.076  -0.611  14.449
  260    HD2  ARG  33           HD2      ARG  33  84.232  -0.412  15.474
  261    HD3  ARG  33           HD1      ARG  33  83.557  -0.633  17.088
  262   HH11  ARG  33          HH21      ARG  33  83.862  -1.171  13.784
  263   HH12  ARG  33          HH22      ARG  33  84.169  -2.565  12.804
  264   HH21  ARG  33          HH11      ARG  33  83.983  -4.796  15.453
  265   HH22  ARG  33          HH12      ARG  33  84.237  -4.618  13.749
  266    H    GLN  34           HN       GLN  34  78.128   0.329  14.887
  267    HA   GLN  34           HA       GLN  34  77.536  -0.983  17.353
  268    HB2  GLN  34           HB2      GLN  34  76.001   0.481  18.416
  269    HB3  GLN  34           HB1      GLN  34  77.367   1.512  18.005
  270    HG2  GLN  34           HG2      GLN  34  74.763   1.249  16.473
  271    HG3  GLN  34           HG1      GLN  34  75.339   2.668  17.349
  272   HE21  GLN  34          HE21      GLN  34  78.073   2.654  16.489
  273   HE22  GLN  34          HE22      GLN  34  78.111   2.973  14.822
  274    H    THR  35           HN       THR  35  77.279  -0.857  14.274
  275    HA   THR  35           HA       THR  35  74.699  -0.833  13.327
  276    HB   THR  35           HB       THR  35  76.545  -3.121  12.647
  277    HG1  THR  35           HG1      THR  35  77.959  -1.551  12.437
  278   HG21  THR  35          HG21      THR  35  75.643  -2.702  10.385
  279   HG22  THR  35          HG22      THR  35  74.678  -1.371  11.022
  280   HG23  THR  35          HG23      THR  35  74.350  -3.024  11.540
  281    H    ARG  36           HN       ARG  36  73.147  -2.555  12.986
  282    HA   ARG  36           HA       ARG  36  72.749  -4.162  15.421
  283    HE   ARG  36           HE       ARG  36  69.351  -4.482  16.680
  284    HB2  ARG  36           HB2      ARG  36  70.817  -2.991  14.585
  285    HB3  ARG  36           HB1      ARG  36  71.057  -3.638  12.963
  286    HG2  ARG  36           HG2      ARG  36  70.342  -5.785  13.569
  287    HG3  ARG  36           HG1      ARG  36  70.675  -5.518  15.281
  288    HD2  ARG  36           HD2      ARG  36  68.660  -3.720  14.041
  289    HD3  ARG  36           HD1      ARG  36  68.182  -5.406  14.242
  290   HH11  ARG  36          HH21      ARG  36  66.598  -4.096  14.641
  291   HH12  ARG  36          HH22      ARG  36  65.529  -3.680  15.939
  292   HH21  ARG  36          HH11      ARG  36  67.971  -3.941  18.387
  293   HH22  ARG  36          HH12      ARG  36  66.306  -3.592  18.059
  294    H    GLN  37           HN       GLN  37  74.539  -4.618  12.749
  295    HA   GLN  37           HA       GLN  37  75.595  -6.600  12.010
  296    HB2  GLN  37           HB2      GLN  37  74.568  -7.525  14.293
  297    HB3  GLN  37           HB1      GLN  37  73.469  -8.355  13.193
  298    HG2  GLN  37           HG2      GLN  37  75.567  -9.108  11.918
  299    HG3  GLN  37           HG1      GLN  37  76.481  -8.566  13.326
  300   HE21  GLN  37          HE21      GLN  37  74.644 -11.182  12.046
  301   HE22  GLN  37          HE22      GLN  37  74.545 -12.102  13.469
  302    H1U  RCY  38           H1U      RCY  38  76.184  -4.556   2.281
  303    H1S  RCY  38           H1S      RCY  38  72.662  -4.876   4.322
  304    HB1  RCY  38           HB1      RCY  38  74.103  -4.910   7.671
  305    HB2  RCY  38           HB2      RCY  38  72.612  -4.576   8.551
  306    HA   RCY  38           HA       RCY  38  72.303  -7.004   8.928
  307    HN1  RCY  38           HN1      RCY  38  74.795  -5.744   9.951
  308    H    LYS  39           HN       LYS  39  72.707  -9.046   8.194
  309    HA   LYS  39           HA       LYS  39  73.675 -10.791   6.969
  310    HB2  LYS  39           HB2      LYS  39  74.738  -8.488   5.302
  311    HB3  LYS  39           HB1      LYS  39  74.659 -10.175   4.797
  312    HG2  LYS  39           HG2      LYS  39  72.151  -8.856   5.770
  313    HG3  LYS  39           HG1      LYS  39  72.723  -8.485   4.143
  314    HD2  LYS  39           HD2      LYS  39  72.641 -10.790   3.492
  315    HD3  LYS  39           HD1      LYS  39  72.388 -11.317   5.156
  316    HE2  LYS  39           HE2      LYS  39  70.452  -9.544   3.643
  317    HE3  LYS  39           HE1      LYS  39  70.290 -11.297   3.759
  318    HZ1  LYS  39           HZ1      LYS  39  70.428 -10.943   6.248
  319    HZ2  LYS  39           HZ2      LYS  39  68.993 -10.447   5.486
  320    HZ3  LYS  39           HZ3      LYS  39  70.162  -9.297   5.934
  321    H    SER  40           HN       SER  40  75.409 -12.006   7.526
  322    HA   SER  40           HA       SER  40  78.108 -10.838   7.561
  323    HG   SER  40           HG       SER  40  76.478 -11.786  11.136
  324    HB2  SER  40           HB2      SER  40  78.520 -11.538   9.922
  325    HB3  SER  40           HB1      SER  40  77.332 -10.244   9.798
  326    H    LYS  41           HN       LYS  41  75.963 -13.414   7.218
  327    HA   LYS  41           HA       LYS  41  77.921 -15.549   7.684
  328    HB2  LYS  41           HB2      LYS  41  75.325 -15.882   6.186
  329    HB3  LYS  41           HB1      LYS  41  76.164 -17.047   7.210
  330    HG2  LYS  41           HG2      LYS  41  74.757 -14.525   8.132
  331    HG3  LYS  41           HG1      LYS  41  74.230 -16.185   8.415
  332    HD2  LYS  41           HD2      LYS  41  76.457 -16.558   9.597
  333    HD3  LYS  41           HD1      LYS  41  76.686 -14.810   9.527
  334    HE2  LYS  41           HE2      LYS  41  74.380 -14.618  10.631
  335    HE3  LYS  41           HE1      LYS  41  74.512 -16.346  10.960
  336    HZ1  LYS  41           HZ1      LYS  41  76.820 -14.726  11.662
  337    HZ2  LYS  41           HZ2      LYS  41  76.109 -16.026  12.492
  338    HZ3  LYS  41           HZ3      LYS  41  75.429 -14.473  12.600
  339    HA   PRO  42           HA       PRO  42  80.064 -15.746   3.825
  340    HB2  PRO  42           HB2      PRO  42  78.808 -18.465   3.577
  341    HB3  PRO  42           HB1      PRO  42  80.496 -17.983   3.319
  342    HG2  PRO  42           HG2      PRO  42  79.676 -19.186   5.572
  343    HG3  PRO  42           HG1      PRO  42  80.981 -17.991   5.553
  344    HD2  PRO  42           HD2      PRO  42  78.269 -17.749   6.679
  345    HD3  PRO  42           HD1      PRO  42  79.706 -16.751   6.987
  346    HA   PRO  43           HA       PRO  43  77.052 -14.687   0.744
  347    HB2  PRO  43           HB2      PRO  43  78.432 -15.256  -1.567
  348    HB3  PRO  43           HB1      PRO  43  78.749 -13.832  -0.558
  349    HG2  PRO  43           HG2      PRO  43  80.220 -16.414  -0.692
  350    HG3  PRO  43           HG1      PRO  43  80.843 -14.764  -0.517
  351    HD2  PRO  43           HD2      PRO  43  80.629 -16.491   1.592
  352    HD3  PRO  43           HD1      PRO  43  80.487 -14.728   1.774
  353    H    LYS  44           HN       LYS  44  75.261 -15.859   0.223
  354    HA   LYS  44           HA       LYS  44  75.566 -18.741  -0.431
  355    HB2  LYS  44           HB2      LYS  44  73.842 -17.596   1.265
  356    HB3  LYS  44           HB1      LYS  44  72.887 -17.419  -0.205
  357    HG2  LYS  44           HG2      LYS  44  72.202 -19.529   0.490
  358    HG3  LYS  44           HG1      LYS  44  73.552 -19.960  -0.561
  359    HD2  LYS  44           HD2      LYS  44  75.051 -20.079   1.378
  360    HD3  LYS  44           HD1      LYS  44  73.734 -19.592   2.445
  361    HE2  LYS  44           HE2      LYS  44  73.799 -21.956   2.627
  362    HE3  LYS  44           HE1      LYS  44  72.465 -21.635   1.519
  363    HZ1  LYS  44           HZ1      LYS  44  75.117 -21.944   0.348
  364    HZ2  LYS  44           HZ2      LYS  44  73.603 -22.443  -0.240
  365    HZ3  LYS  44           HZ3      LYS  44  74.389 -23.347   0.966
  366    H    LYS  45           HN       LYS  45  73.400 -16.148  -1.623
  367    HA   LYS  45           HA       LYS  45  73.449 -17.393  -4.304
  368    HB2  LYS  45           HB2      LYS  45  71.959 -14.946  -3.301
  369    HB3  LYS  45           HB1      LYS  45  71.704 -15.748  -4.850
  370    HG2  LYS  45           HG2      LYS  45  71.501 -17.359  -2.325
  371    HG3  LYS  45           HG1      LYS  45  70.149 -16.330  -2.798
  372    HD2  LYS  45           HD2      LYS  45  70.127 -17.426  -5.031
  373    HD3  LYS  45           HD1      LYS  45  71.421 -18.498  -4.494
  374    HE2  LYS  45           HE2      LYS  45  69.966 -19.322  -2.666
  375    HE3  LYS  45           HE1      LYS  45  68.667 -18.276  -3.241
  376    HZ1  LYS  45           HZ1      LYS  45  68.130 -20.141  -4.370
  377    HZ2  LYS  45           HZ2      LYS  45  69.720 -20.740  -4.388
  378    HZ3  LYS  45           HZ3      LYS  45  69.253 -19.528  -5.484
  379    H    GLY  46           HN       GLY  46  74.675 -14.560  -2.628
  380    HA2  GLY  46           HA2      GLY  46  75.418 -13.070  -4.978
  381    HA3  GLY  46           HA1      GLY  46  76.076 -12.822  -3.360
  382    H    VAL  47           HN       VAL  47  76.228 -15.348  -5.903
  383    HA   VAL  47           HA       VAL  47  78.953 -16.053  -5.087
  384    HB   VAL  47           HB       VAL  47  78.813 -17.572  -7.114
  385   HG11  VAL  47          HG11      VAL  47  78.221 -18.467  -4.956
  386   HG12  VAL  47          HG12      VAL  47  76.983 -18.997  -6.095
  387   HG13  VAL  47          HG13      VAL  47  76.652 -17.661  -4.992
  388   HG21  VAL  47          HG21      VAL  47  75.923 -16.666  -7.177
  389   HG22  VAL  47          HG22      VAL  47  76.738 -17.749  -8.306
  390   HG23  VAL  47          HG23      VAL  47  77.145 -16.033  -8.280
  391    H    GLN  48           HN       GLN  48  78.192 -13.312  -6.225
  392    HA   GLN  48           HA       GLN  48  80.592 -12.966  -7.817
  393    HB2  GLN  48           HB2      GLN  48  78.883 -13.954  -9.448
  394    HB3  GLN  48           HB1      GLN  48  77.984 -12.449  -9.258
  395    HG2  GLN  48           HG2      GLN  48  79.392 -12.173 -11.186
  396    HG3  GLN  48           HG1      GLN  48  80.112 -11.220  -9.888
  397   HE21  GLN  48          HE21      GLN  48  82.279 -11.433 -10.825
  398   HE22  GLN  48          HE22      GLN  48  83.123 -12.905 -10.757
  399    H    GLY  49           HN       GLY  49  81.259 -10.866  -7.576
  400    HA2  GLY  49           HA2      GLY  49  81.104  -8.534  -7.210
  401    HA3  GLY  49           HA1      GLY  49  79.347  -8.677  -7.281
  402    H1U  RCY  50           H1U      RCY  50  80.738  -5.803   2.184
  403    H1S  RCY  50           H1S      RCY  50  80.692  -8.454  -1.251
  404    HB1  RCY  50           HB1      RCY  50  79.756 -11.711  -2.738
  405    HB2  RCY  50           HB2      RCY  50  78.751 -10.382  -3.315
  406    HA   RCY  50           HA       RCY  50  80.820  -8.890  -2.825
  407    HN1  RCY  50           HN1      RCY  50  81.411 -10.585  -5.143
  408    H    GLY  51           HN       GLY  51  82.314 -11.666  -4.304
  409    HA2  GLY  51           HA2      GLY  51  83.692 -12.671  -1.994
  410    HA3  GLY  51           HA1      GLY  51  84.184 -12.939  -3.668
  411    H    ASP  52           HN       ASP  52  84.946 -11.303  -0.791
  412    HA   ASP  52           HA       ASP  52  87.259 -10.035  -2.089
  413    HB2  ASP  52           HB2      ASP  52  85.124  -8.405  -0.679
  414    HB3  ASP  52           HB1      ASP  52  86.725  -7.792  -1.096
  415    H    ASP  53           HN       ASP  53  88.497  -8.754  -0.228
  416    HA   ASP  53           HA       ASP  53  88.901 -10.690   1.918
  417    HB2  ASP  53           HB2      ASP  53  90.116  -7.959   1.396
  418    HB3  ASP  53           HB1      ASP  53  90.628  -9.042   2.691
  419    H    ILE  54           HN       ILE  54  86.369  -8.894   1.613
  420    HA   ILE  54           HA       ILE  54  86.201  -8.266   4.512
  421    HB   ILE  54           HB       ILE  54  85.280  -6.293   2.411
  422   HG12  ILE  54          HG12      ILE  54  87.864  -6.383   3.999
  423   HG13  ILE  54          HG11      ILE  54  87.699  -6.425   2.243
  424   HG21  ILE  54          HG21      ILE  54  84.948  -4.821   4.253
  425   HG22  ILE  54          HG22      ILE  54  85.869  -5.857   5.344
  426   HG23  ILE  54          HG23      ILE  54  84.280  -6.368   4.775
  427   HD11  ILE  54          HD11      ILE  54  88.236  -4.170   2.711
  428   HD12  ILE  54          HD12      ILE  54  87.176  -4.121   4.119
  429   HD13  ILE  54          HD13      ILE  54  86.485  -4.156   2.497
  430    HA   PRO  55           HA       PRO  55  82.369 -10.234   2.839
  431    HB2  PRO  55           HB2      PRO  55  82.283 -12.358   4.514
  432    HB3  PRO  55           HB1      PRO  55  83.315 -12.343   3.070
  433    HG2  PRO  55           HG2      PRO  55  84.049 -11.946   5.918
  434    HG3  PRO  55           HG1      PRO  55  84.945 -12.750   4.620
  435    HD2  PRO  55           HD2      PRO  55  85.416 -10.144   5.529
  436    HD3  PRO  55           HD1      PRO  55  85.968 -10.805   3.975
  437    H    GLY  56           HN       GLY  56  81.657  -8.112   4.004
  438    HA2  GLY  56           HA2      GLY  56  80.149  -7.116   5.502
  439    HA3  GLY  56           HA1      GLY  56  79.637  -8.748   5.936
  440    H    MET  57           HN       MET  57  81.856  -6.141   6.724
  441    HA   MET  57           HA       MET  57  83.228  -7.572   8.835
  442    HB2  MET  57           HB2      MET  57  83.803  -5.301   7.538
  443    HB3  MET  57           HB1      MET  57  82.975  -4.590   8.922
  444    HG2  MET  57           HG2      MET  57  85.437  -6.344   8.923
  445    HG3  MET  57           HG1      MET  57  85.260  -4.713   9.572
  446    HE1  MET  57           HE1      MET  57  86.664  -6.650  11.174
  447    HE2  MET  57           HE2      MET  57  85.859  -8.126  10.647
  448    HE3  MET  57           HE3      MET  57  85.807  -7.660  12.345
  449    H    GLU  58           HN       GLU  58  80.552  -8.092   9.218
  450    HA   GLU  58           HA       GLU  58  78.841  -7.975  10.821
  451    HB2  GLU  58           HB2      GLU  58  81.039  -8.376  12.187
  452    HB3  GLU  58           HB1      GLU  58  80.841  -6.694  12.677
  453    HG2  GLU  58           HG2      GLU  58  78.584  -7.182  13.514
  454    HG3  GLU  58           HG1      GLU  58  78.739  -8.858  12.987
  455    H    GLY  59           HN       GLY  59  79.362  -5.622   9.062
  456    HA2  GLY  59           HA2      GLY  59  78.098  -3.610   8.856
  457    HA3  GLY  59           HA1      GLY  59  77.714  -3.704  10.576
  458    H1U  RCY  60           H1U      RCY  60  76.219  -3.124   5.903
  459    H1S  RCY  60           H1S      RCY  60  80.279  -3.225   7.372
  460    HB1  RCY  60           HB1      RCY  60  81.924   0.477   9.392
  461    HB2  RCY  60           HB2      RCY  60  80.377   0.434   8.547
  462    HA   RCY  60           HA       RCY  60  81.087  -0.950  11.147
  463    HN1  RCY  60           HN1      RCY  60  78.393  -1.265   9.985
  464    H    GLY  61           HN       GLY  61  78.568  -0.421  12.267
  465    HA2  GLY  61           HA2      GLY  61  77.648   1.315  13.571
  466    HA3  GLY  61           HA1      GLY  61  78.874   2.400  12.915
  467    H    THR  62           HN       THR  62  76.363   0.466  11.266
  468    HA   THR  62           HA       THR  62  74.867   2.891  10.544
  469    HB   THR  62           HB       THR  62  75.124   2.389   8.068
  470    HG1  THR  62           HG1      THR  62  76.563   0.948   7.456
  471   HG21  THR  62          HG21      THR  62  76.373   4.191   9.418
  472   HG22  THR  62          HG22      THR  62  77.063   3.736   7.860
  473   HG23  THR  62          HG23      THR  62  77.760   3.105   9.352
  474    H    ASP  63           HN       ASP  63  73.300   1.545  11.732
  475    HA   ASP  63           HA       ASP  63  72.444  -0.997  10.642
  476    HB2  ASP  63           HB2      ASP  63  71.966  -0.324  12.985
  477    HB3  ASP  63           HB1      ASP  63  70.929   0.973  12.389
  478    H    ILE  64           HN       ILE  64  72.622   1.616   8.987
  479    HA   ILE  64           HA       ILE  64  71.307   2.816   7.449
  480    HB   ILE  64           HB       ILE  64  71.867   0.287   6.662
  481   HG12  ILE  64          HG12      ILE  64  71.862   2.313   5.245
  482   HG13  ILE  64          HG11      ILE  64  71.059   0.972   4.429
  483   HG21  ILE  64          HG21      ILE  64  69.983  -0.961   6.080
  484   HG22  ILE  64          HG22      ILE  64  68.923   0.448   6.087
  485   HG23  ILE  64          HG23      ILE  64  69.470  -0.252   7.610
  486   HD11  ILE  64          HD11      ILE  64  69.718   3.000   4.172
  487   HD12  ILE  64          HD12      ILE  64  69.697   3.234   5.920
  488   HD13  ILE  64          HD13      ILE  64  68.863   1.855   5.205
  489    H    THR  65           HN       THR  65  70.085   2.438  10.060
  490    HA   THR  65           HA       THR  65  67.191   2.557   9.252
  491    HB   THR  65           HB       THR  65  68.253   1.787  11.988
  492    HG1  THR  65           HG1      THR  65  68.105   0.367   9.702
  493   HG21  THR  65          HG21      THR  65  66.004   2.637  12.074
  494   HG22  THR  65          HG22      THR  65  65.900   0.880  12.182
  495   HG23  THR  65          HG23      THR  65  65.535   1.693  10.660
  496    H    VAL  66           HN       VAL  66  69.884   3.990  10.863
  497    HA   VAL  66           HA       VAL  66  68.390   6.512  11.149
  498    HB   VAL  66           HB       VAL  66  69.515   6.625  13.559
  499   HG11  VAL  66          HG11      VAL  66  67.386   5.902  14.521
  500   HG12  VAL  66          HG12      VAL  66  66.986   5.031  13.040
  501   HG13  VAL  66          HG13      VAL  66  67.083   6.792  13.028
  502   HG21  VAL  66          HG21      VAL  66  68.880   3.674  13.346
  503   HG22  VAL  66          HG22      VAL  66  69.671   4.521  14.676
  504   HG23  VAL  66          HG23      VAL  66  70.518   4.298  13.145
  505    H    ILE  67           HN       ILE  67  71.249   4.688  10.677
  506    HA   ILE  67           HA       ILE  67  72.777   7.238  10.356
  507    HB   ILE  67           HB       ILE  67  73.917   4.706  11.574
  508   HG12  ILE  67          HG12      ILE  67  73.206   7.344  12.898
  509   HG13  ILE  67          HG11      ILE  67  72.288   5.848  13.075
  510   HG21  ILE  67          HG21      ILE  67  75.874   6.100  12.006
  511   HG22  ILE  67          HG22      ILE  67  75.054   7.508  11.331
  512   HG23  ILE  67          HG23      ILE  67  75.491   6.157  10.285
  513   HD11  ILE  67          HD11      ILE  67  73.724   5.920  14.972
  514   HD12  ILE  67          HD12      ILE  67  75.107   6.423  14.000
  515   HD13  ILE  67          HD13      ILE  67  74.484   4.778  13.863
  516    H1U  RCY  68           H1U      RCY  68  71.962   2.211   0.233
  517    H1S  RCY  68           H1S      RCY  68  74.361   4.563   3.109
  518    HB1  RCY  68           HB1      RCY  68  71.837   6.928   5.940
  519    HB2  RCY  68           HB2      RCY  68  71.608   5.207   5.637
  520    HA   RCY  68           HA       RCY  68  73.534   4.612   6.774
  521    HN1  RCY  68           HN1      RCY  68  72.505   7.066   8.085
  522    HA   PRO  69           HA       PRO  69  77.646   6.074   6.039
  523    HB2  PRO  69           HB2      PRO  69  77.017   5.483   3.166
  524    HB3  PRO  69           HB1      PRO  69  78.433   5.014   4.127
  525    HG2  PRO  69           HG2      PRO  69  76.432   3.307   3.586
  526    HG3  PRO  69           HG1      PRO  69  77.363   3.240   5.089
  527    HD2  PRO  69           HD2      PRO  69  74.556   4.053   4.682
  528    HD3  PRO  69           HD1      PRO  69  75.380   3.564   6.179
  529    H    TRP  70           HN       TRP  70  75.116   7.160   3.782
  530    HA   TRP  70           HA       TRP  70  76.511   9.391   2.711
  531    HD1  TRP  70           HD1      TRP  70  76.265  11.306   1.879
  532    HE1  TRP  70           HE1      TRP  70  75.203  13.451   0.925
  533    HE3  TRP  70           HE3      TRP  70  71.337   9.974   1.988
  534    HZ2  TRP  70           HZ2      TRP  70  72.603  14.471   0.289
  535    HZ3  TRP  70           HZ3      TRP  70  69.592  11.546   1.205
  536    HH2  TRP  70           HH2      TRP  70  70.215  13.790   0.357
  537    HB2  TRP  70           HB2      TRP  70  74.425   8.541   1.736
  538    HB3  TRP  70           HB1      TRP  70  73.537   9.027   3.177
  539    H    GLU  71           HN       GLU  71  75.228   8.885   5.860
  540    HA   GLU  71           HA       GLU  71  74.852  11.726   6.470
  541    HB2  GLU  71           HB2      GLU  71  74.862   9.213   8.154
  542    HB3  GLU  71           HB1      GLU  71  74.697  10.821   8.858
  543    HG2  GLU  71           HG2      GLU  71  72.746  11.220   7.323
  544    HG3  GLU  71           HG1      GLU  71  72.860   9.533   6.821
  545    H    ALA  72           HN       ALA  72  77.167   9.212   7.552
  546    HA   ALA  72           HA       ALA  72  78.903  11.152   8.822
  547    HB1  ALA  72           HB1      ALA  72  79.244   8.251   8.039
  548    HB2  ALA  72           HB2      ALA  72  79.025   8.922   9.655
  549    HB3  ALA  72           HB3      ALA  72  80.542   9.178   8.792
  550    H1U  RCY  73           H1U      RCY  73  75.818   6.237   4.423
  551    H1S  RCY  73           H1S      RCY  73  79.403   7.271   2.848
  552    HB1  RCY  73           HB1      RCY  73  80.724   9.853   2.574
  553    HB2  RCY  73           HB2      RCY  73  79.233   9.272   3.317
  554    HA   RCY  73           HA       RCY  73  81.399  10.735   4.849
  555    HN1  RCY  73           HN1      RCY  73  78.842   9.563   5.652
  556    H    ASN  74           HN       ASN  74  78.174  11.824   5.028
  557    HA   ASN  74           HA       ASN  74  77.037  13.622   3.990
  558    HB2  ASN  74           HB2      ASN  74  78.427  15.732   4.112
  559    HB3  ASN  74           HB1      ASN  74  78.361  14.813   5.615
  560   HD21  ASN  74          HD21      ASN  74  80.319  13.805   6.369
  561   HD22  ASN  74          HD22      ASN  74  81.820  14.055   5.619
  562    H    HIS  75           HN       HIS  75  79.394  15.456   2.613
  563    HA   HIS  75           HA       HIS  75  78.518  15.131  -0.044
  564    HD1  HIS  75           HD1      HIS  75  78.392  16.370  -1.647
  565    HD2  HIS  75           HD2      HIS  75  82.517  16.984  -1.587
  566    HE1  HIS  75           HE1      HIS  75  79.047  17.062  -3.994
  567    HE2  HIS  75           HE2      HIS  75  81.555  17.439  -3.971
  568    HB2  HIS  75           HB2      HIS  75  79.976  17.000   0.919
  569    HB3  HIS  75           HB1      HIS  75  81.345  15.909   0.704
  570    H1U  RCY  76           H1U      RCY  76  74.326   6.934  -2.747
  571    H1S  RCY  76           H1S      RCY  76  76.764  10.142  -3.463
  572    HB1  RCY  76           HB1      RCY  76  79.753  10.710  -0.584
  573    HB2  RCY  76           HB2      RCY  76  80.091  10.174  -2.229
  574    HA   RCY  76           HA       RCY  76  81.591  12.039  -1.329
  575    HN1  RCY  76           HN1      RCY  76  79.472  14.012  -1.851
  576    H    GLU  77           HN       GLU  77  82.859  12.179  -3.107
  577    HA   GLU  77           HA       GLU  77  82.013  13.476  -5.527
  578    HB2  GLU  77           HB2      GLU  77  84.393  11.652  -5.063
  579    HB3  GLU  77           HB1      GLU  77  84.188  12.754  -6.426
  580    HG2  GLU  77           HG2      GLU  77  84.199  14.677  -4.940
  581    HG3  GLU  77           HG1      GLU  77  84.236  13.627  -3.523
  582    H    LEU  78           HN       LEU  78  81.083  12.633  -7.343
  583    HA   LEU  78           HA       LEU  78  80.014   9.959  -7.309
  584    HG   LEU  78           HG       LEU  78  79.678   9.377 -10.045
  585    HB2  LEU  78           HB2      LEU  78  78.996  11.909  -8.532
  586    HB3  LEU  78           HB1      LEU  78  80.328  11.825  -9.681
  587   HD11  LEU  78          HD11      LEU  78  77.370  10.367  -8.374
  588   HD12  LEU  78          HD12      LEU  78  78.297   8.877  -8.197
  589   HD13  LEU  78          HD13      LEU  78  77.157   9.052  -9.530
  590   HD21  LEU  78          HD21      LEU  78  77.722  10.025 -11.513
  591   HD22  LEU  78          HD22      LEU  78  79.157  11.026 -11.733
  592   HD23  LEU  78          HD23      LEU  78  77.795  11.633 -10.791
  593    H    HIS  79           HN       HIS  79  83.019  11.324  -8.367
  594    HA   HIS  79           HA       HIS  79  83.898   8.627  -9.235
  595    HD1  HIS  79           HD1      HIS  79  81.292  10.242 -10.871
  596    HD2  HIS  79           HD2      HIS  79  84.047   7.774 -12.800
  597    HE1  HIS  79           HE1      HIS  79  79.945   8.667 -12.328
  598    HE2  HIS  79           HE2      HIS  79  81.610   7.159 -13.507
  599    HB2  HIS  79           HB2      HIS  79  83.915  11.111 -10.952
  600    HB3  HIS  79           HB1      HIS  79  85.069   9.805 -11.224
  601    H    GLU  80           HN       GLU  80  85.829   8.217  -8.299
  602    HA   GLU  80           HA       GLU  80  87.857  10.323  -8.037
  603    HB2  GLU  80           HB2      GLU  80  86.305  10.488  -5.995
  604    HB3  GLU  80           HB1      GLU  80  86.940   8.912  -5.521
  605    HG2  GLU  80           HG2      GLU  80  88.708  11.293  -6.132
  606    HG3  GLU  80           HG1      GLU  80  88.156  10.892  -4.506
  607    H    LEU  81           HN       LEU  81  87.262   7.253  -6.309
  608    HA   LEU  81           HA       LEU  81  89.925   6.313  -7.166
  609    HG   LEU  81           HG       LEU  81  87.420   3.847  -6.215
  610    HB2  LEU  81           HB2      LEU  81  89.680   4.590  -5.540
  611    HB3  LEU  81           HB1      LEU  81  88.986   6.030  -4.800
  612   HD11  LEU  81          HD11      LEU  81  88.355   3.219  -3.981
  613   HD12  LEU  81          HD12      LEU  81  86.592   3.286  -3.991
  614   HD13  LEU  81          HD13      LEU  81  87.520   4.606  -3.279
  615   HD21  LEU  81          HD21      LEU  81  85.493   5.157  -5.084
  616   HD22  LEU  81          HD22      LEU  81  86.215   5.863  -6.530
  617   HD23  LEU  81          HD23      LEU  81  86.656   6.474  -4.936
  618    H    ALA  82           HN       ALA  82  86.737   6.129  -8.286
  619    HA   ALA  82           HA       ALA  82  86.670   3.457  -9.328
  620    HB1  ALA  82           HB1      ALA  82  85.336   5.935 -10.463
  621    HB2  ALA  82           HB2      ALA  82  84.674   4.954  -9.155
  622    HB3  ALA  82           HB3      ALA  82  84.869   4.262 -10.765
  623    H    GLN  83           HN       GLN  83  86.790   2.959 -11.725
  624    HA   GLN  83           HA       GLN  83  88.375   4.721 -13.417
  625    HB2  GLN  83           HB2      GLN  83  90.068   3.701 -11.816
  626    HB3  GLN  83           HB1      GLN  83  89.690   2.139 -12.543
  627    HG2  GLN  83           HG2      GLN  83  91.595   2.973 -13.728
  628    HG3  GLN  83           HG1      GLN  83  90.213   3.206 -14.799
  629   HE21  GLN  83          HE21      GLN  83  92.523   4.897 -12.705
  630   HE22  GLN  83          HE22      GLN  83  92.148   6.457 -13.258
  631    H    TYR  84           HN       TYR  84  87.226   1.406 -12.815
  632    HA   TYR  84           HA       TYR  84  85.947   1.324 -15.420
  633    HD1  TYR  84           HD2      TYR  84  85.348  -0.817 -16.569
  634    HD2  TYR  84           HD1      TYR  84  89.124   0.799 -17.827
  635    HE1  TYR  84           HE2      TYR  84  84.633  -0.990 -18.937
  636    HE2  TYR  84           HE1      TYR  84  88.409   0.625 -20.195
  637    HH   TYR  84           HH       TYR  84  85.827   0.587 -21.336
  638    HB2  TYR  84           HB2      TYR  84  88.605   0.718 -15.536
  639    HB3  TYR  84           HB1      TYR  84  87.933  -0.878 -15.217
  640    H    GLY  85           HN       GLY  85  84.966   0.993 -12.816
  641    HA2  GLY  85           HA2      GLY  85  83.526  -0.453 -11.659
  642    HA3  GLY  85           HA1      GLY  85  83.606  -1.530 -13.053
  643    H    ILE  86           HN       ILE  86  85.901  -0.420 -10.521
  644    HA   ILE  86           HA       ILE  86  87.320  -2.943 -10.552
  645    HB   ILE  86           HB       ILE  86  88.241  -0.665  -9.820
  646   HG12  ILE  86          HG12      ILE  86  88.640  -2.791  -7.716
  647   HG13  ILE  86          HG11      ILE  86  89.222  -3.027  -9.365
  648   HG21  ILE  86          HG21      ILE  86  86.163  -0.390  -8.256
  649   HG22  ILE  86          HG22      ILE  86  87.735   0.175  -7.689
  650   HG23  ILE  86          HG23      ILE  86  87.097  -1.371  -7.127
  651   HD11  ILE  86          HD11      ILE  86  90.904  -2.010  -7.739
  652   HD12  ILE  86          HD12      ILE  86  89.891  -0.566  -7.738
  653   HD13  ILE  86          HD13      ILE  86  90.648  -1.111  -9.235
  654    H1U  RCY  87           H1U      RCY  87  78.450  -3.408  -2.929
  655    H1S  RCY  87           H1S      RCY  87  82.111  -3.925  -5.955
  656    HB1  RCY  87           HB1      RCY  87  82.617  -4.919  -9.778
  657    HB2  RCY  87           HB2      RCY  87  82.074  -3.354  -9.192
  658    HA   RCY  87           HA       RCY  87  83.739  -3.531  -7.330
  659    HN1  RCY  87           HN1      RCY  87  84.355  -2.953 -10.015
  Start of MODEL   19
    1    HA   MET   1           HA       MET   1  59.317  -7.144 -13.003
    2    HB2  MET   1           HB2      MET   1  58.587  -4.280 -12.350
    3    HB3  MET   1           HB1      MET   1  59.722  -5.325 -11.496
    4    HG2  MET   1           HG2      MET   1  61.045  -5.429 -13.687
    5    HG3  MET   1           HG1      MET   1  60.033  -4.094 -14.239
    6    HE1  MET   1           HE1      MET   1  61.025  -1.068 -12.387
    7    HE2  MET   1           HE2      MET   1  59.550  -2.018 -12.552
    8    HE3  MET   1           HE3      MET   1  60.591  -1.768 -13.952
    9    H    ASN   2           HN       ASN   2  56.954  -8.153 -13.515
   10    HA   ASN   2           HA       ASN   2  55.546  -8.131 -11.029
   11    HB2  ASN   2           HB2      ASN   2  53.370  -7.147 -12.056
   12    HB3  ASN   2           HB1      ASN   2  54.617  -6.020 -11.523
   13   HD21  ASN   2          HD21      ASN   2  53.277  -4.690 -13.275
   14   HD22  ASN   2          HD22      ASN   2  53.880  -4.768 -14.860
   15    H    LEU   3           HN       LEU   3  54.410  -8.288 -14.425
   16    HA   LEU   3           HA       LEU   3  53.292 -10.035 -15.535
   17    HG   LEU   3           HG       LEU   3  55.032 -10.934 -16.993
   18    HB2  LEU   3           HB2      LEU   3  55.520 -11.421 -14.038
   19    HB3  LEU   3           HB1      LEU   3  54.423 -12.318 -15.088
   20   HD11  LEU   3          HD11      LEU   3  56.974  -9.272 -16.598
   21   HD12  LEU   3          HD12      LEU   3  56.538  -9.374 -14.892
   22   HD13  LEU   3          HD13      LEU   3  55.365  -8.780 -16.068
   23   HD21  LEU   3          HD21      LEU   3  56.501 -12.819 -16.615
   24   HD22  LEU   3          HD22      LEU   3  57.406 -11.929 -15.390
   25   HD23  LEU   3          HD23      LEU   3  57.505 -11.447 -17.084
   26    H    GLU   4           HN       GLU   4  53.820 -12.579 -13.389
   27    HA   GLU   4           HA       GLU   4  50.990 -12.620 -12.650
   28    HB2  GLU   4           HB2      GLU   4  53.314 -14.469 -12.059
   29    HB3  GLU   4           HB1      GLU   4  51.682 -14.756 -11.456
   30    HG2  GLU   4           HG2      GLU   4  51.931 -15.999 -13.513
   31    HG3  GLU   4           HG1      GLU   4  50.865 -14.632 -13.838
   32    HA   PRO   5           HA       PRO   5  50.952 -10.574  -8.740
   33    HB2  PRO   5           HB2      PRO   5  50.094 -13.232  -7.640
   34    HB3  PRO   5           HB1      PRO   5  49.404 -11.622  -7.354
   35    HG2  PRO   5           HG2      PRO   5  48.290 -13.377  -9.049
   36    HG3  PRO   5           HG1      PRO   5  48.231 -11.628  -9.317
   37    HD2  PRO   5           HD2      PRO   5  49.741 -13.681 -10.803
   38    HD3  PRO   5           HD1      PRO   5  49.316 -12.026 -11.289
   39    HA   PRO   6           HA       PRO   6  54.917 -12.036  -7.143
   40    HB2  PRO   6           HB2      PRO   6  55.435  -9.970  -5.457
   41    HB3  PRO   6           HB1      PRO   6  55.568  -9.812  -7.220
   42    HG2  PRO   6           HG2      PRO   6  53.379  -8.923  -5.411
   43    HG3  PRO   6           HG1      PRO   6  54.073  -8.116  -6.827
   44    HD2  PRO   6           HD2      PRO   6  51.698  -9.528  -6.875
   45    HD3  PRO   6           HD1      PRO   6  52.722  -9.261  -8.302
   46    H    LYS   7           HN       LYS   7  55.714 -12.959  -5.160
   47    HA   LYS   7           HA       LYS   7  53.694 -13.973  -3.380
   48    HB2  LYS   7           HB2      LYS   7  56.659 -13.878  -2.788
   49    HB3  LYS   7           HB1      LYS   7  55.478 -15.068  -2.239
   50    HG2  LYS   7           HG2      LYS   7  55.151 -15.812  -4.577
   51    HG3  LYS   7           HG1      LYS   7  56.359 -14.643  -5.111
   52    HD2  LYS   7           HD2      LYS   7  57.628 -16.600  -4.906
   53    HD3  LYS   7           HD1      LYS   7  57.897 -15.818  -3.348
   54    HE2  LYS   7           HE2      LYS   7  56.256 -17.215  -2.275
   55    HE3  LYS   7           HE1      LYS   7  55.713 -17.861  -3.823
   56    HZ1  LYS   7           HZ1      LYS   7  57.348 -19.345  -3.834
   57    HZ2  LYS   7           HZ2      LYS   7  57.629 -18.941  -2.207
   58    HZ3  LYS   7           HZ3      LYS   7  58.525 -18.188  -3.439
   59    H    ALA   8           HN       ALA   8  52.905 -11.603  -2.991
   60    HA   ALA   8           HA       ALA   8  54.479 -10.189  -0.921
   61    HB1  ALA   8           HB1      ALA   8  51.793  -9.474  -2.137
   62    HB2  ALA   8           HB2      ALA   8  53.350  -8.917  -2.752
   63    HB3  ALA   8           HB3      ALA   8  52.808  -8.425  -1.147
   64    H    GLU   9           HN       GLU   9  54.198 -11.989   0.652
   65    HA   GLU   9           HA       GLU   9  51.789 -11.541   2.284
   66    HB2  GLU   9           HB2      GLU   9  51.055 -13.332   0.768
   67    HB3  GLU   9           HB1      GLU   9  52.479 -14.285   1.187
   68    HG2  GLU   9           HG2      GLU   9  51.746 -14.571   3.440
   69    HG3  GLU   9           HG1      GLU   9  50.500 -13.335   3.267
   70    H1U  RCY  10           H1U      RCY  10  58.703 -10.914  10.113
   71    H1S  RCY  10           H1S      RCY  10  57.347  -9.330   6.422
   72    HB1  RCY  10           HB1      RCY  10  55.936 -11.900   4.035
   73    HB2  RCY  10           HB2      RCY  10  56.356 -11.969   5.747
   74    HA   RCY  10           HA       RCY  10  54.349 -13.256   5.500
   75    HN1  RCY  10           HN1      RCY  10  52.621 -11.269   4.292
   76    H    ARG  11           HN       ARG  11  55.048 -12.432   7.760
   77    HA   ARG  11           HA       ARG  11  52.708 -11.137   8.974
   78    HE   ARG  11           HE       ARG  11  52.907 -16.204  11.389
   79    HB2  ARG  11           HB2      ARG  11  55.240 -12.356  10.099
   80    HB3  ARG  11           HB1      ARG  11  54.038 -11.556  11.113
   81    HG2  ARG  11           HG2      ARG  11  52.302 -13.104  10.198
   82    HG3  ARG  11           HG1      ARG  11  53.572 -13.954   9.317
   83    HD2  ARG  11           HD2      ARG  11  54.655 -14.623  11.350
   84    HD3  ARG  11           HD1      ARG  11  53.642 -13.550  12.316
   85   HH11  ARG  11          HH21      ARG  11  51.808 -13.035  12.187
   86   HH12  ARG  11          HH22      ARG  11  50.208 -13.551  12.604
   87   HH21  ARG  11          HH11      ARG  11  50.824 -16.896  11.929
   88   HH22  ARG  11          HH12      ARG  11  49.651 -15.736  12.458
   89    H    SER  12           HN       SER  12  52.607  -8.996   9.473
   90    HA   SER  12           HA       SER  12  54.752  -7.205   8.764
   91    HG   SER  12           HG       SER  12  51.340  -6.228  10.720
   92    HB2  SER  12           HB2      SER  12  53.322  -5.451   9.636
   93    HB3  SER  12           HB1      SER  12  52.311  -6.602   8.767
   94    H    ALA  13           HN       ALA  13  53.699  -5.962  11.627
   95    HA   ALA  13           HA       ALA  13  54.613  -5.823  13.789
   96    HB1  ALA  13           HB1      ALA  13  55.458  -7.741  14.761
   97    HB2  ALA  13           HB2      ALA  13  56.415  -8.169  13.343
   98    HB3  ALA  13           HB3      ALA  13  54.677  -8.465  13.356
   99    H    THR  14           HN       THR  14  56.321  -5.739  10.897
  100    HA   THR  14           HA       THR  14  58.540  -4.251  12.222
  101    HB   THR  14           HB       THR  14  59.642  -6.292  11.778
  102    HG1  THR  14           HG1      THR  14  60.363  -4.244  10.561
  103   HG21  THR  14          HG21      THR  14  59.360  -7.327   9.406
  104   HG22  THR  14          HG22      THR  14  57.899  -6.342   9.324
  105   HG23  THR  14          HG23      THR  14  58.069  -7.564  10.584
  106    H    ARG  15           HN       ARG  15  57.327  -2.374  11.481
  107    HA   ARG  15           HA       ARG  15  58.049  -1.629   8.731
  108    HE   ARG  15           HE       ARG  15  53.650  -1.860  12.739
  109    HB2  ARG  15           HB2      ARG  15  55.550  -0.826   8.446
  110    HB3  ARG  15           HB1      ARG  15  55.983  -2.493   8.072
  111    HG2  ARG  15           HG2      ARG  15  53.949  -2.386   9.480
  112    HG3  ARG  15           HG1      ARG  15  55.271  -3.198  10.321
  113    HD2  ARG  15           HD2      ARG  15  55.698  -1.332  11.702
  114    HD3  ARG  15           HD1      ARG  15  54.817  -0.234  10.640
  115   HH11  ARG  15          HH21      ARG  15  53.195  -0.460   9.621
  116   HH12  ARG  15          HH22      ARG  15  51.472  -0.373   9.765
  117   HH21  ARG  15          HH11      ARG  15  51.401  -1.753  12.945
  118   HH22  ARG  15          HH12      ARG  15  50.456  -1.104  11.647
  119    H    VAL  16           HN       VAL  16  58.676  -0.772  11.480
  120    HA   VAL  16           HA       VAL  16  58.611   1.155  12.857
  121    HB   VAL  16           HB       VAL  16  59.420   3.132  11.609
  122   HG11  VAL  16          HG11      VAL  16  60.568   0.446  10.809
  123   HG12  VAL  16          HG12      VAL  16  61.077   1.470  12.151
  124   HG13  VAL  16          HG13      VAL  16  61.379   1.979  10.490
  125   HG21  VAL  16          HG21      VAL  16  58.988   1.454   9.122
  126   HG22  VAL  16          HG22      VAL  16  59.536   3.129   9.200
  127   HG23  VAL  16          HG23      VAL  16  57.876   2.723   9.637
  128    H    MET  17           HN       MET  17  57.798   3.820  11.666
  129    HA   MET  17           HA       MET  17  54.859   3.461  11.437
  130    HB2  MET  17           HB2      MET  17  55.633   3.825  13.890
  131    HB3  MET  17           HB1      MET  17  55.990   5.475  13.383
  132    HG2  MET  17           HG2      MET  17  53.707   5.873  12.763
  133    HG3  MET  17           HG1      MET  17  53.301   4.164  12.925
  134    HE1  MET  17           HE1      MET  17  55.063   7.034  14.837
  135    HE2  MET  17           HE2      MET  17  53.958   7.299  16.182
  136    HE3  MET  17           HE3      MET  17  53.404   7.562  14.530
  137    H    GLY  18           HN       GLY  18  57.273   4.452   9.812
  138    HA2  GLY  18           HA2      GLY  18  55.992   6.414   8.272
  139    HA3  GLY  18           HA1      GLY  18  56.948   7.294   9.466
  140    H    GLY  19           HN       GLY  19  58.478   8.095   7.971
  141    HA2  GLY  19           HA2      GLY  19  60.858   6.826   7.539
  142    HA3  GLY  19           HA1      GLY  19  59.890   6.246   6.182
  143    HA   PRO  20           HA       PRO  20  60.040  11.217   5.974
  144    HB2  PRO  20           HB2      PRO  20  62.717  11.358   7.315
  145    HB3  PRO  20           HB1      PRO  20  61.380  12.525   7.342
  146    HG2  PRO  20           HG2      PRO  20  61.873  10.923   9.411
  147    HG3  PRO  20           HG1      PRO  20  60.221  11.362   8.948
  148    HD2  PRO  20           HD2      PRO  20  61.637   8.764   8.610
  149    HD3  PRO  20           HD1      PRO  20  59.899   9.088   8.787
  150    H1U  RCY  21           H1U      RCY  21  62.646   2.981   0.331
  151    H1S  RCY  21           H1S      RCY  21  62.060   5.883   3.068
  152    HB1  RCY  21           HB1      RCY  21  62.352   9.371   0.934
  153    HB2  RCY  21           HB2      RCY  21  60.881   9.157   1.883
  154    HA   RCY  21           HA       RCY  21  63.233  10.772   2.888
  155    HN1  RCY  21           HN1      RCY  21  60.390  10.982   3.768
  156    H    THR  22           HN       THR  22  63.319  12.954   2.314
  157    HA   THR  22           HA       THR  22  61.319  13.898   0.298
  158    HB   THR  22           HB       THR  22  63.185  15.558   2.013
  159    HG1  THR  22           HG1      THR  22  61.636  15.624   3.450
  160   HG21  THR  22          HG21      THR  22  62.550  16.755   0.036
  161   HG22  THR  22          HG22      THR  22  61.521  17.354   1.337
  162   HG23  THR  22          HG23      THR  22  60.879  16.203   0.165
  163    HA   PRO  23           HA       PRO  23  64.880  13.026  -2.448
  164    HB2  PRO  23           HB2      PRO  23  62.992  14.524  -4.238
  165    HB3  PRO  23           HB1      PRO  23  63.925  13.049  -4.567
  166    HG2  PRO  23           HG2      PRO  23  61.325  12.945  -4.022
  167    HG3  PRO  23           HG1      PRO  23  62.439  11.704  -3.425
  168    HD2  PRO  23           HD2      PRO  23  61.080  13.889  -1.919
  169    HD3  PRO  23           HD1      PRO  23  61.625  12.295  -1.351
  170    H    ARG  24           HN       ARG  24  66.142  14.641  -1.186
  171    HA   ARG  24           HA       ARG  24  66.771  16.980  -2.805
  172    HE   ARG  24           HE       ARG  24  64.243  19.741  -2.392
  173    HB2  ARG  24           HB2      ARG  24  64.779  17.743  -1.472
  174    HB3  ARG  24           HB1      ARG  24  65.711  17.445  -0.004
  175    HG2  ARG  24           HG2      ARG  24  67.350  19.096  -0.609
  176    HG3  ARG  24           HG1      ARG  24  66.671  19.260  -2.229
  177    HD2  ARG  24           HD2      ARG  24  65.241  19.972   0.350
  178    HD3  ARG  24           HD1      ARG  24  65.964  21.128  -0.769
  179   HH11  ARG  24          HH21      ARG  24  63.981  21.240   0.702
  180   HH12  ARG  24          HH22      ARG  24  62.307  21.643   0.513
  181   HH21  ARG  24          HH11      ARG  24  62.059  20.258  -2.657
  182   HH22  ARG  24          HH12      ARG  24  61.219  21.087  -1.389
  183    H    LYS  25           HN       LYS  25  67.077  16.356   0.692
  184    HA   LYS  25           HA       LYS  25  68.998  16.126   2.022
  185    HB2  LYS  25           HB2      LYS  25  70.310  14.981  -0.450
  186    HB3  LYS  25           HB1      LYS  25  70.654  14.599   1.236
  187    HG2  LYS  25           HG2      LYS  25  68.010  14.029  -0.133
  188    HG3  LYS  25           HG1      LYS  25  69.289  12.836   0.091
  189    HD2  LYS  25           HD2      LYS  25  68.320  12.386   2.084
  190    HD3  LYS  25           HD1      LYS  25  68.988  13.926   2.625
  191    HE2  LYS  25           HE2      LYS  25  66.947  15.090   1.983
  192    HE3  LYS  25           HE1      LYS  25  66.282  13.608   1.295
  193    HZ1  LYS  25           HZ1      LYS  25  65.817  12.765   3.318
  194    HZ2  LYS  25           HZ2      LYS  25  65.779  14.403   3.766
  195    HZ3  LYS  25           HZ3      LYS  25  67.168  13.471   4.063
  196    H    GLY  26           HN       GLY  26  71.307  16.895   2.214
  197    HA2  GLY  26           HA2      GLY  26  71.576  19.468   0.797
  198    HA3  GLY  26           HA1      GLY  26  72.557  18.932   2.162
  199    HA   PRO  27           HA       PRO  27  74.807  18.672  -2.078
  200    HB2  PRO  27           HB2      PRO  27  76.850  19.891  -0.259
  201    HB3  PRO  27           HB1      PRO  27  76.503  20.247  -1.963
  202    HG2  PRO  27           HG2      PRO  27  75.704  21.866  -0.000
  203    HG3  PRO  27           HG1      PRO  27  74.730  21.610  -1.457
  204    HD2  PRO  27           HD2      PRO  27  74.267  20.613   1.309
  205    HD3  PRO  27           HD1      PRO  27  73.093  20.951   0.019
  206    HA   PRO  28           HA       PRO  28  76.864  14.833  -1.265
  207    HB2  PRO  28           HB2      PRO  28  79.372  16.173  -2.225
  208    HB3  PRO  28           HB1      PRO  28  78.680  14.608  -2.699
  209    HG2  PRO  28           HG2      PRO  28  78.452  16.780  -4.241
  210    HG3  PRO  28           HG1      PRO  28  77.172  15.559  -4.140
  211    HD2  PRO  28           HD2      PRO  28  77.209  18.320  -3.060
  212    HD3  PRO  28           HD1      PRO  28  75.822  17.281  -3.454
  213    H    LYS  29           HN       LYS  29  78.433  13.855   0.214
  214    HA   LYS  29           HA       LYS  29  80.006  15.660   1.939
  215    HB2  LYS  29           HB2      LYS  29  77.655  14.033   2.931
  216    HB3  LYS  29           HB1      LYS  29  78.943  14.583   4.002
  217    HG2  LYS  29           HG2      LYS  29  78.515  16.929   3.193
  218    HG3  LYS  29           HG1      LYS  29  77.111  16.315   2.321
  219    HD2  LYS  29           HD2      LYS  29  76.375  17.182   4.472
  220    HD3  LYS  29           HD1      LYS  29  76.218  15.425   4.484
  221    HE2  LYS  29           HE2      LYS  29  78.845  16.437   5.382
  222    HE3  LYS  29           HE1      LYS  29  77.492  16.856   6.433
  223    HZ1  LYS  29           HZ1      LYS  29  77.930  14.104   5.435
  224    HZ2  LYS  29           HZ2      LYS  29  76.935  14.612   6.715
  225    HZ3  LYS  29           HZ3      LYS  29  78.625  14.664   6.878
  226    H1U  RCY  30           H1U      RCY  30  80.882  14.565  -2.745
  227    H1S  RCY  30           H1S      RCY  30  82.392  15.630   1.428
  228    HB1  RCY  30           HB1      RCY  30  83.776  12.952   0.024
  229    HB2  RCY  30           HB2      RCY  30  84.535  12.113   1.377
  230    HA   RCY  30           HA       RCY  30  82.041  11.650   1.022
  231    HN1  RCY  30           HN1      RCY  30  81.808  14.462   1.128
  232    H    LYS  31           HN       LYS  31  82.673  10.093   2.549
  233    HA   LYS  31           HA       LYS  31  82.745  11.031   5.395
  234    HB2  LYS  31           HB2      LYS  31  80.792   9.480   4.329
  235    HB3  LYS  31           HB1      LYS  31  81.936   8.226   4.798
  236    HG2  LYS  31           HG2      LYS  31  80.707   8.466   6.764
  237    HG3  LYS  31           HG1      LYS  31  82.041   9.582   7.059
  238    HD2  LYS  31           HD2      LYS  31  80.549  11.387   6.001
  239    HD3  LYS  31           HD1      LYS  31  79.226  10.235   6.179
  240    HE2  LYS  31           HE2      LYS  31  80.883  11.538   8.334
  241    HE3  LYS  31           HE1      LYS  31  79.128  11.493   8.172
  242    HZ1  LYS  31           HZ1      LYS  31  80.949   9.482   9.225
  243    HZ2  LYS  31           HZ2      LYS  31  79.642   8.906   8.305
  244    HZ3  LYS  31           HZ3      LYS  31  79.359   9.855   9.685
  245    H    GLN  32           HN       GLN  32  83.351   8.226   6.209
  246    HA   GLN  32           HA       GLN  32  86.258   8.406   5.885
  247    HB2  GLN  32           HB2      GLN  32  86.384   6.692   7.540
  248    HB3  GLN  32           HB1      GLN  32  85.040   7.721   8.028
  249    HG2  GLN  32           HG2      GLN  32  84.910   5.024   6.661
  250    HG3  GLN  32           HG1      GLN  32  84.233   5.480   8.226
  251   HE21  GLN  32          HE21      GLN  32  82.164   6.499   8.251
  252   HE22  GLN  32          HE22      GLN  32  81.259   6.799   6.847
  253    H    ARG  33           HN       ARG  33  84.440   7.710   3.558
  254    HA   ARG  33           HA       ARG  33  84.479   5.065   2.751
  255    HE   ARG  33           HE       ARG  33  86.633   6.870  -0.733
  256    HB2  ARG  33           HB2      ARG  33  84.971   5.994   0.406
  257    HB3  ARG  33           HB1      ARG  33  83.565   6.658   1.239
  258    HG2  ARG  33           HG2      ARG  33  84.659   8.675   1.748
  259    HG3  ARG  33           HG1      ARG  33  86.260   7.974   1.512
  260    HD2  ARG  33           HD2      ARG  33  84.268   8.240  -0.747
  261    HD3  ARG  33           HD1      ARG  33  85.423   9.513  -0.354
  262   HH11  ARG  33          HH21      ARG  33  85.595   9.854  -2.113
  263   HH12  ARG  33          HH22      ARG  33  86.665   9.751  -3.471
  264   HH21  ARG  33          HH11      ARG  33  88.037   6.719  -2.498
  265   HH22  ARG  33          HH12      ARG  33  88.048   7.977  -3.689
  266    H    GLN  34           HN       GLN  34  86.021   3.691   1.724
  267    HA   GLN  34           HA       GLN  34  88.819   4.272   2.503
  268    HB2  GLN  34           HB2      GLN  34  87.590   1.762   1.322
  269    HB3  GLN  34           HB1      GLN  34  89.224   1.909   1.971
  270    HG2  GLN  34           HG2      GLN  34  88.315   2.452   4.188
  271    HG3  GLN  34           HG1      GLN  34  86.673   2.355   3.551
  272   HE21  GLN  34          HE21      GLN  34  89.192   0.514   4.973
  273   HE22  GLN  34          HE22      GLN  34  88.546  -1.027   4.678
  274    H    THR  35           HN       THR  35  88.618   2.132  -0.107
  275    HA   THR  35           HA       THR  35  90.105   3.953  -1.824
  276    HB   THR  35           HB       THR  35  90.102   2.060  -3.419
  277    HG1  THR  35           HG1      THR  35  88.826   0.366  -3.113
  278   HG21  THR  35          HG21      THR  35  90.581   1.170  -0.561
  279   HG22  THR  35          HG22      THR  35  91.716   2.114  -1.527
  280   HG23  THR  35          HG23      THR  35  91.304   0.468  -2.008
  281    H    ARG  36           HN       ARG  36  87.462   1.964  -3.061
  282    HA   ARG  36           HA       ARG  36  86.025   4.439  -3.920
  283    HE   ARG  36           HE       ARG  36  85.475   5.384  -5.382
  284    HB2  ARG  36           HB2      ARG  36  86.864   2.097  -5.646
  285    HB3  ARG  36           HB1      ARG  36  85.624   3.249  -6.135
  286    HG2  ARG  36           HG2      ARG  36  88.057   4.557  -5.157
  287    HG3  ARG  36           HG1      ARG  36  88.349   3.543  -6.570
  288    HD2  ARG  36           HD2      ARG  36  87.656   5.982  -7.016
  289    HD3  ARG  36           HD1      ARG  36  86.770   4.729  -7.886
  290   HH11  ARG  36          HH21      ARG  36  86.037   6.381  -8.634
  291   HH12  ARG  36          HH22      ARG  36  84.557   7.272  -8.757
  292   HH21  ARG  36          HH11      ARG  36  83.539   6.542  -5.524
  293   HH22  ARG  36          HH12      ARG  36  83.143   7.364  -6.996
  294    H    GLN  37           HN       GLN  37  85.961   0.981  -3.254
  295    HA   GLN  37           HA       GLN  37  83.294   1.121  -2.173
  296    HB2  GLN  37           HB2      GLN  37  82.933   1.204  -4.725
  297    HB3  GLN  37           HB1      GLN  37  83.479  -0.473  -4.734
  298    HG2  GLN  37           HG2      GLN  37  81.716  -0.882  -2.907
  299    HG3  GLN  37           HG1      GLN  37  81.057   0.691  -3.355
  300   HE21  GLN  37          HE21      GLN  37  80.459   0.943  -5.740
  301   HE22  GLN  37          HE22      GLN  37  79.919  -0.430  -6.578
  302    H1U  RCY  38           H1U      RCY  38  83.845   1.958  -3.294
  303    H1S  RCY  38           H1S      RCY  38  82.884  -0.050   1.033
  304    HB1  RCY  38           HB1      RCY  38  84.933  -3.547   0.452
  305    HB2  RCY  38           HB2      RCY  38  83.724  -2.561  -0.370
  306    HA   RCY  38           HA       RCY  38  86.639  -1.765  -0.174
  307    HN1  RCY  38           HN1      RCY  38  85.640   0.151  -1.104
  308    H    LYS  39           HN       LYS  39  86.049  -1.590  -3.261
  309    HA   LYS  39           HA       LYS  39  86.055  -4.444  -3.983
  310    HB2  LYS  39           HB2      LYS  39  86.003  -3.688  -6.265
  311    HB3  LYS  39           HB1      LYS  39  84.911  -2.642  -5.358
  312    HG2  LYS  39           HG2      LYS  39  86.918  -1.064  -5.073
  313    HG3  LYS  39           HG1      LYS  39  87.706  -2.024  -6.326
  314    HD2  LYS  39           HD2      LYS  39  85.503  -1.632  -7.671
  315    HD3  LYS  39           HD1      LYS  39  85.244  -0.305  -6.538
  316    HE2  LYS  39           HE2      LYS  39  87.401  -0.645  -8.595
  317    HE3  LYS  39           HE1      LYS  39  86.430   0.779  -8.221
  318    HZ1  LYS  39           HZ1      LYS  39  88.183   1.451  -7.054
  319    HZ2  LYS  39           HZ2      LYS  39  88.920  -0.080  -7.094
  320    HZ3  LYS  39           HZ3      LYS  39  87.758   0.276  -5.906
  321    H    SER  40           HN       SER  40  87.877  -5.620  -4.368
  322    HA   SER  40           HA       SER  40  90.309  -4.702  -5.444
  323    HG   SER  40           HG       SER  40  92.086  -4.881  -2.121
  324    HB2  SER  40           HB2      SER  40  90.917  -3.353  -3.658
  325    HB3  SER  40           HB1      SER  40  90.030  -4.326  -2.488
  326    H    LYS  41           HN       LYS  41  90.472  -6.503  -2.440
  327    HA   LYS  41           HA       LYS  41  91.246  -8.908  -3.974
  328    HB2  LYS  41           HB2      LYS  41  91.552  -7.946  -1.165
  329    HB3  LYS  41           HB1      LYS  41  91.467  -9.691  -1.395
  330    HG2  LYS  41           HG2      LYS  41  93.800  -8.979  -1.506
  331    HG3  LYS  41           HG1      LYS  41  93.280  -9.518  -3.103
  332    HD2  LYS  41           HD2      LYS  41  92.825  -7.149  -3.723
  333    HD3  LYS  41           HD1      LYS  41  93.445  -6.643  -2.151
  334    HE2  LYS  41           HE2      LYS  41  95.037  -8.249  -4.169
  335    HE3  LYS  41           HE1      LYS  41  95.155  -6.499  -3.978
  336    HZ1  LYS  41           HZ1      LYS  41  96.765  -7.073  -2.535
  337    HZ2  LYS  41           HZ2      LYS  41  96.135  -8.626  -2.259
  338    HZ3  LYS  41           HZ3      LYS  41  95.467  -7.282  -1.464
  339    HA   PRO  42           HA       PRO  42  87.395 -11.007  -3.625
  340    HB2  PRO  42           HB2      PRO  42  88.234 -13.557  -2.882
  341    HB3  PRO  42           HB1      PRO  42  88.248 -12.927  -4.540
  342    HG2  PRO  42           HG2      PRO  42  90.473 -13.153  -2.586
  343    HG3  PRO  42           HG1      PRO  42  90.479 -13.382  -4.343
  344    HD2  PRO  42           HD2      PRO  42  91.450 -11.124  -3.182
  345    HD3  PRO  42           HD1      PRO  42  90.666 -11.104  -4.778
  346    HA   PRO  43           HA       PRO  43  85.592 -11.075   0.397
  347    HB2  PRO  43           HB2      PRO  43  85.119 -14.012  -0.003
  348    HB3  PRO  43           HB1      PRO  43  83.994 -12.757   0.551
  349    HG2  PRO  43           HG2      PRO  43  83.953 -13.697  -1.954
  350    HG3  PRO  43           HG1      PRO  43  83.566 -12.012  -1.570
  351    HD2  PRO  43           HD2      PRO  43  85.941 -13.107  -2.948
  352    HD3  PRO  43           HD1      PRO  43  85.292 -11.454  -2.965
  353    H    LYS  44           HN       LYS  44  86.414 -11.320   2.462
  354    HA   LYS  44           HA       LYS  44  88.777 -13.107   2.775
  355    HB2  LYS  44           HB2      LYS  44  88.981 -11.743   4.974
  356    HB3  LYS  44           HB1      LYS  44  89.334 -10.916   3.457
  357    HG2  LYS  44           HG2      LYS  44  87.316  -9.732   3.476
  358    HG3  LYS  44           HG1      LYS  44  86.533 -10.893   4.549
  359    HD2  LYS  44           HD2      LYS  44  87.722 -10.101   6.448
  360    HD3  LYS  44           HD1      LYS  44  88.880  -9.219   5.453
  361    HE2  LYS  44           HE2      LYS  44  87.327  -7.537   4.914
  362    HE3  LYS  44           HE1      LYS  44  85.946  -8.546   5.344
  363    HZ1  LYS  44           HZ1      LYS  44  86.008  -7.539   7.307
  364    HZ2  LYS  44           HZ2      LYS  44  87.520  -6.830   6.994
  365    HZ3  LYS  44           HZ3      LYS  44  87.432  -8.402   7.632
  366    H    LYS  45           HN       LYS  45  87.286 -12.158   5.684
  367    HA   LYS  45           HA       LYS  45  85.468 -14.424   5.929
  368    HB2  LYS  45           HB2      LYS  45  86.751 -15.584   7.697
  369    HB3  LYS  45           HB1      LYS  45  87.633 -15.581   6.169
  370    HG2  LYS  45           HG2      LYS  45  88.792 -13.459   7.013
  371    HG3  LYS  45           HG1      LYS  45  88.115 -13.845   8.595
  372    HD2  LYS  45           HD2      LYS  45  89.183 -16.112   8.429
  373    HD3  LYS  45           HD1      LYS  45  89.973 -15.581   6.944
  374    HE2  LYS  45           HE2      LYS  45  90.273 -14.277   9.667
  375    HE3  LYS  45           HE1      LYS  45  91.476 -15.298   8.877
  376    HZ1  LYS  45           HZ1      LYS  45  91.154 -12.570   8.593
  377    HZ2  LYS  45           HZ2      LYS  45  90.617 -13.245   7.129
  378    HZ3  LYS  45           HZ3      LYS  45  92.183 -13.580   7.698
  379    H    GLY  46           HN       GLY  46  85.242 -11.598   6.315
  380    HA2  GLY  46           HA2      GLY  46  85.358 -11.073   9.195
  381    HA3  GLY  46           HA1      GLY  46  84.718  -9.980   7.967
  382    H    VAL  47           HN       VAL  47  82.693  -9.541   8.808
  383    HA   VAL  47           HA       VAL  47  81.023 -11.547  10.046
  384    HB   VAL  47           HB       VAL  47  79.220  -9.782   9.739
  385   HG11  VAL  47          HG11      VAL  47  80.574  -9.877  11.776
  386   HG12  VAL  47          HG12      VAL  47  80.309  -8.194  11.319
  387   HG13  VAL  47          HG13      VAL  47  81.861  -8.964  10.988
  388   HG21  VAL  47          HG21      VAL  47  79.817  -7.653   8.821
  389   HG22  VAL  47          HG22      VAL  47  80.368  -8.852   7.651
  390   HG23  VAL  47          HG23      VAL  47  81.524  -8.089   8.744
  391    H    GLN  48           HN       GLN  48  81.746 -10.799   6.787
  392    HA   GLN  48           HA       GLN  48  79.975 -12.883   5.825
  393    HB2  GLN  48           HB2      GLN  48  78.300 -11.115   6.051
  394    HB3  GLN  48           HB1      GLN  48  79.317 -10.003   5.133
  395    HG2  GLN  48           HG2      GLN  48  79.090 -11.305   3.133
  396    HG3  GLN  48           HG1      GLN  48  78.346 -12.641   4.013
  397   HE21  GLN  48          HE21      GLN  48  77.650  -9.829   2.204
  398   HE22  GLN  48          HE22      GLN  48  76.013  -9.676   2.625
  399    H    GLY  49           HN       GLY  49  81.177  -9.848   4.353
  400    HA2  GLY  49           HA2      GLY  49  83.543 -10.794   3.214
  401    HA3  GLY  49           HA1      GLY  49  82.275 -11.264   2.081
  402    H1U  RCY  50           H1U      RCY  50  81.601  -2.195  -3.040
  403    H1S  RCY  50           H1S      RCY  50  80.779  -6.277  -2.782
  404    HB1  RCY  50           HB1      RCY  50  81.383  -6.003   0.398
  405    HB2  RCY  50           HB2      RCY  50  80.840  -7.411   1.311
  406    HA   RCY  50           HA       RCY  50  83.110  -7.716  -0.630
  407    HN1  RCY  50           HN1      RCY  50  82.959  -9.793   0.456
  408    H    GLY  51           HN       GLY  51  84.361  -8.225   2.302
  409    HA2  GLY  51           HA2      GLY  51  85.036  -5.388   2.882
  410    HA3  GLY  51           HA1      GLY  51  85.341  -6.751   3.959
  411    H    ASP  52           HN       ASP  52  87.020  -4.578   2.347
  412    HA   ASP  52           HA       ASP  52  88.935  -6.385   1.001
  413    HB2  ASP  52           HB2      ASP  52  90.155  -4.138   0.627
  414    HB3  ASP  52           HB1      ASP  52  88.610  -4.365  -0.194
  415    H    ASP  53           HN       ASP  53  89.662  -3.607   3.103
  416    HA   ASP  53           HA       ASP  53  91.649  -5.328   4.519
  417    HB2  ASP  53           HB2      ASP  53  91.410  -2.323   4.215
  418    HB3  ASP  53           HB1      ASP  53  92.589  -3.104   5.269
  419    H    ILE  54           HN       ILE  54  90.371  -2.324   5.803
  420    HA   ILE  54           HA       ILE  54  88.838  -3.840   7.863
  421    HB   ILE  54           HB       ILE  54  91.113  -3.312   8.743
  422   HG12  ILE  54          HG12      ILE  54  88.816  -1.756   9.975
  423   HG13  ILE  54          HG11      ILE  54  89.211  -3.447  10.289
  424   HG21  ILE  54          HG21      ILE  54  91.022  -1.067   7.307
  425   HG22  ILE  54          HG22      ILE  54  91.973  -1.165   8.789
  426   HG23  ILE  54          HG23      ILE  54  90.378  -0.414   8.814
  427   HD11  ILE  54          HD11      ILE  54  90.810  -0.992  11.030
  428   HD12  ILE  54          HD12      ILE  54  91.523  -2.605  11.020
  429   HD13  ILE  54          HD13      ILE  54  90.177  -2.243  12.100
  430    HA   PRO  55           HA       PRO  55  86.246  -0.361   6.507
  431    HB2  PRO  55           HB2      PRO  55  83.847  -1.485   7.043
  432    HB3  PRO  55           HB1      PRO  55  84.815  -1.970   5.638
  433    HG2  PRO  55           HG2      PRO  55  84.466  -3.347   8.249
  434    HG3  PRO  55           HG1      PRO  55  84.596  -4.028   6.620
  435    HD2  PRO  55           HD2      PRO  55  86.687  -3.905   8.462
  436    HD3  PRO  55           HD1      PRO  55  86.889  -4.098   6.707
  437    H    GLY  56           HN       GLY  56  84.035  -1.600   8.844
  438    HA2  GLY  56           HA2      GLY  56  84.582   0.753  10.580
  439    HA3  GLY  56           HA1      GLY  56  83.079  -0.170  10.557
  440    H    MET  57           HN       MET  57  85.929  -2.077  10.508
  441    HA   MET  57           HA       MET  57  86.733  -3.615  12.095
  442    HB2  MET  57           HB2      MET  57  87.531  -1.274  12.911
  443    HB3  MET  57           HB1      MET  57  86.284  -1.447  14.146
  444    HG2  MET  57           HG2      MET  57  87.344  -3.782  14.576
  445    HG3  MET  57           HG1      MET  57  88.734  -3.144  13.698
  446    HE1  MET  57           HE1      MET  57  87.549  -3.847  17.052
  447    HE2  MET  57           HE2      MET  57  88.992  -3.165  17.800
  448    HE3  MET  57           HE3      MET  57  89.147  -4.205  16.386
  449    H    GLU  58           HN       GLU  58  83.794  -3.484  11.655
  450    HA   GLU  58           HA       GLU  58  83.009  -5.174  13.876
  451    HB2  GLU  58           HB2      GLU  58  81.296  -3.788  14.848
  452    HB3  GLU  58           HB1      GLU  58  82.783  -2.841  14.838
  453    HG2  GLU  58           HG2      GLU  58  81.275  -1.302  13.952
  454    HG3  GLU  58           HG1      GLU  58  81.903  -2.043  12.480
  455    H    GLY  59           HN       GLY  59  82.132  -3.316  11.013
  456    HA2  GLY  59           HA2      GLY  59  80.919  -5.445   9.648
  457    HA3  GLY  59           HA1      GLY  59  79.618  -4.644  10.532
  458    H1U  RCY  60           H1U      RCY  60  75.484   1.875   4.615
  459    H1S  RCY  60           H1S      RCY  60  75.582  -0.363   8.032
  460    HB1  RCY  60           HB1      RCY  60  78.987  -2.169   6.931
  461    HB2  RCY  60           HB2      RCY  60  78.750  -0.421   6.927
  462    HA   RCY  60           HA       RCY  60  81.017  -1.150   7.759
  463    HN1  RCY  60           HN1      RCY  60  80.062  -2.032  10.348
  464    H    GLY  61           HN       GLY  61  79.345   1.139   7.530
  465    HA2  GLY  61           HA2      GLY  61  80.505   2.813   9.575
  466    HA3  GLY  61           HA1      GLY  61  79.342   3.336   8.355
  467    H    THR  62           HN       THR  62  78.154   4.528   9.953
  468    HA   THR  62           HA       THR  62  75.937   3.202  11.086
  469    HB   THR  62           HB       THR  62  77.062   2.132  12.799
  470    HG1  THR  62           HG1      THR  62  77.287   4.397  14.286
  471   HG21  THR  62          HG21      THR  62  79.305   2.515  12.490
  472   HG22  THR  62          HG22      THR  62  79.066   3.535  13.910
  473   HG23  THR  62          HG23      THR  62  79.089   4.255  12.300
  474    H    ASP  63           HN       ASP  63  78.129   5.912  11.038
  475    HA   ASP  63           HA       ASP  63  76.795   7.815  12.600
  476    HB2  ASP  63           HB2      ASP  63  78.224   8.087   9.947
  477    HB3  ASP  63           HB1      ASP  63  77.592   9.483  10.820
  478    H    ILE  64           HN       ILE  64  75.879   6.452   9.502
  479    HA   ILE  64           HA       ILE  64  73.795   8.391   8.931
  480    HB   ILE  64           HB       ILE  64  74.009   5.543   7.927
  481   HG12  ILE  64          HG12      ILE  64  76.133   6.568   7.479
  482   HG13  ILE  64          HG11      ILE  64  75.209   6.668   5.980
  483   HG21  ILE  64          HG21      ILE  64  71.882   6.672   7.444
  484   HG22  ILE  64          HG22      ILE  64  72.828   6.503   5.965
  485   HG23  ILE  64          HG23      ILE  64  72.752   8.060   6.790
  486   HD11  ILE  64          HD11      ILE  64  75.814   8.854   7.965
  487   HD12  ILE  64          HD12      ILE  64  74.443   8.988   6.863
  488   HD13  ILE  64          HD13      ILE  64  76.080   8.844   6.222
  489    H    THR  65           HN       THR  65  73.257   4.915   9.390
  490    HA   THR  65           HA       THR  65  71.819   3.799  10.897
  491    HB   THR  65           HB       THR  65  70.763   6.406  11.951
  492    HG1  THR  65           HG1      THR  65  72.749   6.932  12.373
  493   HG21  THR  65          HG21      THR  65  69.916   4.140  12.681
  494   HG22  THR  65          HG22      THR  65  70.549   5.138  13.990
  495   HG23  THR  65          HG23      THR  65  71.523   3.822  13.335
  496    H    VAL  66           HN       VAL  66  70.818   6.481   8.894
  497    HA   VAL  66           HA       VAL  66  68.281   5.012   8.365
  498    HB   VAL  66           HB       VAL  66  67.332   7.518   8.184
  499   HG11  VAL  66          HG11      VAL  66  66.371   5.708   9.544
  500   HG12  VAL  66          HG12      VAL  66  66.433   7.206  10.473
  501   HG13  VAL  66          HG13      VAL  66  67.628   5.941  10.759
  502   HG21  VAL  66          HG21      VAL  66  69.673   8.313   8.952
  503   HG22  VAL  66          HG22      VAL  66  69.204   7.721  10.546
  504   HG23  VAL  66          HG23      VAL  66  68.274   9.005   9.772
  505    H    ILE  67           HN       ILE  67  69.481   8.191   7.239
  506    HA   ILE  67           HA       ILE  67  69.432   7.043   4.467
  507    HB   ILE  67           HB       ILE  67  68.797   9.849   5.416
  508   HG12  ILE  67          HG12      ILE  67  67.056   7.844   3.956
  509   HG13  ILE  67          HG11      ILE  67  67.069   8.003   5.713
  510   HG21  ILE  67          HG21      ILE  67  69.902  10.085   3.314
  511   HG22  ILE  67          HG22      ILE  67  68.177  10.126   2.946
  512   HG23  ILE  67          HG23      ILE  67  69.107   8.656   2.654
  513   HD11  ILE  67          HD11      ILE  67  65.251   9.349   4.760
  514   HD12  ILE  67          HD12      ILE  67  66.404  10.203   3.734
  515   HD13  ILE  67          HD13      ILE  67  66.469  10.399   5.485
  516    H1U  RCY  68           H1U      RCY  68  77.789   1.742   0.838
  517    H1S  RCY  68           H1S      RCY  68  75.382   5.813   0.259
  518    HB1  RCY  68           HB1      RCY  68  73.741   5.885   4.091
  519    HB2  RCY  68           HB2      RCY  68  75.109   6.905   3.654
  520    HA   RCY  68           HA       RCY  68  73.690   8.403   4.787
  521    HN1  RCY  68           HN1      RCY  68  71.489   6.746   3.808
  522    HA   PRO  69           HA       PRO  69  73.499  11.508   1.647
  523    HB2  PRO  69           HB2      PRO  69  76.189  12.056   1.309
  524    HB3  PRO  69           HB1      PRO  69  75.213  12.659   2.661
  525    HG2  PRO  69           HG2      PRO  69  77.108  10.372   2.572
  526    HG3  PRO  69           HG1      PRO  69  76.799  11.537   3.870
  527    HD2  PRO  69           HD2      PRO  69  75.802   8.992   3.906
  528    HD3  PRO  69           HD1      PRO  69  74.969  10.362   4.674
  529    H    TRP  70           HN       TRP  70  75.080   8.519   1.145
  530    HA   TRP  70           HA       TRP  70  75.848   9.017  -1.634
  531    HD1  TRP  70           HD1      TRP  70  75.978   6.741  -3.561
  532    HE1  TRP  70           HE1      TRP  70  78.266   6.596  -4.737
  533    HE3  TRP  70           HE3      TRP  70  79.074   7.224   0.471
  534    HZ2  TRP  70           HZ2      TRP  70  81.047   6.675  -4.058
  535    HZ3  TRP  70           HZ3      TRP  70  81.532   7.187   0.180
  536    HH2  TRP  70           HH2      TRP  70  82.523   6.913  -2.075
  537    HB2  TRP  70           HB2      TRP  70  76.611   7.163   0.244
  538    HB3  TRP  70           HB1      TRP  70  75.505   6.210  -0.743
  539    H    GLU  71           HN       GLU  71  73.009   8.010   0.079
  540    HA   GLU  71           HA       GLU  71  71.604   6.427  -1.717
  541    HB2  GLU  71           HB2      GLU  71  70.804   8.588   0.191
  542    HB3  GLU  71           HB1      GLU  71  69.587   8.033  -0.960
  543    HG2  GLU  71           HG2      GLU  71  71.199   6.044   0.628
  544    HG3  GLU  71           HG1      GLU  71  69.776   6.810   1.337
  545    H    ALA  72           HN       ALA  72  71.839   9.996  -1.811
  546    HA   ALA  72           HA       ALA  72  70.340  10.298  -4.235
  547    HB1  ALA  72           HB1      ALA  72  71.200  12.546  -4.289
  548    HB2  ALA  72           HB2      ALA  72  72.576  12.104  -3.278
  549    HB3  ALA  72           HB3      ALA  72  70.952  12.138  -2.591
  550    H1U  RCY  73           H1U      RCY  73  71.079   1.726  -3.322
  551    H1S  RCY  73           H1S      RCY  73  70.256   4.580  -6.979
  552    HB1  RCY  73           HB1      RCY  73  73.346   6.441  -5.948
  553    HB2  RCY  73           HB2      RCY  73  73.629   6.693  -7.669
  554    HA   RCY  73           HA       RCY  73  74.170   8.698  -6.254
  555    HN1  RCY  73           HN1      RCY  73  71.451   8.331  -5.283
  556    H    ASN  74           HN       ASN  74  74.074  10.734  -7.358
  557    HA   ASN  74           HA       ASN  74  72.198  11.120  -9.566
  558    HB2  ASN  74           HB2      ASN  74  74.715  12.680  -8.903
  559    HB3  ASN  74           HB1      ASN  74  73.388  13.212  -9.936
  560   HD21  ASN  74          HD21      ASN  74  71.337  11.992  -8.084
  561   HD22  ASN  74          HD22      ASN  74  71.260  13.042  -6.753
  562    H    HIS  75           HN       HIS  75  74.708   9.092  -9.246
  563    HA   HIS  75           HA       HIS  75  75.026   8.681 -12.077
  564    HD1  HIS  75           HD1      HIS  75  78.443   7.507 -11.113
  565    HD2  HIS  75           HD2      HIS  75  77.734  10.034 -14.355
  566    HE1  HIS  75           HE1      HIS  75  79.895   6.663 -13.009
  567    HE2  HIS  75           HE2      HIS  75  79.472   8.193 -14.989
  568    HB2  HIS  75           HB2      HIS  75  76.445  10.648 -11.992
  569    HB3  HIS  75           HB1      HIS  75  77.308  10.015 -10.590
  570    H1U  RCY  76           H1U      RCY  76  70.731   0.533  -8.649
  571    H1S  RCY  76           H1S      RCY  76  75.174   1.790  -7.661
  572    HB1  RCY  76           HB1      RCY  76  74.534   4.175 -10.875
  573    HB2  RCY  76           HB2      RCY  76  74.978   5.074  -9.424
  574    HA   RCY  76           HA       RCY  76  77.321   5.241 -10.337
  575    HN1  RCY  76           HN1      RCY  76  75.567   6.554 -12.314
  576    H    GLU  77           HN       GLU  77  77.575   5.853 -13.150
  577    HA   GLU  77           HA       GLU  77  76.981   3.496 -14.724
  578    HB2  GLU  77           HB2      GLU  77  78.600   5.992 -15.114
  579    HB3  GLU  77           HB1      GLU  77  78.863   4.638 -16.213
  580    HG2  GLU  77           HG2      GLU  77  76.424   4.581 -16.692
  581    HG3  GLU  77           HG1      GLU  77  76.204   5.985 -15.647
  582    H    LEU  78           HN       LEU  78  80.060   4.789 -13.404
  583    HA   LEU  78           HA       LEU  78  82.114   3.684 -13.071
  584    HG   LEU  78           HG       LEU  78  82.383   3.258 -10.804
  585    HB2  LEU  78           HB2      LEU  78  79.981   1.853 -12.016
  586    HB3  LEU  78           HB1      LEU  78  81.641   1.260 -12.079
  587   HD11  LEU  78          HD11      LEU  78  79.406   3.835 -10.716
  588   HD12  LEU  78          HD12      LEU  78  80.644   4.825 -11.489
  589   HD13  LEU  78          HD13      LEU  78  80.614   4.663  -9.733
  590   HD21  LEU  78          HD21      LEU  78  80.084   1.888  -9.385
  591   HD22  LEU  78          HD22      LEU  78  81.570   2.514  -8.671
  592   HD23  LEU  78          HD23      LEU  78  81.622   1.086  -9.705
  593    H    HIS  79           HN       HIS  79  80.929   0.518 -13.552
  594    HA   HIS  79           HA       HIS  79  80.771  -0.088 -16.183
  595    HD1  HIS  79           HD1      HIS  79  81.805  -1.081 -18.431
  596    HD2  HIS  79           HD2      HIS  79  85.355  -1.373 -16.261
  597    HE1  HIS  79           HE1      HIS  79  83.107  -3.001 -19.446
  598    HE2  HIS  79           HE2      HIS  79  85.271  -3.190 -18.134
  599    HB2  HIS  79           HB2      HIS  79  82.643   1.161 -16.927
  600    HB3  HIS  79           HB1      HIS  79  83.633   0.660 -15.556
  601    H    GLU  80           HN       GLU  80  81.677  -0.817 -13.064
  602    HA   GLU  80           HA       GLU  80  82.683  -3.527 -13.591
  603    HB2  GLU  80           HB2      GLU  80  81.777  -2.459 -10.917
  604    HB3  GLU  80           HB1      GLU  80  82.984  -3.701 -11.250
  605    HG2  GLU  80           HG2      GLU  80  84.386  -1.947 -12.374
  606    HG3  GLU  80           HG1      GLU  80  83.221  -0.737 -11.837
  607    H    LEU  81           HN       LEU  81  80.849  -4.002 -10.967
  608    HA   LEU  81           HA       LEU  81  78.798  -5.423 -12.521
  609    HG   LEU  81           HG       LEU  81  79.627  -5.772  -8.363
  610    HB2  LEU  81           HB2      LEU  81  78.021  -6.065 -10.112
  611    HB3  LEU  81           HB1      LEU  81  79.518  -6.748 -10.734
  612   HD11  LEU  81          HD11      LEU  81  81.451  -5.583 -10.588
  613   HD12  LEU  81          HD12      LEU  81  81.816  -5.844  -8.882
  614   HD13  LEU  81          HD13      LEU  81  81.686  -4.203  -9.515
  615   HD21  LEU  81          HD21      LEU  81  79.681  -3.152  -9.883
  616   HD22  LEU  81          HD22      LEU  81  79.726  -3.381  -8.135
  617   HD23  LEU  81          HD23      LEU  81  78.252  -3.739  -9.033
  618    H    ALA  82           HN       ALA  82  78.857  -2.408 -12.322
  619    HA   ALA  82           HA       ALA  82  76.659  -1.567 -10.670
  620    HB1  ALA  82           HB1      ALA  82  77.638  -0.295 -13.243
  621    HB2  ALA  82           HB2      ALA  82  78.378  -0.031 -11.664
  622    HB3  ALA  82           HB3      ALA  82  76.721   0.493 -11.959
  623    H    GLN  83           HN       GLN  83  76.336  -3.916 -12.680
  624    HA   GLN  83           HA       GLN  83  74.613  -4.765 -14.021
  625    HB2  GLN  83           HB2      GLN  83  73.392  -2.998 -12.047
  626    HB3  GLN  83           HB1      GLN  83  72.447  -3.035 -13.533
  627    HG2  GLN  83           HG2      GLN  83  73.427  -5.528 -12.116
  628    HG3  GLN  83           HG1      GLN  83  71.828  -4.827 -11.860
  629   HE21  GLN  83          HE21      GLN  83  71.124  -7.030 -12.802
  630   HE22  GLN  83          HE22      GLN  83  71.027  -7.161 -14.492
  631    H    TYR  84           HN       TYR  84  73.446  -1.414 -14.105
  632    HA   TYR  84           HA       TYR  84  74.531  -1.096 -16.850
  633    HD1  TYR  84           HD2      TYR  84  73.736  -1.445 -19.182
  634    HD2  TYR  84           HD1      TYR  84  71.169  -3.461 -16.390
  635    HE1  TYR  84           HE2      TYR  84  73.842  -3.499 -20.569
  636    HE2  TYR  84           HE1      TYR  84  71.274  -5.515 -17.777
  637    HH   TYR  84           HH       TYR  84  72.282  -6.511 -19.510
  638    HB2  TYR  84           HB2      TYR  84  71.611  -1.180 -16.104
  639    HB3  TYR  84           HB1      TYR  84  72.154  -0.223 -17.483
  640    H    GLY  85           HN       GLY  85  73.095   0.262 -13.947
  641    HA2  GLY  85           HA2      GLY  85  74.550   2.514 -13.639
  642    HA3  GLY  85           HA1      GLY  85  73.458   3.023 -14.927
  643    H    ILE  86           HN       ILE  86  72.583   0.820 -12.298
  644    HA   ILE  86           HA       ILE  86  71.122   2.974 -10.914
  645    HB   ILE  86           HB       ILE  86  68.951   1.823 -11.031
  646   HG12  ILE  86          HG12      ILE  86  69.836  -0.475 -11.293
  647   HG13  ILE  86          HG11      ILE  86  68.662  -0.098 -12.554
  648   HG21  ILE  86          HG21      ILE  86  69.644   3.508 -12.781
  649   HG22  ILE  86          HG22      ILE  86  68.417   2.363 -13.323
  650   HG23  ILE  86          HG23      ILE  86  70.097   2.154 -13.816
  651   HD11  ILE  86          HD11      ILE  86  70.843   0.722 -13.844
  652   HD12  ILE  86          HD12      ILE  86  70.358  -0.973 -13.859
  653   HD13  ILE  86          HD13      ILE  86  71.626  -0.429 -12.762
  654    H1U  RCY  87           H1U      RCY  87  73.674  -3.187  -3.579
  655    H1S  RCY  87           H1S      RCY  87  70.463  -2.369  -6.564
  656    HB1  RCY  87           HB1      RCY  87  72.624  -3.106  -9.009
  657    HB2  RCY  87           HB2      RCY  87  71.750  -2.601 -10.454
  658    HA   RCY  87           HA       RCY  87  71.278  -0.815  -8.181
  659    HN1  RCY  87           HN1      RCY  87  71.751  -0.547 -11.060
  Start of MODEL   20
    1    HA   MET   1           HA       MET   1  76.320 -20.272   5.259
    2    HB2  MET   1           HB2      MET   1  73.395 -20.977   5.605
    3    HB3  MET   1           HB1      MET   1  74.795 -21.845   6.238
    4    HG2  MET   1           HG2      MET   1  73.981 -20.608   8.091
    5    HG3  MET   1           HG1      MET   1  75.351 -19.667   7.500
    6    HE1  MET   1           HE1      MET   1  71.589 -19.319   8.558
    7    HE2  MET   1           HE2      MET   1  71.754 -20.446   7.213
    8    HE3  MET   1           HE3      MET   1  70.891 -18.927   6.981
    9    H    ASN   2           HN       ASN   2  74.650 -22.615   4.465
   10    HA   ASN   2           HA       ASN   2  75.484 -22.845   1.755
   11    HB2  ASN   2           HB2      ASN   2  73.379 -24.644   1.983
   12    HB3  ASN   2           HB1      ASN   2  75.051 -24.973   2.430
   13   HD21  ASN   2          HD21      ASN   2  72.474 -22.986   4.003
   14   HD22  ASN   2          HD22      ASN   2  72.605 -23.752   5.512
   15    H    LEU   3           HN       LEU   3  73.292 -23.746   0.294
   16    HA   LEU   3           HA       LEU   3  72.275 -21.494  -0.953
   17    HG   LEU   3           HG       LEU   3  73.112 -23.516  -2.121
   18    HB2  LEU   3           HB2      LEU   3  71.094 -24.242  -0.563
   19    HB3  LEU   3           HB1      LEU   3  70.225 -23.012  -1.480
   20   HD11  LEU   3          HD11      LEU   3  72.311 -25.762  -2.163
   21   HD12  LEU   3          HD12      LEU   3  72.240 -25.209  -3.836
   22   HD13  LEU   3          HD13      LEU   3  70.769 -25.276  -2.867
   23   HD21  LEU   3          HD21      LEU   3  71.917 -21.661  -3.199
   24   HD22  LEU   3          HD22      LEU   3  70.654 -22.767  -3.738
   25   HD23  LEU   3          HD23      LEU   3  72.287 -22.909  -4.388
   26    H    GLU   4           HN       GLU   4  71.003 -19.850  -0.272
   27    HA   GLU   4           HA       GLU   4  69.362 -20.238   2.183
   28    HB2  GLU   4           HB2      GLU   4  69.151 -17.637   1.865
   29    HB3  GLU   4           HB1      GLU   4  70.664 -18.309   2.472
   30    HG2  GLU   4           HG2      GLU   4  70.213 -17.906  -0.483
   31    HG3  GLU   4           HG1      GLU   4  70.811 -16.597   0.537
   32    HA   PRO   5           HA       PRO   5  65.401 -20.444   0.260
   33    HB2  PRO   5           HB2      PRO   5  64.865 -17.798   1.577
   34    HB3  PRO   5           HB1      PRO   5  63.854 -19.256   1.532
   35    HG2  PRO   5           HG2      PRO   5  65.337 -18.600   3.672
   36    HG3  PRO   5           HG1      PRO   5  65.016 -20.279   3.212
   37    HD2  PRO   5           HD2      PRO   5  67.549 -18.779   3.086
   38    HD3  PRO   5           HD1      PRO   5  67.279 -20.533   3.024
   39    HA   PRO   6           HA       PRO   6  65.863 -17.876  -3.360
   40    HB2  PRO   6           HB2      PRO   6  63.403 -18.226  -4.503
   41    HB3  PRO   6           HB1      PRO   6  64.653 -19.486  -4.496
   42    HG2  PRO   6           HG2      PRO   6  62.270 -19.187  -2.736
   43    HG3  PRO   6           HG1      PRO   6  62.959 -20.646  -3.467
   44    HD2  PRO   6           HD2      PRO   6  63.380 -19.958  -0.849
   45    HD3  PRO   6           HD1      PRO   6  64.554 -20.890  -1.805
   46    H    LYS   7           HN       LYS   7  65.647 -15.686  -3.690
   47    HA   LYS   7           HA       LYS   7  64.091 -14.068  -1.925
   48    HB2  LYS   7           HB2      LYS   7  64.631 -12.213  -3.561
   49    HB3  LYS   7           HB1      LYS   7  66.032 -13.093  -2.954
   50    HG2  LYS   7           HG2      LYS   7  65.877 -14.565  -5.013
   51    HG3  LYS   7           HG1      LYS   7  64.669 -13.440  -5.637
   52    HD2  LYS   7           HD2      LYS   7  66.233 -11.632  -5.675
   53    HD3  LYS   7           HD1      LYS   7  67.410 -12.541  -4.726
   54    HE2  LYS   7           HE2      LYS   7  67.803 -12.401  -7.275
   55    HE3  LYS   7           HE1      LYS   7  67.912 -13.994  -6.526
   56    HZ1  LYS   7           HZ1      LYS   7  66.366 -13.405  -8.641
   57    HZ2  LYS   7           HZ2      LYS   7  65.255 -13.244  -7.365
   58    HZ3  LYS   7           HZ3      LYS   7  66.094 -14.705  -7.586
   59    H    ALA   8           HN       ALA   8  63.598 -14.875  -5.342
   60    HA   ALA   8           HA       ALA   8  61.682 -14.574  -6.697
   61    HB1  ALA   8           HB1      ALA   8  60.593 -15.788  -4.146
   62    HB2  ALA   8           HB2      ALA   8  61.095 -16.640  -5.606
   63    HB3  ALA   8           HB3      ALA   8  59.648 -15.632  -5.626
   64    H    GLU   9           HN       GLU   9  61.524 -12.287  -6.862
   65    HA   GLU   9           HA       GLU   9  60.635 -10.453  -4.961
   66    HB2  GLU   9           HB2      GLU   9  59.754 -10.390  -7.858
   67    HB3  GLU   9           HB1      GLU   9  60.010  -9.016  -6.782
   68    HG2  GLU   9           HG2      GLU   9  62.434  -9.749  -6.600
   69    HG3  GLU   9           HG1      GLU   9  62.106 -10.888  -7.906
   70    H1U  RCY  10           H1U      RCY  10  60.223  -7.313  -0.578
   71    H1S  RCY  10           H1S      RCY  10  57.412 -11.259  -0.931
   72    HB1  RCY  10           HB1      RCY  10  55.323 -11.214  -3.328
   73    HB2  RCY  10           HB2      RCY  10  56.468  -9.966  -2.837
   74    HA   RCY  10           HA       RCY  10  56.152 -11.224  -5.571
   75    HN1  RCY  10           HN1      RCY  10  58.358  -9.321  -5.086
   76    H    ARG  11           HN       ARG  11  56.316  -8.321  -3.506
   77    HA   ARG  11           HA       ARG  11  54.552  -6.937  -5.498
   78    HE   ARG  11           HE       ARG  11  52.859  -7.289  -1.021
   79    HB2  ARG  11           HB2      ARG  11  54.509  -6.836  -2.467
   80    HB3  ARG  11           HB1      ARG  11  53.605  -5.723  -3.495
   81    HG2  ARG  11           HG2      ARG  11  52.671  -7.878  -4.618
   82    HG3  ARG  11           HG1      ARG  11  53.239  -8.696  -3.162
   83    HD2  ARG  11           HD2      ARG  11  51.256  -6.410  -3.311
   84    HD3  ARG  11           HD1      ARG  11  50.932  -8.067  -2.801
   85   HH11  ARG  11          HH21      ARG  11  49.947  -5.863  -2.193
   86   HH12  ARG  11          HH22      ARG  11  49.618  -5.007  -0.724
   87   HH21  ARG  11          HH11      ARG  11  52.446  -6.179   0.904
   88   HH22  ARG  11          HH12      ARG  11  51.033  -5.186   1.030
   89    H    SER  12           HN       SER  12  57.292  -6.687  -5.756
   90    HA   SER  12           HA       SER  12  57.982  -4.098  -4.441
   91    HG   SER  12           HG       SER  12  60.056  -5.199  -3.315
   92    HB2  SER  12           HB2      SER  12  59.661  -6.140  -5.919
   93    HB3  SER  12           HB1      SER  12  60.279  -4.583  -5.377
   94    H    ALA  13           HN       ALA  13  59.460  -2.736  -6.088
   95    HA   ALA  13           HA       ALA  13  59.416  -1.360  -7.988
   96    HB1  ALA  13           HB1      ALA  13  59.259  -2.458 -10.088
   97    HB2  ALA  13           HB2      ALA  13  58.201  -3.714  -9.443
   98    HB3  ALA  13           HB3      ALA  13  59.906  -3.681  -8.994
   99    H    THR  14           HN       THR  14  57.049  -1.495  -6.218
  100    HA   THR  14           HA       THR  14  54.579  -1.575  -7.520
  101    HB   THR  14           HB       THR  14  55.341   0.591  -5.546
  102    HG1  THR  14           HG1      THR  14  54.676  -2.131  -5.120
  103   HG21  THR  14          HG21      THR  14  53.028   0.488  -4.903
  104   HG22  THR  14          HG22      THR  14  52.761  -0.954  -5.882
  105   HG23  THR  14          HG23      THR  14  53.068   0.597  -6.663
  106    H    ARG  15           HN       ARG  15  56.386   1.477  -6.996
  107    HA   ARG  15           HA       ARG  15  56.162   2.282  -9.760
  108    HE   ARG  15           HE       ARG  15  51.637   3.682  -9.115
  109    HB2  ARG  15           HB2      ARG  15  53.785   2.537  -9.050
  110    HB3  ARG  15           HB1      ARG  15  54.305   3.656  -7.790
  111    HG2  ARG  15           HG2      ARG  15  54.750   5.347  -9.281
  112    HG3  ARG  15           HG1      ARG  15  55.248   4.234 -10.555
  113    HD2  ARG  15           HD2      ARG  15  53.058   5.443 -10.987
  114    HD3  ARG  15           HD1      ARG  15  52.971   3.685 -11.083
  115   HH11  ARG  15          HH21      ARG  15  53.078   6.744  -9.774
  116   HH12  ARG  15          HH22      ARG  15  52.144   7.589  -8.585
  117   HH21  ARG  15          HH11      ARG  15  50.409   4.767  -7.558
  118   HH22  ARG  15          HH12      ARG  15  50.633   6.470  -7.330
  119    H    VAL  16           HN       VAL  16  58.361   2.222  -8.153
  120    HA   VAL  16           HA       VAL  16  58.767   4.946  -7.053
  121    HB   VAL  16           HB       VAL  16  60.584   2.516  -7.086
  122   HG11  VAL  16          HG11      VAL  16  61.819   3.861  -5.330
  123   HG12  VAL  16          HG12      VAL  16  60.835   5.248  -5.800
  124   HG13  VAL  16          HG13      VAL  16  61.933   4.510  -6.966
  125   HG21  VAL  16          HG21      VAL  16  59.996   2.353  -4.707
  126   HG22  VAL  16          HG22      VAL  16  58.536   2.280  -5.693
  127   HG23  VAL  16          HG23      VAL  16  58.957   3.771  -4.850
  128    H    MET  17           HN       MET  17  59.960   2.843  -9.659
  129    HA   MET  17           HA       MET  17  60.818   5.229 -11.145
  130    HB2  MET  17           HB2      MET  17  62.745   4.432  -9.584
  131    HB3  MET  17           HB1      MET  17  62.890   3.079 -10.705
  132    HG2  MET  17           HG2      MET  17  62.942   5.987 -11.557
  133    HG3  MET  17           HG1      MET  17  64.389   5.021 -11.267
  134    HE1  MET  17           HE1      MET  17  64.384   5.325 -15.076
  135    HE2  MET  17           HE2      MET  17  65.480   4.970 -13.743
  136    HE3  MET  17           HE3      MET  17  64.400   6.358 -13.641
  137    H    GLY  18           HN       GLY  18  61.824   1.813 -11.400
  138    HA2  GLY  18           HA2      GLY  18  59.894   1.244 -13.506
  139    HA3  GLY  18           HA1      GLY  18  61.524   1.495 -14.132
  140    H    GLY  19           HN       GLY  19  60.425  -0.987 -14.489
  141    HA2  GLY  19           HA2      GLY  19  61.253  -2.751 -12.283
  142    HA3  GLY  19           HA1      GLY  19  60.540  -3.269 -13.811
  143    HA   PRO  20           HA       PRO  20  64.265  -4.478 -15.797
  144    HB2  PRO  20           HB2      PRO  20  64.152  -1.978 -17.452
  145    HB3  PRO  20           HB1      PRO  20  64.395  -3.658 -17.968
  146    HG2  PRO  20           HG2      PRO  20  62.040  -2.418 -18.237
  147    HG3  PRO  20           HG1      PRO  20  62.161  -4.149 -17.886
  148    HD2  PRO  20           HD2      PRO  20  61.270  -1.947 -16.120
  149    HD3  PRO  20           HD1      PRO  20  60.938  -3.689 -16.005
  150    H1U  RCY  21           H1U      RCY  21  69.487   2.700  -9.343
  151    H1S  RCY  21           H1S      RCY  21  67.528  -1.234 -11.155
  152    HB1  RCY  21           HB1      RCY  21  67.777  -4.271 -12.792
  153    HB2  RCY  21           HB2      RCY  21  66.839  -2.954 -12.088
  154    HA   RCY  21           HA       RCY  21  67.209  -1.576 -14.060
  155    HN1  RCY  21           HN1      RCY  21  66.213  -4.310 -14.761
  156    H    THR  22           HN       THR  22  68.460  -1.081 -15.871
  157    HA   THR  22           HA       THR  22  70.328  -3.096 -16.938
  158    HB   THR  22           HB       THR  22  69.429  -1.831 -18.682
  159    HG1  THR  22           HG1      THR  22  71.615  -0.169 -18.070
  160   HG21  THR  22          HG21      THR  22  69.326   0.721 -18.495
  161   HG22  THR  22          HG22      THR  22  69.674   0.504 -16.780
  162   HG23  THR  22          HG23      THR  22  68.206  -0.183 -17.476
  163    HA   PRO  23           HA       PRO  23  73.561  -1.977 -13.999
  164    HB2  PRO  23           HB2      PRO  23  75.231  -2.661 -16.400
  165    HB3  PRO  23           HB1      PRO  23  75.433  -3.164 -14.709
  166    HG2  PRO  23           HG2      PRO  23  74.387  -4.799 -16.537
  167    HG3  PRO  23           HG1      PRO  23  73.814  -4.789 -14.862
  168    HD2  PRO  23           HD2      PRO  23  72.456  -3.793 -17.308
  169    HD3  PRO  23           HD1      PRO  23  71.753  -4.327 -15.765
  170    H    ARG  24           HN       ARG  24  75.270  -0.326 -13.836
  171    HA   ARG  24           HA       ARG  24  74.623   2.130 -15.138
  172    HE   ARG  24           HE       ARG  24  73.163   3.105 -13.858
  173    HB2  ARG  24           HB2      ARG  24  76.834   1.157 -13.375
  174    HB3  ARG  24           HB1      ARG  24  77.127   2.640 -14.279
  175    HG2  ARG  24           HG2      ARG  24  76.107   3.006 -12.001
  176    HG3  ARG  24           HG1      ARG  24  75.170   3.690 -13.330
  177    HD2  ARG  24           HD2      ARG  24  74.532   0.883 -12.603
  178    HD3  ARG  24           HD1      ARG  24  74.080   2.110 -11.420
  179   HH11  ARG  24          HH21      ARG  24  72.803   0.241 -11.972
  180   HH12  ARG  24          HH22      ARG  24  71.191  -0.078 -12.521
  181   HH21  ARG  24          HH11      ARG  24  71.061   2.705 -14.586
  182   HH22  ARG  24          HH12      ARG  24  70.205   1.317 -14.001
  183    H    LYS  25           HN       LYS  25  77.955   1.954 -15.455
  184    HA   LYS  25           HA       LYS  25  77.819   1.094 -18.311
  185    HB2  LYS  25           HB2      LYS  25  79.190   3.610 -17.307
  186    HB3  LYS  25           HB1      LYS  25  79.165   3.033 -18.973
  187    HG2  LYS  25           HG2      LYS  25  76.832   3.432 -19.192
  188    HG3  LYS  25           HG1      LYS  25  76.618   3.602 -17.449
  189    HD2  LYS  25           HD2      LYS  25  76.583   5.811 -18.509
  190    HD3  LYS  25           HD1      LYS  25  78.021   5.653 -17.500
  191    HE2  LYS  25           HE2      LYS  25  79.434   5.304 -19.382
  192    HE3  LYS  25           HE1      LYS  25  78.063   5.007 -20.451
  193    HZ1  LYS  25           HZ1      LYS  25  77.366   7.345 -19.966
  194    HZ2  LYS  25           HZ2      LYS  25  78.799   7.196 -20.866
  195    HZ3  LYS  25           HZ3      LYS  25  78.868   7.576 -19.211
  196    H    GLY  26           HN       GLY  26  80.084   2.243 -15.788
  197    HA2  GLY  26           HA2      GLY  26  81.628   0.262 -15.047
  198    HA3  GLY  26           HA1      GLY  26  82.069   0.239 -16.756
  199    HA   PRO  27           HA       PRO  27  84.967   3.554 -16.622
  200    HB2  PRO  27           HB2      PRO  27  82.964   5.513 -17.683
  201    HB3  PRO  27           HB1      PRO  27  84.596   5.144 -18.271
  202    HG2  PRO  27           HG2      PRO  27  82.423   4.247 -19.523
  203    HG3  PRO  27           HG1      PRO  27  83.909   3.288 -19.427
  204    HD2  PRO  27           HD2      PRO  27  81.328   2.898 -17.995
  205    HD3  PRO  27           HD1      PRO  27  82.556   1.699 -18.456
  206    HA   PRO  28           HA       PRO  28  84.790   5.895 -12.875
  207    HB2  PRO  28           HB2      PRO  28  85.172   8.341 -14.578
  208    HB3  PRO  28           HB1      PRO  28  86.001   7.875 -13.079
  209    HG2  PRO  28           HG2      PRO  28  87.131   7.546 -15.480
  210    HG3  PRO  28           HG1      PRO  28  87.399   6.407 -14.152
  211    HD2  PRO  28           HD2      PRO  28  85.859   6.024 -16.647
  212    HD3  PRO  28           HD1      PRO  28  86.540   4.807 -15.547
  213    H    LYS  29           HN       LYS  29  83.001   6.532 -11.736
  214    HA   LYS  29           HA       LYS  29  80.564   7.266 -13.126
  215    HB2  LYS  29           HB2      LYS  29  80.939   6.026 -10.814
  216    HB3  LYS  29           HB1      LYS  29  80.907   7.665 -10.168
  217    HG2  LYS  29           HG2      LYS  29  78.644   7.111 -10.088
  218    HG3  LYS  29           HG1      LYS  29  78.746   7.895 -11.665
  219    HD2  LYS  29           HD2      LYS  29  77.684   5.959 -12.314
  220    HD3  LYS  29           HD1      LYS  29  79.352   5.395 -12.424
  221    HE2  LYS  29           HE2      LYS  29  77.327   4.874 -10.257
  222    HE3  LYS  29           HE1      LYS  29  78.323   3.718 -11.140
  223    HZ1  LYS  29           HZ1      LYS  29  80.271   4.563 -10.026
  224    HZ2  LYS  29           HZ2      LYS  29  79.118   4.089  -8.873
  225    HZ3  LYS  29           HZ3      LYS  29  79.350   5.736  -9.218
  226    H1U  RCY  30           H1U      RCY  30  82.451   8.992  -6.660
  227    H1S  RCY  30           H1S      RCY  30  82.719  12.609  -8.445
  228    HB1  RCY  30           HB1      RCY  30  80.615  11.026 -10.309
  229    HB2  RCY  30           HB2      RCY  30  80.454  11.865 -11.850
  230    HA   RCY  30           HA       RCY  30  82.676  11.482 -12.442
  231    HN1  RCY  30           HN1      RCY  30  82.914   9.022 -11.106
  232    H    LYS  31           HN       LYS  31  82.971   9.971  -9.255
  233    HA   LYS  31           HA       LYS  31  85.634  10.977  -8.874
  234    HB2  LYS  31           HB2      LYS  31  83.873  12.965  -8.409
  235    HB3  LYS  31           HB1      LYS  31  83.823  12.189  -6.828
  236    HG2  LYS  31           HG2      LYS  31  85.596  13.679  -6.547
  237    HG3  LYS  31           HG1      LYS  31  86.449  12.220  -7.051
  238    HD2  LYS  31           HD2      LYS  31  86.149  13.127  -9.461
  239    HD3  LYS  31           HD1      LYS  31  85.794  14.670  -8.683
  240    HE2  LYS  31           HE2      LYS  31  88.339  13.046  -8.507
  241    HE3  LYS  31           HE1      LYS  31  88.143  14.692  -9.110
  242    HZ1  LYS  31           HZ1      LYS  31  88.869  15.135  -7.021
  243    HZ2  LYS  31           HZ2      LYS  31  88.217  13.713  -6.357
  244    HZ3  LYS  31           HZ3      LYS  31  87.207  15.038  -6.691
  245    H    GLN  32           HN       GLN  32  86.352  10.495  -6.524
  246    HA   GLN  32           HA       GLN  32  86.623   8.810  -4.909
  247    HB2  GLN  32           HB2      GLN  32  84.559  10.041  -4.092
  248    HB3  GLN  32           HB1      GLN  32  83.593   8.797  -4.886
  249    HG2  GLN  32           HG2      GLN  32  84.970   7.093  -3.551
  250    HG3  GLN  32           HG1      GLN  32  85.532   8.464  -2.592
  251   HE21  GLN  32          HE21      GLN  32  83.178   6.096  -2.627
  252   HE22  GLN  32          HE22      GLN  32  81.988   6.879  -1.705
  253    H    ARG  33           HN       ARG  33  87.276   7.509  -6.953
  254    HA   ARG  33           HA       ARG  33  85.783   4.970  -6.864
  255    HE   ARG  33           HE       ARG  33  87.656   7.487 -12.368
  256    HB2  ARG  33           HB2      ARG  33  85.799   4.885  -9.425
  257    HB3  ARG  33           HB1      ARG  33  84.600   5.938  -8.683
  258    HG2  ARG  33           HG2      ARG  33  85.475   7.410 -10.239
  259    HG3  ARG  33           HG1      ARG  33  86.572   7.727  -8.894
  260    HD2  ARG  33           HD2      ARG  33  88.260   6.300  -9.815
  261    HD3  ARG  33           HD1      ARG  33  87.143   5.640 -11.010
  262   HH11  ARG  33          HH21      ARG  33  88.247   8.155  -9.038
  263   HH12  ARG  33          HH22      ARG  33  88.895   9.734  -9.332
  264   HH21  ARG  33          HH11      ARG  33  88.499   9.546 -12.771
  265   HH22  ARG  33          HH12      ARG  33  89.038  10.521 -11.446
  266    H    GLN  34           HN       GLN  34  88.636   6.635  -6.896
  267    HA   GLN  34           HA       GLN  34  90.228   4.672  -8.395
  268    HB2  GLN  34           HB2      GLN  34  91.385   6.691  -6.480
  269    HB3  GLN  34           HB1      GLN  34  92.071   6.067  -7.980
  270    HG2  GLN  34           HG2      GLN  34  90.284   7.242  -9.255
  271    HG3  GLN  34           HG1      GLN  34  89.685   7.924  -7.743
  272   HE21  GLN  34          HE21      GLN  34  92.679   7.768  -9.740
  273   HE22  GLN  34          HE22      GLN  34  93.258   9.289  -9.256
  274    H    THR  35           HN       THR  35  88.652   3.548  -6.270
  275    HA   THR  35           HA       THR  35  88.955   1.934  -4.593
  276    HB   THR  35           HB       THR  35  91.927   2.347  -4.614
  277    HG1  THR  35           HG1      THR  35  90.466   1.008  -6.642
  278   HG21  THR  35          HG21      THR  35  91.888  -0.111  -4.416
  279   HG22  THR  35          HG22      THR  35  90.132  -0.096  -4.579
  280   HG23  THR  35          HG23      THR  35  90.893   0.640  -3.169
  281    H    ARG  36           HN       ARG  36  88.629   4.772  -4.050
  282    HA   ARG  36           HA       ARG  36  90.391   5.565  -1.899
  283    HE   ARG  36           HE       ARG  36  91.979   6.098  -4.113
  284    HB2  ARG  36           HB2      ARG  36  87.854   6.562  -3.109
  285    HB3  ARG  36           HB1      ARG  36  88.178   7.063  -1.451
  286    HG2  ARG  36           HG2      ARG  36  89.133   8.701  -2.994
  287    HG3  ARG  36           HG1      ARG  36  90.436   7.848  -2.166
  288    HD2  ARG  36           HD2      ARG  36  89.686   6.400  -4.545
  289    HD3  ARG  36           HD1      ARG  36  90.044   8.077  -4.957
  290   HH11  ARG  36          HH21      ARG  36  91.075   9.422  -3.983
  291   HH12  ARG  36          HH22      ARG  36  92.696   9.992  -3.767
  292   HH21  ARG  36          HH11      ARG  36  94.102   6.823  -3.832
  293   HH22  ARG  36          HH12      ARG  36  94.410   8.521  -3.682
  294    H    GLN  37           HN       GLN  37  89.877   3.069  -1.166
  295    HA   GLN  37           HA       GLN  37  87.570   2.403   0.272
  296    HB2  GLN  37           HB2      GLN  37  89.748   1.032  -0.149
  297    HB3  GLN  37           HB1      GLN  37  90.308   1.753   1.360
  298    HG2  GLN  37           HG2      GLN  37  89.275  -0.335   1.942
  299    HG3  GLN  37           HG1      GLN  37  88.149   0.934   2.422
  300   HE21  GLN  37          HE21      GLN  37  86.051   0.326   1.893
  301   HE22  GLN  37          HE22      GLN  37  85.598  -0.492   0.475
  302    H1U  RCY  38           H1U      RCY  38  84.710   0.313   0.502
  303    H1S  RCY  38           H1S      RCY  38  86.890   3.565   2.120
  304    HB1  RCY  38           HB1      RCY  38  87.693   6.792   3.918
  305    HB2  RCY  38           HB2      RCY  38  87.545   5.044   4.096
  306    HA   RCY  38           HA       RCY  38  89.575   6.633   2.553
  307    HN1  RCY  38           HN1      RCY  38  89.620   5.010   0.856
  308    H    LYS  39           HN       LYS  39  90.166   6.827   4.914
  309    HA   LYS  39           HA       LYS  39  92.294   5.101   5.596
  310    HB2  LYS  39           HB2      LYS  39  91.100   7.422   6.679
  311    HB3  LYS  39           HB1      LYS  39  91.060   6.231   7.977
  312    HG2  LYS  39           HG2      LYS  39  93.173   7.334   8.168
  313    HG3  LYS  39           HG1      LYS  39  93.514   5.762   7.443
  314    HD2  LYS  39           HD2      LYS  39  93.051   7.218   5.204
  315    HD3  LYS  39           HD1      LYS  39  93.705   8.474   6.255
  316    HE2  LYS  39           HE2      LYS  39  95.624   7.560   5.230
  317    HE3  LYS  39           HE1      LYS  39  95.569   6.756   6.799
  318    HZ1  LYS  39           HZ1      LYS  39  94.960   4.790   5.880
  319    HZ2  LYS  39           HZ2      LYS  39  95.826   5.419   4.561
  320    HZ3  LYS  39           HZ3      LYS  39  94.129   5.506   4.586
  321    H    SER  40           HN       SER  40  91.903   4.254   8.226
  322    HA   SER  40           HA       SER  40  90.626   1.735   7.843
  323    HG   SER  40           HG       SER  40  92.646   1.080   9.093
  324    HB2  SER  40           HB2      SER  40  91.316   3.198  10.407
  325    HB3  SER  40           HB1      SER  40  90.830   1.507  10.321
  326    H    LYS  41           HN       LYS  41  89.495   3.305  10.702
  327    HA   LYS  41           HA       LYS  41  86.770   3.627   9.518
  328    HB2  LYS  41           HB2      LYS  41  87.527   2.124  12.039
  329    HB3  LYS  41           HB1      LYS  41  85.876   2.618  11.669
  330    HG2  LYS  41           HG2      LYS  41  85.766   1.227   9.754
  331    HG3  LYS  41           HG1      LYS  41  87.517   1.015   9.707
  332    HD2  LYS  41           HD2      LYS  41  87.468  -0.310  11.740
  333    HD3  LYS  41           HD1      LYS  41  85.746   0.011  11.953
  334    HE2  LYS  41           HE2      LYS  41  85.213  -1.212   9.922
  335    HE3  LYS  41           HE1      LYS  41  86.926  -1.424   9.557
  336    HZ1  LYS  41           HZ1      LYS  41  86.889  -2.459  11.965
  337    HZ2  LYS  41           HZ2      LYS  41  86.518  -3.384  10.589
  338    HZ3  LYS  41           HZ3      LYS  41  85.269  -2.761  11.558
  339    HA   PRO  42           HA       PRO  42  86.850   7.492  11.658
  340    HB2  PRO  42           HB2      PRO  42  84.167   7.756  12.310
  341    HB3  PRO  42           HB1      PRO  42  84.850   8.101  10.710
  342    HG2  PRO  42           HG2      PRO  42  83.401   5.690  11.666
  343    HG3  PRO  42           HG1      PRO  42  83.341   6.497  10.090
  344    HD2  PRO  42           HD2      PRO  42  84.741   4.194  10.495
  345    HD3  PRO  42           HD1      PRO  42  85.246   5.421   9.312
  346    HA   PRO  43           HA       PRO  43  87.019   6.491  15.988
  347    HB2  PRO  43           HB2      PRO  43  87.106   8.976  17.083
  348    HB3  PRO  43           HB1      PRO  43  88.456   8.303  16.147
  349    HG2  PRO  43           HG2      PRO  43  86.360  10.241  15.298
  350    HG3  PRO  43           HG1      PRO  43  88.096  10.229  14.945
  351    HD2  PRO  43           HD2      PRO  43  86.188   9.343  13.171
  352    HD3  PRO  43           HD1      PRO  43  87.863   8.750  13.185
  353    H    LYS  44           HN       LYS  44  85.345   5.745  17.217
  354    HA   LYS  44           HA       LYS  44  83.277   5.651  18.313
  355    HB2  LYS  44           HB2      LYS  44  84.311   8.303  18.661
  356    HB3  LYS  44           HB1      LYS  44  82.572   8.433  18.413
  357    HG2  LYS  44           HG2      LYS  44  83.760   6.431  20.341
  358    HG3  LYS  44           HG1      LYS  44  83.363   8.077  20.834
  359    HD2  LYS  44           HD2      LYS  44  81.030   7.672  19.918
  360    HD3  LYS  44           HD1      LYS  44  81.474   5.973  19.753
  361    HE2  LYS  44           HE2      LYS  44  82.075   5.969  22.198
  362    HE3  LYS  44           HE1      LYS  44  81.409   7.598  22.310
  363    HZ1  LYS  44           HZ1      LYS  44  79.649   5.756  20.997
  364    HZ2  LYS  44           HZ2      LYS  44  79.340   6.821  22.285
  365    HZ3  LYS  44           HZ3      LYS  44  80.008   5.288  22.588
  366    H    LYS  45           HN       LYS  45  80.920   6.887  18.081
  367    HA   LYS  45           HA       LYS  45  80.347   7.380  15.214
  368    HB2  LYS  45           HB2      LYS  45  78.529   5.691  15.221
  369    HB3  LYS  45           HB1      LYS  45  80.107   4.945  15.471
  370    HG2  LYS  45           HG2      LYS  45  79.253   5.607  18.048
  371    HG3  LYS  45           HG1      LYS  45  77.798   5.008  17.251
  372    HD2  LYS  45           HD2      LYS  45  79.025   2.981  16.542
  373    HD3  LYS  45           HD1      LYS  45  80.467   3.573  17.367
  374    HE2  LYS  45           HE2      LYS  45  78.788   3.760  19.423
  375    HE3  LYS  45           HE1      LYS  45  77.920   2.515  18.525
  376    HZ1  LYS  45           HZ1      LYS  45  79.957   1.208  18.453
  377    HZ2  LYS  45           HZ2      LYS  45  79.500   1.536  20.056
  378    HZ3  LYS  45           HZ3      LYS  45  80.774   2.401  19.340
  379    H    GLY  46           HN       GLY  46  77.491   6.547  16.556
  380    HA2  GLY  46           HA2      GLY  46  76.820   8.516  18.443
  381    HA3  GLY  46           HA1      GLY  46  76.603   9.269  16.863
  382    H    VAL  47           HN       VAL  47  75.104   7.357  19.206
  383    HA   VAL  47           HA       VAL  47  73.493   5.546  17.839
  384    HB   VAL  47           HB       VAL  47  73.489   5.966  20.321
  385   HG11  VAL  47          HG11      VAL  47  73.209   8.491  19.980
  386   HG12  VAL  47          HG12      VAL  47  72.216   7.760  21.241
  387   HG13  VAL  47          HG13      VAL  47  71.505   8.155  19.676
  388   HG21  VAL  47          HG21      VAL  47  71.172   5.335  20.612
  389   HG22  VAL  47          HG22      VAL  47  71.733   4.617  19.102
  390   HG23  VAL  47          HG23      VAL  47  70.729   6.067  19.069
  391    H    GLN  48           HN       GLN  48  73.574   8.948  17.446
  392    HA   GLN  48           HA       GLN  48  71.429   8.784  15.446
  393    HB2  GLN  48           HB2      GLN  48  70.384   9.286  17.772
  394    HB3  GLN  48           HB1      GLN  48  71.133  10.874  17.606
  395    HG2  GLN  48           HG2      GLN  48  69.921  11.311  15.563
  396    HG3  GLN  48           HG1      GLN  48  69.314   9.655  15.511
  397   HE21  GLN  48          HE21      GLN  48  68.008   9.026  17.609
  398   HE22  GLN  48          HE22      GLN  48  66.967  10.219  18.221
  399    H    GLY  49           HN       GLY  49  74.398   9.619  16.050
  400    HA2  GLY  49           HA2      GLY  49  74.282  12.040  14.315
  401    HA3  GLY  49           HA1      GLY  49  75.264  12.079  15.781
  402    H1U  RCY  50           H1U      RCY  50  77.971   4.602   6.712
  403    H1S  RCY  50           H1S      RCY  50  77.470   6.773  10.396
  404    HB1  RCY  50           HB1      RCY  50  76.651   9.926  10.816
  405    HB2  RCY  50           HB2      RCY  50  76.480   9.040  12.330
  406    HA   RCY  50           HA       RCY  50  78.447  10.521  13.164
  407    HN1  RCY  50           HN1      RCY  50  76.192  12.306  13.004
  408    H    GLY  51           HN       GLY  51  76.460  12.770  11.362
  409    HA2  GLY  51           HA2      GLY  51  77.929  14.765  10.605
  410    HA3  GLY  51           HA1      GLY  51  78.830  13.539   9.711
  411    H    ASP  52           HN       ASP  52  75.313  13.941  10.180
  412    HA   ASP  52           HA       ASP  52  74.536  13.136   7.619
  413    HB2  ASP  52           HB2      ASP  52  72.988  13.639   9.533
  414    HB3  ASP  52           HB1      ASP  52  73.215  15.357   9.205
  415    H    ASP  53           HN       ASP  53  75.454  16.409   8.693
  416    HA   ASP  53           HA       ASP  53  76.017  18.312   7.439
  417    HB2  ASP  53           HB2      ASP  53  76.737  16.266   5.319
  418    HB3  ASP  53           HB1      ASP  53  77.352  17.913   5.448
  419    H    ILE  54           HN       ILE  54  75.838  18.131   4.372
  420    HA   ILE  54           HA       ILE  54  72.893  17.975   4.025
  421    HB   ILE  54           HB       ILE  54  74.447  20.428   3.172
  422   HG12  ILE  54          HG12      ILE  54  72.775  19.952   5.659
  423   HG13  ILE  54          HG11      ILE  54  74.489  20.364   5.603
  424   HG21  ILE  54          HG21      ILE  54  71.472  20.049   3.570
  425   HG22  ILE  54          HG22      ILE  54  72.267  19.732   2.028
  426   HG23  ILE  54          HG23      ILE  54  72.293  21.356   2.716
  427   HD11  ILE  54          HD11      ILE  54  72.137  22.100   4.832
  428   HD12  ILE  54          HD12      ILE  54  73.792  22.489   4.363
  429   HD13  ILE  54          HD13      ILE  54  73.354  22.411   6.069
  430    HA   PRO  55           HA       PRO  55  75.197  16.533   0.306
  431    HB2  PRO  55           HB2      PRO  55  74.377  13.958   0.313
  432    HB3  PRO  55           HB1      PRO  55  75.695  14.520   1.360
  433    HG2  PRO  55           HG2      PRO  55  72.894  13.863   2.044
  434    HG3  PRO  55           HG1      PRO  55  74.365  13.705   3.015
  435    HD2  PRO  55           HD2      PRO  55  72.461  15.802   3.174
  436    HD3  PRO  55           HD1      PRO  55  74.058  15.762   3.951
  437    H    GLY  56           HN       GLY  56  72.042  14.990   0.992
  438    HA2  GLY  56           HA2      GLY  56  70.994  16.180  -1.546
  439    HA3  GLY  56           HA1      GLY  56  70.647  14.509  -1.092
  440    H    MET  57           HN       MET  57  70.823  16.517   1.614
  441    HA   MET  57           HA       MET  57  69.199  17.521   2.978
  442    HB2  MET  57           HB2      MET  57  68.347  18.184   0.467
  443    HB3  MET  57           HB1      MET  57  66.976  17.234   1.034
  444    HG2  MET  57           HG2      MET  57  68.215  19.579   2.506
  445    HG3  MET  57           HG1      MET  57  66.698  19.621   1.608
  446    HE1  MET  57           HE1      MET  57  67.669  19.748   5.220
  447    HE2  MET  57           HE2      MET  57  65.925  19.908   5.412
  448    HE3  MET  57           HE3      MET  57  66.737  20.726   4.079
  449    H    GLU  58           HN       GLU  58  68.671  14.525   1.300
  450    HA   GLU  58           HA       GLU  58  67.409  13.433   3.722
  451    HB2  GLU  58           HB2      GLU  58  65.454  12.521   2.546
  452    HB3  GLU  58           HB1      GLU  58  65.464  14.279   2.457
  453    HG2  GLU  58           HG2      GLU  58  66.824  12.763   0.264
  454    HG3  GLU  58           HG1      GLU  58  65.060  12.795   0.276
  455    H    GLY  59           HN       GLY  59  66.422  11.111   2.088
  456    HA2  GLY  59           HA2      GLY  59  67.270   9.142   1.104
  457    HA3  GLY  59           HA1      GLY  59  68.779   9.999   0.783
  458    H1U  RCY  60           H1U      RCY  60  72.336   6.168   0.058
  459    H1S  RCY  60           H1S      RCY  60  70.517  10.087   2.132
  460    HB1  RCY  60           HB1      RCY  60  71.028   8.118   4.059
  461    HB2  RCY  60           HB2      RCY  60  71.408   8.684   5.686
  462    HA   RCY  60           HA       RCY  60  68.943   8.210   5.234
  463    HN1  RCY  60           HN1      RCY  60  68.462  10.704   3.875
  464    H    GLY  61           HN       GLY  61  67.638   9.114   6.859
  465    HA2  GLY  61           HA2      GLY  61  68.916  10.665   8.874
  466    HA3  GLY  61           HA1      GLY  61  67.898  11.743   7.918
  467    H    THR  62           HN       THR  62  66.181   9.155   7.473
  468    HA   THR  62           HA       THR  62  64.937   8.955  10.159
  469    HB   THR  62           HB       THR  62  62.845   9.780   9.529
  470    HG1  THR  62           HG1      THR  62  63.663   9.533   6.825
  471   HG21  THR  62          HG21      THR  62  63.206  11.934   8.462
  472   HG22  THR  62          HG22      THR  62  64.723  11.371   7.760
  473   HG23  THR  62          HG23      THR  62  64.583  11.580   9.506
  474    H    ASP  63           HN       ASP  63  64.511   8.019   6.724
  475    HA   ASP  63           HA       ASP  63  63.216   5.528   7.353
  476    HB2  ASP  63           HB2      ASP  63  63.871   4.952   4.953
  477    HB3  ASP  63           HB1      ASP  63  62.898   6.410   5.152
  478    H    ILE  64           HN       ILE  64  66.162   6.362   8.301
  479    HA   ILE  64           HA       ILE  64  67.712   4.070   7.373
  480    HB   ILE  64           HB       ILE  64  69.377   5.459   8.016
  481   HG12  ILE  64          HG12      ILE  64  68.315   5.118  10.838
  482   HG13  ILE  64          HG11      ILE  64  69.318   3.927  10.009
  483   HG21  ILE  64          HG21      ILE  64  67.277   6.966   9.606
  484   HG22  ILE  64          HG22      ILE  64  67.748   7.304   7.940
  485   HG23  ILE  64          HG23      ILE  64  68.902   7.551   9.251
  486   HD11  ILE  64          HD11      ILE  64  70.776   5.295  11.369
  487   HD12  ILE  64          HD12      ILE  64  70.075   6.775  10.714
  488   HD13  ILE  64          HD13      ILE  64  71.050   5.729   9.682
  489    H    THR  65           HN       THR  65  65.824   4.920  10.199
  490    HA   THR  65           HA       THR  65  65.503   3.703  12.220
  491    HB   THR  65           HB       THR  65  63.678   2.990  10.771
  492    HG1  THR  65           HG1      THR  65  63.284   1.582  12.251
  493   HG21  THR  65          HG21      THR  65  65.718   1.015   9.720
  494   HG22  THR  65          HG22      THR  65  64.893   2.283   8.814
  495   HG23  THR  65          HG23      THR  65  63.988   0.889   9.403
  496    H    VAL  66           HN       VAL  66  68.246   3.560  11.469
  497    HA   VAL  66           HA       VAL  66  70.160   2.352  12.068
  498    HB   VAL  66           HB       VAL  66  68.330   0.270  13.275
  499   HG11  VAL  66          HG11      VAL  66  70.815  -0.124  13.111
  500   HG12  VAL  66          HG12      VAL  66  70.200  -0.106  14.764
  501   HG13  VAL  66          HG13      VAL  66  71.051   1.300  14.125
  502   HG21  VAL  66          HG21      VAL  66  68.654   1.713  15.392
  503   HG22  VAL  66          HG22      VAL  66  67.484   2.286  14.203
  504   HG23  VAL  66          HG23      VAL  66  69.087   3.016  14.285
  505    H    ILE  67           HN       ILE  67  67.468   0.538  10.687
  506    HA   ILE  67           HA       ILE  67  69.419  -0.840   8.907
  507    HB   ILE  67           HB       ILE  67  67.146  -2.150  10.429
  508   HG12  ILE  67          HG12      ILE  67  70.093  -2.849  10.278
  509   HG13  ILE  67          HG11      ILE  67  69.391  -1.860  11.559
  510   HG21  ILE  67          HG21      ILE  67  67.030  -3.050   8.223
  511   HG22  ILE  67          HG22      ILE  67  67.970  -4.216   9.154
  512   HG23  ILE  67          HG23      ILE  67  68.786  -3.091   8.069
  513   HD11  ILE  67          HD11      ILE  67  67.813  -3.734  12.073
  514   HD12  ILE  67          HD12      ILE  67  69.504  -4.166  12.327
  515   HD13  ILE  67          HD13      ILE  67  68.659  -4.723  10.883
  516    H1U  RCY  68           H1U      RCY  68  70.650   2.339  -1.249
  517    H1S  RCY  68           H1S      RCY  68  68.453   0.903   2.441
  518    HB1  RCY  68           HB1      RCY  68  67.840   2.591   5.860
  519    HB2  RCY  68           HB2      RCY  68  66.961   2.000   4.452
  520    HA   RCY  68           HA       RCY  68  66.024   1.068   6.544
  521    HN1  RCY  68           HN1      RCY  68  68.785   0.592   7.234
  522    HA   PRO  69           HA       PRO  69  65.036  -2.681   4.421
  523    HB2  PRO  69           HB2      PRO  69  63.509  -1.676   2.322
  524    HB3  PRO  69           HB1      PRO  69  62.907  -1.962   3.965
  525    HG2  PRO  69           HG2      PRO  69  63.782   0.574   2.691
  526    HG3  PRO  69           HG1      PRO  69  62.467   0.278   3.841
  527    HD2  PRO  69           HD2      PRO  69  64.828   1.392   4.605
  528    HD3  PRO  69           HD1      PRO  69  63.882   0.345   5.687
  529    H    TRP  70           HN       TRP  70  66.737  -0.118   2.834
  530    HA   TRP  70           HA       TRP  70  67.222  -1.605   0.360
  531    HD1  TRP  70           HD1      TRP  70  65.285   0.283   0.722
  532    HE1  TRP  70           HE1      TRP  70  64.221   2.449   1.625
  533    HE3  TRP  70           HE3      TRP  70  69.501   2.981   1.729
  534    HZ2  TRP  70           HZ2      TRP  70  65.050   4.996   2.642
  535    HZ3  TRP  70           HZ3      TRP  70  69.337   5.268   2.661
  536    HH2  TRP  70           HH2      TRP  70  67.122   6.279   3.120
  537    HB2  TRP  70           HB2      TRP  70  69.111   0.564   1.089
  538    HB3  TRP  70           HB1      TRP  70  68.210   0.313  -0.404
  539    H    GLU  71           HN       GLU  71  68.117  -2.302   3.363
  540    HA   GLU  71           HA       GLU  71  70.992  -2.686   3.014
  541    HB2  GLU  71           HB2      GLU  71  68.986  -3.117   5.140
  542    HB3  GLU  71           HB1      GLU  71  70.269  -4.325   5.113
  543    HG2  GLU  71           HG2      GLU  71  70.929  -1.391   4.921
  544    HG3  GLU  71           HG1      GLU  71  70.652  -2.147   6.491
  545    H    ALA  72           HN       ALA  72  68.075  -4.690   2.790
  546    HA   ALA  72           HA       ALA  72  69.527  -7.155   2.309
  547    HB1  ALA  72           HB1      ALA  72  67.117  -6.939   3.134
  548    HB2  ALA  72           HB2      ALA  72  67.384  -8.121   1.853
  549    HB3  ALA  72           HB3      ALA  72  66.683  -6.549   1.470
  550    H1U  RCY  73           H1U      RCY  73  72.126   1.652  -5.347
  551    H1S  RCY  73           H1S      RCY  73  69.703  -1.120  -3.695
  552    HB1  RCY  73           HB1      RCY  73  71.863  -3.952  -1.681
  553    HB2  RCY  73           HB2      RCY  73  70.435  -3.236  -0.941
  554    HA   RCY  73           HA       RCY  73  69.285  -5.402  -2.054
  555    HN1  RCY  73           HN1      RCY  73  70.335  -4.892   0.627
  556    H    ASN  74           HN       ASN  74  70.034  -7.847  -1.322
  557    HA   ASN  74           HA       ASN  74  71.433  -9.647  -1.895
  558    HB2  ASN  74           HB2      ASN  74  72.834  -7.868  -3.877
  559    HB3  ASN  74           HB1      ASN  74  72.385  -9.567  -4.031
  560   HD21  ASN  74          HD21      ASN  74  69.957 -10.003  -4.197
  561   HD22  ASN  74          HD22      ASN  74  68.987  -8.838  -4.961
  562    H    HIS  75           HN       HIS  75  72.341  -7.182  -0.163
  563    HA   HIS  75           HA       HIS  75  74.289  -6.467   0.933
  564    HD1  HIS  75           HD1      HIS  75  72.158  -9.635   0.935
  565    HD2  HIS  75           HD2      HIS  75  76.015 -10.923   0.006
  566    HE1  HIS  75           HE1      HIS  75  71.907 -11.889  -0.192
  567    HE2  HIS  75           HE2      HIS  75  74.248 -12.684  -0.763
  568    HB2  HIS  75           HB2      HIS  75  75.777  -8.589   1.503
  569    HB3  HIS  75           HB1      HIS  75  74.192  -8.377   2.241
  570    H1U  RCY  76           H1U      RCY  76  72.745  -4.116   1.405
  571    H1S  RCY  76           H1S      RCY  76  75.934  -3.979  -1.075
  572    HB1  RCY  76           HB1      RCY  76  78.072  -5.426  -3.073
  573    HB2  RCY  76           HB2      RCY  76  77.197  -5.278  -1.548
  574    HA   RCY  76           HA       RCY  76  76.037  -6.828  -3.861
  575    HN1  RCY  76           HN1      RCY  76  74.403  -7.015  -2.184
  576    H    GLU  77           HN       GLU  77  77.022  -8.696  -4.463
  577    HA   GLU  77           HA       GLU  77  78.311 -10.556  -2.793
  578    HB2  GLU  77           HB2      GLU  77  78.896  -9.939  -5.706
  579    HB3  GLU  77           HB1      GLU  77  79.392 -11.404  -4.859
  580    HG2  GLU  77           HG2      GLU  77  77.381 -12.012  -5.961
  581    HG3  GLU  77           HG1      GLU  77  76.897 -11.710  -4.292
  582    H    LEU  78           HN       LEU  78  80.538  -9.474  -5.175
  583    HA   LEU  78           HA       LEU  78  82.629  -8.438  -5.033
  584    HG   LEU  78           HG       LEU  78  84.155  -7.045  -3.823
  585    HB2  LEU  78           HB2      LEU  78  81.177  -6.815  -3.520
  586    HB3  LEU  78           HB1      LEU  78  82.115  -7.535  -2.215
  587   HD11  LEU  78          HD11      LEU  78  82.278  -4.813  -4.617
  588   HD12  LEU  78          HD12      LEU  78  82.489  -6.252  -5.615
  589   HD13  LEU  78          HD13      LEU  78  83.863  -5.195  -5.290
  590   HD21  LEU  78          HD21      LEU  78  84.056  -6.030  -1.666
  591   HD22  LEU  78          HD22      LEU  78  82.656  -5.053  -2.109
  592   HD23  LEU  78          HD23      LEU  78  84.238  -4.692  -2.800
  593    H    HIS  79           HN       HIS  79  82.637  -8.903  -1.534
  594    HA   HIS  79           HA       HIS  79  83.660 -11.588  -1.583
  595    HD1  HIS  79           HD1      HIS  79  88.193 -10.596  -1.157
  596    HD2  HIS  79           HD2      HIS  79  84.911 -12.993  -0.216
  597    HE1  HIS  79           HE1      HIS  79  89.107 -12.605   0.086
  598    HE2  HIS  79           HE2      HIS  79  87.120 -14.072   0.665
  599    HB2  HIS  79           HB2      HIS  79  85.574 -10.457  -2.688
  600    HB3  HIS  79           HB1      HIS  79  85.740  -9.401  -1.285
  601    H    GLU  80           HN       GLU  80  85.671 -10.023   0.512
  602    HA   GLU  80           HA       GLU  80  84.227 -10.893   2.835
  603    HB2  GLU  80           HB2      GLU  80  86.018  -9.360   3.997
  604    HB3  GLU  80           HB1      GLU  80  86.535 -10.828   3.168
  605    HG2  GLU  80           HG2      GLU  80  87.165  -9.580   1.199
  606    HG3  GLU  80           HG1      GLU  80  86.452  -8.102   1.848
  607    H    LEU  81           HN       LEU  81  83.189  -8.559   0.937
  608    HA   LEU  81           HA       LEU  81  82.701  -6.510   3.033
  609    HG   LEU  81           HG       LEU  81  83.583  -4.597   0.089
  610    HB2  LEU  81           HB2      LEU  81  82.291  -6.642   0.053
  611    HB3  LEU  81           HB1      LEU  81  81.391  -5.461   1.001
  612   HD11  LEU  81          HD11      LEU  81  83.865  -4.626   3.060
  613   HD12  LEU  81          HD12      LEU  81  82.355  -4.002   2.395
  614   HD13  LEU  81          HD13      LEU  81  83.890  -3.261   1.943
  615   HD21  LEU  81          HD21      LEU  81  84.751  -6.831   0.474
  616   HD22  LEU  81          HD22      LEU  81  84.808  -6.408   2.185
  617   HD23  LEU  81          HD23      LEU  81  85.650  -5.408   1.001
  618    H    ALA  82           HN       ALA  82  80.871  -8.656   0.858
  619    HA   ALA  82           HA       ALA  82  78.300  -8.002   1.982
  620    HB1  ALA  82           HB1      ALA  82  78.385 -10.677   0.863
  621    HB2  ALA  82           HB2      ALA  82  79.295  -9.566  -0.158
  622    HB3  ALA  82           HB3      ALA  82  77.604  -9.232   0.218
  623    H    GLN  83           HN       GLN  83  80.772  -9.283   3.612
  624    HA   GLN  83           HA       GLN  83  79.552 -11.639   4.778
  625    HB2  GLN  83           HB2      GLN  83  81.922  -9.912   5.467
  626    HB3  GLN  83           HB1      GLN  83  81.337 -11.098   6.635
  627    HG2  GLN  83           HG2      GLN  83  81.480 -12.844   4.831
  628    HG3  GLN  83           HG1      GLN  83  82.245 -11.640   3.795
  629   HE21  GLN  83          HE21      GLN  83  83.364 -14.191   5.089
  630   HE22  GLN  83          HE22      GLN  83  84.755 -13.666   5.908
  631    H    TYR  84           HN       TYR  84  77.411 -10.702   5.222
  632    HA   TYR  84           HA       TYR  84  75.850 -10.079   6.871
  633    HD1  TYR  84           HD2      TYR  84  76.366 -12.314   7.690
  634    HD2  TYR  84           HD1      TYR  84  79.885 -10.383   9.220
  635    HE1  TYR  84           HE2      TYR  84  77.536 -14.500   7.759
  636    HE2  TYR  84           HE1      TYR  84  81.055 -12.569   9.289
  637    HH   TYR  84           HH       TYR  84  80.845 -14.773   9.045
  638    HB2  TYR  84           HB2      TYR  84  78.023  -9.092   8.697
  639    HB3  TYR  84           HB1      TYR  84  76.505  -9.894   9.096
  640    H    GLY  85           HN       GLY  85  78.087  -8.106   5.348
  641    HA2  GLY  85           HA2      GLY  85  78.236  -5.760   5.061
  642    HA3  GLY  85           HA1      GLY  85  76.472  -5.862   5.060
  643    H    ILE  86           HN       ILE  86  79.070  -6.144   7.487
  644    HA   ILE  86           HA       ILE  86  77.774  -5.525   9.805
  645    HB   ILE  86           HB       ILE  86  80.232  -5.897   9.589
  646   HG12  ILE  86          HG12      ILE  86  79.352  -3.436  11.132
  647   HG13  ILE  86          HG11      ILE  86  79.321  -5.102  11.713
  648   HG21  ILE  86          HG21      ILE  86  81.649  -4.352   8.659
  649   HG22  ILE  86          HG22      ILE  86  80.682  -2.983   9.208
  650   HG23  ILE  86          HG23      ILE  86  80.193  -3.891   7.777
  651   HD11  ILE  86          HD11      ILE  86  81.317  -4.242  12.628
  652   HD12  ILE  86          HD12      ILE  86  81.710  -3.349  11.159
  653   HD13  ILE  86          HD13      ILE  86  81.864  -5.105  11.191
  654    H1U  RCY  87           H1U      RCY  87  76.551  -3.851   4.420
  655    H1S  RCY  87           H1S      RCY  87  73.719  -1.278   5.895
  656    HB1  RCY  87           HB1      RCY  87  73.810  -2.394   9.628
  657    HB2  RCY  87           HB2      RCY  87  74.289  -2.941   8.024
  658    HA   RCY  87           HA       RCY  87  76.384  -1.401   8.430
  659    HN1  RCY  87           HN1      RCY  87  75.933  -4.171   9.269
  Start of MODEL   21
    1    HA   MET   1           HA       MET   1  65.166 -21.973  18.082
    2    HB2  MET   1           HB2      MET   1  67.559 -21.532  18.887
    3    HB3  MET   1           HB1      MET   1  67.418 -19.954  18.112
    4    HG2  MET   1           HG2      MET   1  65.542 -19.356  19.506
    5    HG3  MET   1           HG1      MET   1  65.441 -20.991  20.159
    6    HE1  MET   1           HE1      MET   1  68.217 -17.578  21.254
    7    HE2  MET   1           HE2      MET   1  66.479 -17.529  20.972
    8    HE3  MET   1           HE3      MET   1  67.571 -17.895  19.639
    9    H    ASN   2           HN       ASN   2  66.724 -19.755  15.762
   10    HA   ASN   2           HA       ASN   2  64.118 -18.282  15.581
   11    HB2  ASN   2           HB2      ASN   2  66.971 -17.302  15.390
   12    HB3  ASN   2           HB1      ASN   2  65.619 -16.363  14.757
   13   HD21  ASN   2          HD21      ASN   2  67.385 -17.099  17.614
   14   HD22  ASN   2          HD22      ASN   2  66.331 -16.367  18.725
   15    H    LEU   3           HN       LEU   3  65.143 -20.665  14.053
   16    HA   LEU   3           HA       LEU   3  65.828 -19.705  11.397
   17    HG   LEU   3           HG       LEU   3  67.255 -23.013  11.950
   18    HB2  LEU   3           HB2      LEU   3  64.983 -22.381  12.515
   19    HB3  LEU   3           HB1      LEU   3  65.202 -22.138  10.783
   20   HD11  LEU   3          HD11      LEU   3  67.945 -20.266  11.005
   21   HD12  LEU   3          HD12      LEU   3  67.093 -21.325   9.881
   22   HD13  LEU   3          HD13      LEU   3  68.648 -21.819  10.551
   23   HD21  LEU   3          HD21      LEU   3  68.436 -21.659  13.504
   24   HD22  LEU   3          HD22      LEU   3  66.753 -21.557  14.022
   25   HD23  LEU   3          HD23      LEU   3  67.477 -20.232  13.111
   26    H    GLU   4           HN       GLU   4  63.273 -18.778  12.781
   27    HA   GLU   4           HA       GLU   4  61.114 -19.901  11.176
   28    HB2  GLU   4           HB2      GLU   4  61.208 -17.395  12.886
   29    HB3  GLU   4           HB1      GLU   4  59.746 -18.122  12.220
   30    HG2  GLU   4           HG2      GLU   4  60.406 -20.262  13.439
   31    HG3  GLU   4           HG1      GLU   4  61.621 -19.298  14.281
   32    HA   PRO   5           HA       PRO   5  61.367 -17.678   7.366
   33    HB2  PRO   5           HB2      PRO   5  58.667 -16.606   8.133
   34    HB3  PRO   5           HB1      PRO   5  59.204 -17.292   6.587
   35    HG2  PRO   5           HG2      PRO   5  57.758 -18.698   8.357
   36    HG3  PRO   5           HG1      PRO   5  58.969 -19.448   7.307
   37    HD2  PRO   5           HD2      PRO   5  59.050 -19.036  10.224
   38    HD3  PRO   5           HD1      PRO   5  60.030 -20.121   9.216
   39    HA   PRO   6           HA       PRO   6  62.645 -13.573   8.485
   40    HB2  PRO   6           HB2      PRO   6  62.457 -12.281   6.076
   41    HB3  PRO   6           HB1      PRO   6  63.732 -13.456   6.452
   42    HG2  PRO   6           HG2      PRO   6  61.233 -13.825   4.881
   43    HG3  PRO   6           HG1      PRO   6  62.859 -14.462   4.583
   44    HD2  PRO   6           HD2      PRO   6  60.853 -15.967   5.686
   45    HD3  PRO   6           HD1      PRO   6  62.574 -16.243   6.035
   46    H    LYS   7           HN       LYS   7  61.805 -11.475   8.970
   47    HA   LYS   7           HA       LYS   7  58.959 -11.300   9.284
   48    HB2  LYS   7           HB2      LYS   7  60.904  -8.977   9.304
   49    HB3  LYS   7           HB1      LYS   7  59.359  -9.093  10.147
   50    HG2  LYS   7           HG2      LYS   7  60.239 -10.931  11.530
   51    HG3  LYS   7           HG1      LYS   7  61.784 -10.835  10.683
   52    HD2  LYS   7           HD2      LYS   7  61.901  -8.402  11.413
   53    HD3  LYS   7           HD1      LYS   7  60.524  -8.737  12.463
   54    HE2  LYS   7           HE2      LYS   7  62.558  -9.006  13.761
   55    HE3  LYS   7           HE1      LYS   7  61.845 -10.598  13.505
   56    HZ1  LYS   7           HZ1      LYS   7  63.670  -9.760  11.434
   57    HZ2  LYS   7           HZ2      LYS   7  63.553 -11.248  12.245
   58    HZ3  LYS   7           HZ3      LYS   7  64.397  -9.955  12.954
   59    H    ALA   8           HN       ALA   8  57.999 -11.565   7.212
   60    HA   ALA   8           HA       ALA   8  58.744  -9.773   5.014
   61    HB1  ALA   8           HB1      ALA   8  57.222 -11.004   3.703
   62    HB2  ALA   8           HB2      ALA   8  56.248 -11.464   5.100
   63    HB3  ALA   8           HB3      ALA   8  57.829 -12.202   4.845
   64    H    GLU   9           HN       GLU   9  55.966 -10.151   7.219
   65    HA   GLU   9           HA       GLU   9  54.225  -8.663   7.734
   66    HB2  GLU   9           HB2      GLU   9  56.639  -6.944   7.293
   67    HB3  GLU   9           HB1      GLU   9  55.075  -6.146   7.458
   68    HG2  GLU   9           HG2      GLU   9  55.942  -8.255   9.430
   69    HG3  GLU   9           HG1      GLU   9  56.457  -6.578   9.617
   70    H1U  RCY  10           H1U      RCY  10  54.527  -7.224  -2.482
   71    H1S  RCY  10           H1S      RCY  10  53.446  -4.282   0.092
   72    HB1  RCY  10           HB1      RCY  10  55.644  -5.208   2.862
   73    HB2  RCY  10           HB2      RCY  10  54.937  -4.442   4.285
   74    HA   RCY  10           HA       RCY  10  53.059  -6.249   3.990
   75    HN1  RCY  10           HN1      RCY  10  55.578  -6.397   5.410
   76    H    ARG  11           HN       ARG  11  52.518  -8.150   2.940
   77    HA   ARG  11           HA       ARG  11  52.713  -9.966   1.450
   78    HE   ARG  11           HE       ARG  11  50.179  -6.103  -1.782
   79    HB2  ARG  11           HB2      ARG  11  54.165  -7.756  -0.033
   80    HB3  ARG  11           HB1      ARG  11  53.667  -9.280  -0.770
   81    HG2  ARG  11           HG2      ARG  11  51.327  -8.809  -0.247
   82    HG3  ARG  11           HG1      ARG  11  51.788  -7.326   0.589
   83    HD2  ARG  11           HD2      ARG  11  52.511  -6.290  -1.432
   84    HD3  ARG  11           HD1      ARG  11  52.482  -7.818  -2.311
   85   HH11  ARG  11          HH21      ARG  11  51.357  -9.283  -2.402
   86   HH12  ARG  11          HH22      ARG  11  49.863  -9.850  -3.071
   87   HH21  ARG  11          HH11      ARG  11  48.221  -6.824  -2.652
   88   HH22  ARG  11          HH12      ARG  11  48.088  -8.458  -3.212
   89    H    SER  12           HN       SER  12  54.794 -10.618  -0.351
   90    HA   SER  12           HA       SER  12  56.701 -11.814   1.510
   91    HG   SER  12           HG       SER  12  54.921 -13.024  -0.937
   92    HB2  SER  12           HB2      SER  12  56.584 -11.848  -1.521
   93    HB3  SER  12           HB1      SER  12  57.672 -12.826  -0.540
   94    H    ALA  13           HN       ALA  13  58.038 -10.770  -1.496
   95    HA   ALA  13           HA       ALA  13  59.155  -8.267  -0.584
   96    HB1  ALA  13           HB1      ALA  13  60.408  -9.969   0.826
   97    HB2  ALA  13           HB2      ALA  13  61.428  -8.933  -0.172
   98    HB3  ALA  13           HB3      ALA  13  61.096 -10.590  -0.675
   99    H    THR  14           HN       THR  14  57.923  -9.598  -2.967
  100    HA   THR  14           HA       THR  14  60.130  -9.428  -4.952
  101    HB   THR  14           HB       THR  14  58.823 -11.300  -5.463
  102    HG1  THR  14           HG1      THR  14  58.598 -10.534  -7.393
  103   HG21  THR  14          HG21      THR  14  56.506  -9.602  -4.540
  104   HG22  THR  14          HG22      THR  14  57.073 -11.134  -3.876
  105   HG23  THR  14          HG23      THR  14  56.255 -11.099  -5.438
  106    H    ARG  15           HN       ARG  15  56.945  -8.623  -5.994
  107    HA   ARG  15           HA       ARG  15  56.108  -6.649  -6.942
  108    HE   ARG  15           HE       ARG  15  56.881  -4.004  -2.666
  109    HB2  ARG  15           HB2      ARG  15  57.409  -5.838  -4.383
  110    HB3  ARG  15           HB1      ARG  15  56.995  -4.545  -5.506
  111    HG2  ARG  15           HG2      ARG  15  54.692  -5.107  -5.483
  112    HG3  ARG  15           HG1      ARG  15  55.002  -6.689  -4.767
  113    HD2  ARG  15           HD2      ARG  15  54.127  -4.714  -3.255
  114    HD3  ARG  15           HD1      ARG  15  55.366  -5.810  -2.642
  115   HH11  ARG  15          HH21      ARG  15  54.134  -3.418  -4.666
  116   HH12  ARG  15          HH22      ARG  15  54.571  -1.778  -5.014
  117   HH21  ARG  15          HH11      ARG  15  57.467  -1.866  -3.110
  118   HH22  ARG  15          HH12      ARG  15  56.458  -0.900  -4.133
  119    H    VAL  16           HN       VAL  16  56.985  -6.252  -8.932
  120    HA   VAL  16           HA       VAL  16  58.527  -5.542 -10.559
  121    HB   VAL  16           HB       VAL  16  59.478  -3.582  -8.466
  122   HG11  VAL  16          HG11      VAL  16  60.582  -3.562 -10.671
  123   HG12  VAL  16          HG12      VAL  16  59.627  -2.098 -10.438
  124   HG13  VAL  16          HG13      VAL  16  59.012  -3.398 -11.459
  125   HG21  VAL  16          HG21      VAL  16  57.050  -3.603  -8.289
  126   HG22  VAL  16          HG22      VAL  16  56.887  -3.553 -10.045
  127   HG23  VAL  16          HG23      VAL  16  57.535  -2.160  -9.179
  128    H    MET  17           HN       MET  17  59.462  -7.781  -9.353
  129    HA   MET  17           HA       MET  17  62.385  -7.271  -9.269
  130    HB2  MET  17           HB2      MET  17  61.520  -7.298  -6.900
  131    HB3  MET  17           HB1      MET  17  60.980  -8.954  -7.174
  132    HG2  MET  17           HG2      MET  17  63.227  -9.713  -7.555
  133    HG3  MET  17           HG1      MET  17  63.840  -8.060  -7.609
  134    HE1  MET  17           HE1      MET  17  64.942 -10.261  -4.366
  135    HE2  MET  17           HE2      MET  17  65.155 -10.166  -6.112
  136    HE3  MET  17           HE3      MET  17  63.823 -11.105  -5.443
  137    H    GLY  18           HN       GLY  18  61.701  -8.275 -11.477
  138    HA2  GLY  18           HA2      GLY  18  62.582 -11.007 -11.519
  139    HA3  GLY  18           HA1      GLY  18  60.833 -10.945 -11.745
  140    H    GLY  19           HN       GLY  19  60.131  -9.254 -13.463
  141    HA2  GLY  19           HA2      GLY  19  61.439  -9.921 -15.944
  142    HA3  GLY  19           HA1      GLY  19  60.144  -8.737 -15.756
  143    HA   PRO  20           HA       PRO  20  64.750  -7.041 -16.392
  144    HB2  PRO  20           HB2      PRO  20  63.308  -6.098 -18.846
  145    HB3  PRO  20           HB1      PRO  20  65.010  -6.559 -18.648
  146    HG2  PRO  20           HG2      PRO  20  63.213  -8.191 -19.782
  147    HG3  PRO  20           HG1      PRO  20  64.565  -8.796 -18.813
  148    HD2  PRO  20           HD2      PRO  20  61.679  -8.752 -18.161
  149    HD3  PRO  20           HD1      PRO  20  62.973  -9.760 -17.479
  150    H1U  RCY  21           H1U      RCY  21  62.206  -2.997  -8.052
  151    H1S  RCY  21           H1S      RCY  21  65.042  -4.398 -10.548
  152    HB1  RCY  21           HB1      RCY  21  62.847  -4.299 -12.821
  153    HB2  RCY  21           HB2      RCY  21  63.245  -2.583 -12.893
  154    HA   RCY  21           HA       RCY  21  62.382  -3.415 -15.066
  155    HN1  RCY  21           HN1      RCY  21  64.462  -5.483 -14.756
  156    H    THR  22           HN       THR  22  62.929  -1.126 -15.176
  157    HA   THR  22           HA       THR  22  65.676  -0.594 -16.237
  158    HB   THR  22           HB       THR  22  63.178   0.785 -17.230
  159    HG1  THR  22           HG1      THR  22  63.276  -1.567 -17.589
  160   HG21  THR  22          HG21      THR  22  64.610   1.452 -19.066
  161   HG22  THR  22          HG22      THR  22  65.919   0.431 -18.471
  162   HG23  THR  22          HG23      THR  22  65.426   1.856 -17.555
  163    HA   PRO  23           HA       PRO  23  65.317   2.474 -12.954
  164    HB2  PRO  23           HB2      PRO  23  67.852   3.456 -13.101
  165    HB3  PRO  23           HB1      PRO  23  67.473   1.888 -12.363
  166    HG2  PRO  23           HG2      PRO  23  68.603   2.488 -15.044
  167    HG3  PRO  23           HG1      PRO  23  68.972   1.160 -13.932
  168    HD2  PRO  23           HD2      PRO  23  67.327   0.922 -16.152
  169    HD3  PRO  23           HD1      PRO  23  67.268  -0.155 -14.740
  170    H    ARG  24           HN       ARG  24  67.600   3.891 -15.275
  171    HA   ARG  24           HA       ARG  24  67.438   5.816 -16.606
  172    HE   ARG  24           HE       ARG  24  64.193   8.012 -20.357
  173    HB2  ARG  24           HB2      ARG  24  65.064   4.706 -17.035
  174    HB3  ARG  24           HB1      ARG  24  64.494   6.062 -16.065
  175    HG2  ARG  24           HG2      ARG  24  65.705   7.622 -17.579
  176    HG3  ARG  24           HG1      ARG  24  66.182   6.248 -18.578
  177    HD2  ARG  24           HD2      ARG  24  63.604   5.737 -18.612
  178    HD3  ARG  24           HD1      ARG  24  63.454   7.440 -18.180
  179   HH11  ARG  24          HH21      ARG  24  64.720   4.691 -19.599
  180   HH12  ARG  24          HH22      ARG  24  65.171   4.256 -21.214
  181   HH21  ARG  24          HH11      ARG  24  64.778   7.464 -22.470
  182   HH22  ARG  24          HH12      ARG  24  65.204   5.826 -22.840
  183    H    LYS  25           HN       LYS  25  64.723   6.589 -14.448
  184    HA   LYS  25           HA       LYS  25  66.167   8.998 -13.560
  185    HB2  LYS  25           HB2      LYS  25  63.529   8.243 -12.382
  186    HB3  LYS  25           HB1      LYS  25  64.098   9.815 -12.950
  187    HG2  LYS  25           HG2      LYS  25  63.975   8.896 -15.307
  188    HG3  LYS  25           HG1      LYS  25  63.159   7.483 -14.638
  189    HD2  LYS  25           HD2      LYS  25  62.170  10.275 -14.065
  190    HD3  LYS  25           HD1      LYS  25  61.672   9.407 -15.517
  191    HE2  LYS  25           HE2      LYS  25  59.996   8.848 -13.960
  192    HE3  LYS  25           HE1      LYS  25  61.088   7.465 -13.891
  193    HZ1  LYS  25           HZ1      LYS  25  61.806   8.014 -11.840
  194    HZ2  LYS  25           HZ2      LYS  25  60.296   8.786 -11.742
  195    HZ3  LYS  25           HZ3      LYS  25  61.691   9.685 -12.109
  196    H    GLY  26           HN       GLY  26  65.233   9.264 -10.945
  197    HA2  GLY  26           HA2      GLY  26  65.421   8.356  -8.748
  198    HA3  GLY  26           HA1      GLY  26  65.990   6.841  -9.449
  199    HA   PRO  27           HA       PRO  27  69.605   8.824  -7.256
  200    HB2  PRO  27           HB2      PRO  27  70.415   5.962  -7.648
  201    HB3  PRO  27           HB1      PRO  27  70.623   7.005  -6.227
  202    HG2  PRO  27           HG2      PRO  27  68.733   5.138  -6.310
  203    HG3  PRO  27           HG1      PRO  27  68.457   6.700  -5.521
  204    HD2  PRO  27           HD2      PRO  27  67.383   5.688  -8.110
  205    HD3  PRO  27           HD1      PRO  27  66.680   6.863  -6.977
  206    HA   PRO  28           HA       PRO  28  72.370   9.792 -10.564
  207    HB2  PRO  28           HB2      PRO  28  74.410   8.158  -9.081
  208    HB3  PRO  28           HB1      PRO  28  74.577   9.766  -9.815
  209    HG2  PRO  28           HG2      PRO  28  74.216   9.434  -7.182
  210    HG3  PRO  28           HG1      PRO  28  73.548  10.819  -8.060
  211    HD2  PRO  28           HD2      PRO  28  72.130   8.522  -6.864
  212    HD3  PRO  28           HD1      PRO  28  71.493  10.108  -7.350
  213    H    LYS  29           HN       LYS  29  73.242   8.831 -12.474
  214    HA   LYS  29           HA       LYS  29  72.476   5.996 -12.850
  215    HB2  LYS  29           HB2      LYS  29  72.903   6.481 -15.259
  216    HB3  LYS  29           HB1      LYS  29  71.728   7.583 -14.543
  217    HG2  LYS  29           HG2      LYS  29  74.086   8.897 -14.042
  218    HG3  LYS  29           HG1      LYS  29  74.424   8.145 -15.601
  219    HD2  LYS  29           HD2      LYS  29  71.959   9.803 -14.994
  220    HD3  LYS  29           HD1      LYS  29  73.390  10.408 -15.830
  221    HE2  LYS  29           HE2      LYS  29  73.070   8.519 -17.502
  222    HE3  LYS  29           HE1      LYS  29  71.502   8.228 -16.749
  223    HZ1  LYS  29           HZ1      LYS  29  71.875  10.987 -17.305
  224    HZ2  LYS  29           HZ2      LYS  29  70.636   9.945 -17.819
  225    HZ3  LYS  29           HZ3      LYS  29  72.074  10.065 -18.714
  226    H1U  RCY  30           H1U      RCY  30  74.747   7.536  -8.236
  227    H1S  RCY  30           H1S      RCY  30  74.783   8.664 -12.362
  228    HB1  RCY  30           HB1      RCY  30  78.443   6.723 -14.201
  229    HB2  RCY  30           HB2      RCY  30  77.755   6.164 -12.677
  230    HA   RCY  30           HA       RCY  30  76.883   5.624 -15.447
  231    HN1  RCY  30           HN1      RCY  30  74.719   6.471 -15.134
  232    H    LYS  31           HN       LYS  31  78.600   4.132 -14.111
  233    HA   LYS  31           HA       LYS  31  77.091   2.095 -12.546
  234    HB2  LYS  31           HB2      LYS  31  78.479   0.384 -13.988
  235    HB3  LYS  31           HB1      LYS  31  76.971   1.039 -14.629
  236    HG2  LYS  31           HG2      LYS  31  78.171   2.694 -15.930
  237    HG3  LYS  31           HG1      LYS  31  79.701   2.230 -15.186
  238    HD2  LYS  31           HD2      LYS  31  79.814   1.023 -17.166
  239    HD3  LYS  31           HD1      LYS  31  79.054  -0.166 -16.108
  240    HE2  LYS  31           HE2      LYS  31  76.812   0.852 -16.908
  241    HE3  LYS  31           HE1      LYS  31  77.763   1.573 -18.207
  242    HZ1  LYS  31           HZ1      LYS  31  78.586  -0.672 -18.737
  243    HZ2  LYS  31           HZ2      LYS  31  76.904  -0.527 -18.928
  244    HZ3  LYS  31           HZ3      LYS  31  77.541  -1.318 -17.567
  245    H    GLN  32           HN       GLN  32  79.402   4.191 -12.293
  246    HA   GLN  32           HA       GLN  32  81.406   4.341 -11.088
  247    HB2  GLN  32           HB2      GLN  32  80.562   1.642  -9.991
  248    HB3  GLN  32           HB1      GLN  32  81.688   2.777  -9.248
  249    HG2  GLN  32           HG2      GLN  32  79.934   4.405  -8.914
  250    HG3  GLN  32           HG1      GLN  32  78.793   3.438  -9.849
  251   HE21  GLN  32          HE21      GLN  32  81.012   1.757  -7.718
  252   HE22  GLN  32          HE22      GLN  32  79.871   1.359  -6.527
  253    H    ARG  33           HN       ARG  33  83.322   4.118 -12.110
  254    HA   ARG  33           HA       ARG  33  84.105   1.397 -13.090
  255    HE   ARG  33           HE       ARG  33  81.284   2.382 -17.101
  256    HB2  ARG  33           HB2      ARG  33  84.496   4.072 -14.466
  257    HB3  ARG  33           HB1      ARG  33  85.239   2.563 -14.998
  258    HG2  ARG  33           HG2      ARG  33  83.215   1.645 -15.679
  259    HG3  ARG  33           HG1      ARG  33  82.273   2.638 -14.567
  260    HD2  ARG  33           HD2      ARG  33  82.780   4.638 -15.936
  261    HD3  ARG  33           HD1      ARG  33  83.687   3.627 -17.061
  262   HH11  ARG  33          HH21      ARG  33  82.181   5.711 -17.161
  263   HH12  ARG  33          HH22      ARG  33  80.807   6.202 -18.095
  264   HH21  ARG  33          HH11      ARG  33  79.485   3.004 -18.321
  265   HH22  ARG  33          HH12      ARG  33  79.281   4.669 -18.752
  266    H    GLN  34           HN       GLN  34  85.814   0.779 -11.868
  267    HA   GLN  34           HA       GLN  34  87.860   0.866 -10.731
  268    HB2  GLN  34           HB2      GLN  34  88.431   1.901 -13.066
  269    HB3  GLN  34           HB1      GLN  34  88.489   3.428 -12.187
  270    HG2  GLN  34           HG2      GLN  34  90.055   2.244 -10.538
  271    HG3  GLN  34           HG1      GLN  34  90.179   0.961 -11.743
  272   HE21  GLN  34          HE21      GLN  34  89.676   3.710 -13.525
  273   HE22  GLN  34          HE22      GLN  34  91.286   4.165 -13.811
  274    H    THR  35           HN       THR  35  85.448   3.064 -10.326
  275    HA   THR  35           HA       THR  35  86.885   4.839  -8.451
  276    HB   THR  35           HB       THR  35  84.537   5.777  -8.102
  277    HG1  THR  35           HG1      THR  35  83.889   3.562  -9.279
  278   HG21  THR  35          HG21      THR  35  86.004   6.927  -9.601
  279   HG22  THR  35          HG22      THR  35  84.471   6.750 -10.454
  280   HG23  THR  35          HG23      THR  35  85.821   5.683 -10.838
  281    H    ARG  36           HN       ARG  36  85.833   1.753  -8.280
  282    HA   ARG  36           HA       ARG  36  84.582   1.934  -5.605
  283    HE   ARG  36           HE       ARG  36  83.853  -1.086  -9.281
  284    HB2  ARG  36           HB2      ARG  36  85.183  -0.402  -7.442
  285    HB3  ARG  36           HB1      ARG  36  84.450  -0.575  -5.846
  286    HG2  ARG  36           HG2      ARG  36  82.620   0.963  -6.559
  287    HG3  ARG  36           HG1      ARG  36  83.326   1.006  -8.175
  288    HD2  ARG  36           HD2      ARG  36  82.440  -1.530  -6.771
  289    HD3  ARG  36           HD1      ARG  36  81.468  -0.661  -7.959
  290   HH11  ARG  36          HH21      ARG  36  81.616  -3.032  -7.523
  291   HH12  ARG  36          HH22      ARG  36  81.928  -4.463  -8.449
  292   HH21  ARG  36          HH11      ARG  36  84.274  -2.943 -10.500
  293   HH22  ARG  36          HH12      ARG  36  83.433  -4.412 -10.134
  294    H    GLN  37           HN       GLN  37  87.059   2.950  -5.345
  295    HA   GLN  37           HA       GLN  37  88.425   0.885  -3.729
  296    HB2  GLN  37           HB2      GLN  37  90.653   1.709  -4.800
  297    HB3  GLN  37           HB1      GLN  37  89.683   0.535  -5.688
  298    HG2  GLN  37           HG2      GLN  37  88.697   2.311  -7.041
  299    HG3  GLN  37           HG1      GLN  37  89.552   3.536  -6.104
  300   HE21  GLN  37          HE21      GLN  37  90.617   0.413  -7.582
  301   HE22  GLN  37          HE22      GLN  37  91.924   1.093  -8.425
  302    H1U  RCY  38           H1U      RCY  38  84.577   0.681  -0.166
  303    H1S  RCY  38           H1S      RCY  38  85.249   4.784  -0.732
  304    HB1  RCY  38           HB1      RCY  38  88.318   4.945   0.270
  305    HB2  RCY  38           HB2      RCY  38  87.486   3.497  -0.295
  306    HA   RCY  38           HA       RCY  38  89.852   4.654  -1.779
  307    HN1  RCY  38           HN1      RCY  38  89.045   1.804  -1.837
  308    H    LYS  39           HN       LYS  39  88.988   3.664   1.281
  309    HA   LYS  39           HA       LYS  39  91.768   2.694   1.837
  310    HB2  LYS  39           HB2      LYS  39  89.814   4.296   3.507
  311    HB3  LYS  39           HB1      LYS  39  91.225   3.506   4.207
  312    HG2  LYS  39           HG2      LYS  39  92.141   5.579   3.727
  313    HG3  LYS  39           HG1      LYS  39  92.475   4.747   2.208
  314    HD2  LYS  39           HD2      LYS  39  90.314   5.644   1.307
  315    HD3  LYS  39           HD1      LYS  39  90.132   6.580   2.790
  316    HE2  LYS  39           HE2      LYS  39  91.135   8.008   1.101
  317    HE3  LYS  39           HE1      LYS  39  92.354   7.645   2.322
  318    HZ1  LYS  39           HZ1      LYS  39  93.384   6.094   0.932
  319    HZ2  LYS  39           HZ2      LYS  39  93.040   7.410  -0.086
  320    HZ3  LYS  39           HZ3      LYS  39  92.064   6.020  -0.131
  321    H    SER  40           HN       SER  40  91.492   0.472   1.762
  322    HA   SER  40           HA       SER  40  89.166  -0.913   2.696
  323    HG   SER  40           HG       SER  40  90.939  -2.954   3.912
  324    HB2  SER  40           HB2      SER  40  90.555  -2.144   1.237
  325    HB3  SER  40           HB1      SER  40  92.011  -1.744   2.143
  326    H    LYS  41           HN       LYS  41  91.487   0.775   4.436
  327    HA   LYS  41           HA       LYS  41  91.832  -0.931   6.714
  328    HB2  LYS  41           HB2      LYS  41  92.958   0.858   7.650
  329    HB3  LYS  41           HB1      LYS  41  92.968   1.386   5.970
  330    HG2  LYS  41           HG2      LYS  41  90.727   2.540   6.494
  331    HG3  LYS  41           HG1      LYS  41  91.123   2.275   8.193
  332    HD2  LYS  41           HD2      LYS  41  93.436   3.346   7.503
  333    HD3  LYS  41           HD1      LYS  41  92.489   4.031   6.182
  334    HE2  LYS  41           HE2      LYS  41  90.907   4.998   7.795
  335    HE3  LYS  41           HE1      LYS  41  91.816   4.287   9.128
  336    HZ1  LYS  41           HZ1      LYS  41  92.490   6.556   7.417
  337    HZ2  LYS  41           HZ2      LYS  41  93.768   5.565   7.936
  338    HZ3  LYS  41           HZ3      LYS  41  92.766   6.329   9.075
  339    HA   PRO  42           HA       PRO  42  87.851  -0.627   8.616
  340    HB2  PRO  42           HB2      PRO  42  88.512  -0.814  11.274
  341    HB3  PRO  42           HB1      PRO  42  88.547  -2.194  10.159
  342    HG2  PRO  42           HG2      PRO  42  90.793  -0.508  11.143
  343    HG3  PRO  42           HG1      PRO  42  90.726  -2.258  10.873
  344    HD2  PRO  42           HD2      PRO  42  91.914  -0.534   9.111
  345    HD3  PRO  42           HD1      PRO  42  91.160  -2.063   8.605
  346    HA   PRO  43           HA       PRO  43  87.134   3.559   9.872
  347    HB2  PRO  43           HB2      PRO  43  84.935   3.305  11.483
  348    HB3  PRO  43           HB1      PRO  43  84.872   3.117   9.719
  349    HG2  PRO  43           HG2      PRO  43  84.947   1.027  11.836
  350    HG3  PRO  43           HG1      PRO  43  84.019   1.075  10.328
  351    HD2  PRO  43           HD2      PRO  43  86.321  -0.386  10.616
  352    HD3  PRO  43           HD1      PRO  43  85.785   0.282   9.058
  353    H    LYS  44           HN       LYS  44  87.035   5.029  11.800
  354    HA   LYS  44           HA       LYS  44  88.922   4.187  13.836
  355    HB2  LYS  44           HB2      LYS  44  88.470   6.577  12.861
  356    HB3  LYS  44           HB1      LYS  44  87.190   6.640  14.072
  357    HG2  LYS  44           HG2      LYS  44  88.958   7.490  15.310
  358    HG3  LYS  44           HG1      LYS  44  89.125   5.772  15.673
  359    HD2  LYS  44           HD2      LYS  44  90.699   5.634  13.671
  360    HD3  LYS  44           HD1      LYS  44  90.691   7.398  13.659
  361    HE2  LYS  44           HE2      LYS  44  91.431   5.720  16.073
  362    HE3  LYS  44           HE1      LYS  44  92.603   6.422  14.958
  363    HZ1  LYS  44           HZ1      LYS  44  92.286   8.469  15.778
  364    HZ2  LYS  44           HZ2      LYS  44  91.680   7.656  17.142
  365    HZ3  LYS  44           HZ3      LYS  44  90.613   8.264  15.967
  366    H    LYS  45           HN       LYS  45  86.817   2.406  13.949
  367    HA   LYS  45           HA       LYS  45  85.230   1.479  15.411
  368    HB2  LYS  45           HB2      LYS  45  86.683   3.262  17.390
  369    HB3  LYS  45           HB1      LYS  45  85.650   1.894  17.801
  370    HG2  LYS  45           HG2      LYS  45  87.155   0.350  16.686
  371    HG3  LYS  45           HG1      LYS  45  88.139   1.683  16.083
  372    HD2  LYS  45           HD2      LYS  45  87.685   1.471  19.035
  373    HD3  LYS  45           HD1      LYS  45  88.843   0.374  18.281
  374    HE2  LYS  45           HE2      LYS  45  88.918   3.354  17.791
  375    HE3  LYS  45           HE1      LYS  45  89.773   2.609  19.140
  376    HZ1  LYS  45           HZ1      LYS  45  91.307   1.742  17.790
  377    HZ2  LYS  45           HZ2      LYS  45  90.763   2.883  16.654
  378    HZ3  LYS  45           HZ3      LYS  45  90.176   1.289  16.610
  379    H    GLY  46           HN       GLY  46  83.358   2.461  14.516
  380    HA2  GLY  46           HA2      GLY  46  82.282   4.722  16.143
  381    HA3  GLY  46           HA1      GLY  46  82.144   4.752  14.384
  382    H    VAL  47           HN       VAL  47  81.402   2.570  17.125
  383    HA   VAL  47           HA       VAL  47  79.582   0.871  15.881
  384    HB   VAL  47           HB       VAL  47  80.344   0.771  18.288
  385   HG11  VAL  47          HG11      VAL  47  78.055   2.680  18.796
  386   HG12  VAL  47          HG12      VAL  47  79.725   3.232  18.665
  387   HG13  VAL  47          HG13      VAL  47  79.266   2.105  19.942
  388   HG21  VAL  47          HG21      VAL  47  78.450  -0.593  17.353
  389   HG22  VAL  47          HG22      VAL  47  77.337   0.657  17.908
  390   HG23  VAL  47          HG23      VAL  47  78.288  -0.258  19.077
  391    H    GLN  48           HN       GLN  48  79.119   4.216  16.869
  392    HA   GLN  48           HA       GLN  48  76.548   4.229  15.373
  393    HB2  GLN  48           HB2      GLN  48  76.951   5.061  18.248
  394    HB3  GLN  48           HB1      GLN  48  75.657   5.754  17.269
  395    HG2  GLN  48           HG2      GLN  48  76.065   2.770  17.568
  396    HG3  GLN  48           HG1      GLN  48  75.013   3.702  18.634
  397   HE21  GLN  48          HE21      GLN  48  73.041   4.614  17.715
  398   HE22  GLN  48          HE22      GLN  48  72.458   4.118  16.201
  399    H    GLY  49           HN       GLY  49  79.135   5.206  14.628
  400    HA2  GLY  49           HA2      GLY  49  78.426   8.022  14.153
  401    HA3  GLY  49           HA1      GLY  49  79.917   7.769  15.063
  402    H1U  RCY  50           H1U      RCY  50  81.060   8.087   4.079
  403    H1S  RCY  50           H1S      RCY  50  78.695   7.192   8.093
  404    HB1  RCY  50           HB1      RCY  50  78.848   5.452  10.156
  405    HB2  RCY  50           HB2      RCY  50  80.305   5.622   9.179
  406    HA   RCY  50           HA       RCY  50  80.836   4.445  11.257
  407    HN1  RCY  50           HN1      RCY  50  79.456   5.167  13.037
  408    H    GLY  51           HN       GLY  51  82.784   5.062  12.645
  409    HA2  GLY  51           HA2      GLY  51  84.868   6.124  12.886
  410    HA3  GLY  51           HA1      GLY  51  84.822   6.205  11.125
  411    H    ASP  52           HN       ASP  52  82.205   7.845  12.511
  412    HA   ASP  52           HA       ASP  52  81.677  10.140  12.431
  413    HB2  ASP  52           HB2      ASP  52  84.357  10.115  13.846
  414    HB3  ASP  52           HB1      ASP  52  83.325  11.542  13.742
  415    H    ASP  53           HN       ASP  53  83.536   8.917  10.244
  416    HA   ASP  53           HA       ASP  53  85.080  11.257   9.375
  417    HB2  ASP  53           HB2      ASP  53  85.618   9.853   7.404
  418    HB3  ASP  53           HB1      ASP  53  85.930   8.997   8.914
  419    H    ILE  54           HN       ILE  54  84.700  12.170   7.153
  420    HA   ILE  54           HA       ILE  54  81.933  11.940   6.136
  421    HB   ILE  54           HB       ILE  54  81.924  14.574   6.148
  422   HG12  ILE  54          HG12      ILE  54  83.604  14.023   8.606
  423   HG13  ILE  54          HG11      ILE  54  84.302  14.584   7.086
  424   HG21  ILE  54          HG21      ILE  54  80.715  14.538   8.270
  425   HG22  ILE  54          HG22      ILE  54  81.479  13.010   8.709
  426   HG23  ILE  54          HG23      ILE  54  80.341  13.072   7.363
  427   HD11  ILE  54          HD11      ILE  54  83.662  16.376   8.841
  428   HD12  ILE  54          HD12      ILE  54  81.995  16.040   8.372
  429   HD13  ILE  54          HD13      ILE  54  83.144  16.641   7.176
  430    HA   PRO  55           HA       PRO  55  85.111  12.662   2.865
  431    HB2  PRO  55           HB2      PRO  55  84.419  10.593   1.249
  432    HB3  PRO  55           HB1      PRO  55  85.470  10.383   2.663
  433    HG2  PRO  55           HG2      PRO  55  82.594   9.727   2.334
  434    HG3  PRO  55           HG1      PRO  55  83.853   8.875   3.242
  435    HD2  PRO  55           HD2      PRO  55  81.952  10.579   4.369
  436    HD3  PRO  55           HD1      PRO  55  83.486  10.115   5.136
  437    H    GLY  56           HN       GLY  56  81.736  11.636   2.232
  438    HA2  GLY  56           HA2      GLY  56  81.600  13.196  -0.230
  439    HA3  GLY  56           HA1      GLY  56  80.251  12.357   0.539
  440    H    MET  57           HN       MET  57  81.960  14.321   2.722
  441    HA   MET  57           HA       MET  57  81.238  16.228   3.900
  442    HB2  MET  57           HB2      MET  57  80.497  17.268   1.157
  443    HB3  MET  57           HB1      MET  57  81.057  18.191   2.552
  444    HG2  MET  57           HG2      MET  57  82.675  16.202   0.934
  445    HG3  MET  57           HG1      MET  57  82.906  17.950   0.991
  446    HE1  MET  57           HE1      MET  57  85.194  15.329   2.005
  447    HE2  MET  57           HE2      MET  57  86.041  16.729   2.656
  448    HE3  MET  57           HE3      MET  57  85.172  16.866   1.130
  449    H    GLU  58           HN       GLU  58  79.183  14.098   3.045
  450    HA   GLU  58           HA       GLU  58  76.843  13.833   3.071
  451    HB2  GLU  58           HB2      GLU  58  77.554  14.743   5.424
  452    HB3  GLU  58           HB1      GLU  58  76.770  16.231   4.894
  453    HG2  GLU  58           HG2      GLU  58  74.745  14.791   4.298
  454    HG3  GLU  58           HG1      GLU  58  75.531  13.488   5.190
  455    H    GLY  59           HN       GLY  59  76.306  14.475   0.934
  456    HA2  GLY  59           HA2      GLY  59  74.790  16.973   0.766
  457    HA3  GLY  59           HA1      GLY  59  76.230  16.947  -0.252
  458    H1U  RCY  60           H1U      RCY  60  77.067   7.000  -0.981
  459    H1S  RCY  60           H1S      RCY  60  74.397  10.622  -1.946
  460    HB1  RCY  60           HB1      RCY  60  72.781  12.182  -2.228
  461    HB2  RCY  60           HB2      RCY  60  73.239  12.295  -0.528
  462    HA   RCY  60           HA       RCY  60  72.892  14.633  -2.431
  463    HN1  RCY  60           HN1      RCY  60  73.273  15.083   0.448
  464    H    GLY  61           HN       GLY  61  71.832  13.771   0.853
  465    HA2  GLY  61           HA2      GLY  61  69.147  14.745   0.350
  466    HA3  GLY  61           HA1      GLY  61  69.206  12.981   0.391
  467    H    THR  62           HN       THR  62  71.379  12.871   2.324
  468    HA   THR  62           HA       THR  62  71.708  12.857   4.637
  469    HB   THR  62           HB       THR  62  69.699  15.068   4.949
  470    HG1  THR  62           HG1      THR  62  72.341  15.379   3.975
  471   HG21  THR  62          HG21      THR  62  71.398  15.850   6.578
  472   HG22  THR  62          HG22      THR  62  72.415  14.473   6.156
  473   HG23  THR  62          HG23      THR  62  70.854  14.210   6.933
  474    H    ASP  63           HN       ASP  63  68.293  13.870   4.368
  475    HA   ASP  63           HA       ASP  63  67.293  12.336   6.470
  476    HB2  ASP  63           HB2      ASP  63  65.959  12.961   3.819
  477    HB3  ASP  63           HB1      ASP  63  65.115  12.376   5.253
  478    H    ILE  64           HN       ILE  64  68.066  10.232   6.675
  479    HA   ILE  64           HA       ILE  64  68.092   7.924   6.307
  480    HB   ILE  64           HB       ILE  64  66.132   8.475   4.071
  481   HG12  ILE  64          HG12      ILE  64  65.502   7.962   6.992
  482   HG13  ILE  64          HG11      ILE  64  65.509   9.572   6.270
  483   HG21  ILE  64          HG21      ILE  64  65.310   6.200   4.778
  484   HG22  ILE  64          HG22      ILE  64  66.705   6.089   5.851
  485   HG23  ILE  64          HG23      ILE  64  66.940   6.193   4.106
  486   HD11  ILE  64          HD11      ILE  64  63.229   8.664   6.273
  487   HD12  ILE  64          HD12      ILE  64  63.781   7.237   5.396
  488   HD13  ILE  64          HD13      ILE  64  63.817   8.819   4.617
  489    H    THR  65           HN       THR  65  68.231   9.920   3.396
  490    HA   THR  65           HA       THR  65  69.314   8.135   1.556
  491    HB   THR  65           HB       THR  65  70.152  11.023   1.937
  492    HG1  THR  65           HG1      THR  65  68.158  10.007   0.221
  493   HG21  THR  65          HG21      THR  65  70.455  10.843  -0.580
  494   HG22  THR  65          HG22      THR  65  70.298   9.097  -0.391
  495   HG23  THR  65          HG23      THR  65  71.631   9.952   0.385
  496    H    VAL  66           HN       VAL  66  71.438  10.426   3.310
  497    HA   VAL  66           HA       VAL  66  73.797   8.949   2.772
  498    HB   VAL  66           HB       VAL  66  74.890  10.338   4.423
  499   HG11  VAL  66          HG11      VAL  66  73.862  12.609   3.795
  500   HG12  VAL  66          HG12      VAL  66  72.667  11.687   2.883
  501   HG13  VAL  66          HG13      VAL  66  74.375  11.578   2.458
  502   HG21  VAL  66          HG21      VAL  66  72.070  10.706   5.442
  503   HG22  VAL  66          HG22      VAL  66  73.346  11.858   5.837
  504   HG23  VAL  66          HG23      VAL  66  73.495  10.172   6.333
  505    H    ILE  67           HN       ILE  67  71.822   8.957   5.782
  506    HA   ILE  67           HA       ILE  67  72.915   6.222   6.286
  507    HB   ILE  67           HB       ILE  67  72.776   8.469   8.312
  508   HG12  ILE  67          HG12      ILE  67  75.119   6.736   7.485
  509   HG13  ILE  67          HG11      ILE  67  74.772   8.294   6.734
  510   HG21  ILE  67          HG21      ILE  67  73.758   6.625   9.818
  511   HG22  ILE  67          HG22      ILE  67  73.161   5.487   8.610
  512   HG23  ILE  67          HG23      ILE  67  72.031   6.532   9.470
  513   HD11  ILE  67          HD11      ILE  67  75.033   7.998   9.728
  514   HD12  ILE  67          HD12      ILE  67  75.117   9.474   8.766
  515   HD13  ILE  67          HD13      ILE  67  76.433   8.301   8.699
  516    H1U  RCY  68           H1U      RCY  68  73.248   2.232   1.302
  517    H1S  RCY  68           H1S      RCY  68  70.207   3.658   3.541
  518    HB1  RCY  68           HB1      RCY  68  68.509   4.938   5.033
  519    HB2  RCY  68           HB2      RCY  68  67.600   3.991   6.209
  520    HA   RCY  68           HA       RCY  68  68.569   6.044   7.212
  521    HN1  RCY  68           HN1      RCY  68  71.128   4.986   6.163
  522    HA   PRO  69           HA       PRO  69  69.211   4.043  11.091
  523    HB2  PRO  69           HB2      PRO  69  66.570   3.760  11.877
  524    HB3  PRO  69           HB1      PRO  69  67.515   5.253  12.018
  525    HG2  PRO  69           HG2      PRO  69  65.497   4.477   9.986
  526    HG3  PRO  69           HG1      PRO  69  65.838   6.063  10.694
  527    HD2  PRO  69           HD2      PRO  69  66.664   5.344   8.183
  528    HD3  PRO  69           HD1      PRO  69  67.538   6.519   9.191
  529    H    TRP  70           HN       TRP  70  67.165   2.470   8.680
  530    HA   TRP  70           HA       TRP  70  67.003   0.009  10.258
  531    HD1  TRP  70           HD1      TRP  70  65.229   2.777   8.649
  532    HE1  TRP  70           HE1      TRP  70  65.196   4.154   6.471
  533    HE3  TRP  70           HE3      TRP  70  66.872  -0.756   5.348
  534    HZ2  TRP  70           HZ2      TRP  70  65.790   3.804   3.691
  535    HZ3  TRP  70           HZ3      TRP  70  67.129  -0.210   2.948
  536    HH2  TRP  70           HH2      TRP  70  66.592   2.061   2.114
  537    HB2  TRP  70           HB2      TRP  70  66.323  -0.837   7.774
  538    HB3  TRP  70           HB1      TRP  70  65.190  -0.059   8.874
  539    H    GLU  71           HN       GLU  71  69.558   1.424   8.699
  540    HA   GLU  71           HA       GLU  71  70.871  -1.234   8.407
  541    HB2  GLU  71           HB2      GLU  71  71.199   0.919   6.308
  542    HB3  GLU  71           HB1      GLU  71  71.784  -0.742   6.251
  543    HG2  GLU  71           HG2      GLU  71  68.860   0.061   6.327
  544    HG3  GLU  71           HG1      GLU  71  69.734  -0.429   4.875
  545    H    ALA  72           HN       ALA  72  71.040   0.921  10.400
  546    HA   ALA  72           HA       ALA  72  73.315   2.575  10.051
  547    HB1  ALA  72           HB1      ALA  72  71.915   2.927  11.973
  548    HB2  ALA  72           HB2      ALA  72  73.491   2.426  12.586
  549    HB3  ALA  72           HB3      ALA  72  72.159   1.271  12.529
  550    H1U  RCY  73           H1U      RCY  73  73.170   2.953   5.902
  551    H1S  RCY  73           H1S      RCY  73  75.704   1.724   9.630
  552    HB1  RCY  73           HB1      RCY  73  78.496   0.885   9.664
  553    HB2  RCY  73           HB2      RCY  73  78.457   1.021  11.420
  554    HA   RCY  73           HA       RCY  73  76.598  -0.334   9.703
  555    HN1  RCY  73           HN1      RCY  73  75.528   2.185  10.278
  556    H    ASN  74           HN       ASN  74  76.086  -2.137  10.873
  557    HA   ASN  74           HA       ASN  74  76.778  -2.129  13.767
  558    HB2  ASN  74           HB2      ASN  74  74.124  -2.963  12.573
  559    HB3  ASN  74           HB1      ASN  74  74.659  -3.492  14.168
  560   HD21  ASN  74          HD21      ASN  74  73.243  -0.858  12.412
  561   HD22  ASN  74          HD22      ASN  74  73.205   0.254  13.695
  562    H    HIS  75           HN       HIS  75  75.029  -4.604  11.935
  563    HA   HIS  75           HA       HIS  75  77.171  -6.527  12.566
  564    HD1  HIS  75           HD1      HIS  75  75.190  -8.888   9.612
  565    HD2  HIS  75           HD2      HIS  75  76.679  -9.302  13.486
  566    HE1  HIS  75           HE1      HIS  75  76.191 -11.211   9.749
  567    HE2  HIS  75           HE2      HIS  75  77.101 -11.476  12.102
  568    HB2  HIS  75           HB2      HIS  75  74.771  -7.144  12.817
  569    HB3  HIS  75           HB1      HIS  75  74.560  -6.941  11.078
  570    H1U  RCY  76           H1U      RCY  76  76.197  -4.115   4.377
  571    H1S  RCY  76           H1S      RCY  76  74.206  -5.310   7.003
  572    HB1  RCY  76           HB1      RCY  76  77.787  -4.853   6.781
  573    HB2  RCY  76           HB2      RCY  76  77.827  -3.420   7.808
  574    HA   RCY  76           HA       RCY  76  78.668  -6.228   8.426
  575    HN1  RCY  76           HN1      RCY  76  77.995  -4.513  10.742
  576    H    GLU  77           HN       GLU  77  79.863  -4.661  10.857
  577    HA   GLU  77           HA       GLU  77  81.542  -2.592   9.983
  578    HB2  GLU  77           HB2      GLU  77  81.262  -4.076  12.317
  579    HB3  GLU  77           HB1      GLU  77  82.902  -4.463  11.801
  580    HG2  GLU  77           HG2      GLU  77  81.792  -1.653  12.083
  581    HG3  GLU  77           HG1      GLU  77  82.836  -2.449  13.260
  582    H    LEU  78           HN       LEU  78  81.650  -5.956   9.186
  583    HA   LEU  78           HA       LEU  78  84.452  -5.870   8.284
  584    HG   LEU  78           HG       LEU  78  83.799  -9.171   9.665
  585    HB2  LEU  78           HB2      LEU  78  82.270  -7.954   8.250
  586    HB3  LEU  78           HB1      LEU  78  83.756  -8.188   7.332
  587   HD11  LEU  78          HD11      LEU  78  85.856  -7.005   9.580
  588   HD12  LEU  78          HD12      LEU  78  85.796  -8.135   8.228
  589   HD13  LEU  78          HD13      LEU  78  86.059  -8.733   9.866
  590   HD21  LEU  78          HD21      LEU  78  84.034  -6.286  10.545
  591   HD22  LEU  78          HD22      LEU  78  83.892  -7.721  11.560
  592   HD23  LEU  78          HD23      LEU  78  82.509  -7.169  10.614
  593    H    HIS  79           HN       HIS  79  85.043  -5.213   6.273
  594    HA   HIS  79           HA       HIS  79  82.945  -5.163   4.131
  595    HD1  HIS  79           HD1      HIS  79  81.703  -4.302   5.296
  596    HD2  HIS  79           HD2      HIS  79  83.415  -0.533   4.785
  597    HE1  HIS  79           HE1      HIS  79  79.997  -2.624   6.123
  598    HE2  HIS  79           HE2      HIS  79  81.026  -0.325   5.818
  599    HB2  HIS  79           HB2      HIS  79  85.057  -3.119   4.840
  600    HB3  HIS  79           HB1      HIS  79  84.294  -3.159   3.250
  601    H    GLU  80           HN       GLU  80  86.306  -5.690   4.998
  602    HA   GLU  80           HA       GLU  80  88.137  -6.364   3.632
  603    HB2  GLU  80           HB2      GLU  80  87.714  -8.716   2.863
  604    HB3  GLU  80           HB1      GLU  80  87.267  -8.424   4.541
  605    HG2  GLU  80           HG2      GLU  80  85.235  -8.112   2.335
  606    HG3  GLU  80           HG1      GLU  80  85.575  -9.698   3.029
  607    H    LEU  81           HN       LEU  81  87.825  -8.113   1.271
  608    HA   LEU  81           HA       LEU  81  87.328  -5.951  -0.712
  609    HG   LEU  81           HG       LEU  81  90.746  -7.176  -1.176
  610    HB2  LEU  81           HB2      LEU  81  88.862  -8.555  -0.788
  611    HB3  LEU  81           HB1      LEU  81  88.450  -7.698  -2.270
  612   HD11  LEU  81          HD11      LEU  81  90.146  -5.747  -2.923
  613   HD12  LEU  81          HD12      LEU  81  90.261  -4.620  -1.571
  614   HD13  LEU  81          HD13      LEU  81  88.683  -5.198  -2.105
  615   HD21  LEU  81          HD21      LEU  81  90.746  -5.640   0.661
  616   HD22  LEU  81          HD22      LEU  81  89.646  -6.940   1.120
  617   HD23  LEU  81          HD23      LEU  81  89.003  -5.400   0.549
  618    H    ALA  82           HN       ALA  82  85.203  -7.627   0.640
  619    HA   ALA  82           HA       ALA  82  84.130  -9.561  -1.126
  620    HB1  ALA  82           HB1      ALA  82  82.975  -7.734   0.954
  621    HB2  ALA  82           HB2      ALA  82  83.030  -9.496   0.922
  622    HB3  ALA  82           HB3      ALA  82  81.873  -8.633  -0.091
  623    H    GLN  83           HN       GLN  83  83.160  -9.386  -3.104
  624    HA   GLN  83           HA       GLN  83  81.626  -7.097  -3.933
  625    HB2  GLN  83           HB2      GLN  83  84.280  -6.535  -4.071
  626    HB3  GLN  83           HB1      GLN  83  84.051  -7.277  -5.652
  627    HG2  GLN  83           HG2      GLN  83  83.554  -5.030  -6.091
  628    HG3  GLN  83           HG1      GLN  83  81.954  -5.712  -5.796
  629   HE21  GLN  83          HE21      GLN  83  81.080  -3.690  -4.967
  630   HE22  GLN  83          HE22      GLN  83  81.562  -3.060  -3.467
  631    H    TYR  84           HN       TYR  84  81.555  -7.259  -6.580
  632    HA   TYR  84           HA       TYR  84  81.021  -8.582  -8.440
  633    HD1  TYR  84           HD2      TYR  84  83.497  -9.309  -9.918
  634    HD2  TYR  84           HD1      TYR  84  80.670 -12.306  -8.703
  635    HE1  TYR  84           HE2      TYR  84  83.364 -10.130 -12.254
  636    HE2  TYR  84           HE1      TYR  84  80.537 -13.127 -11.039
  637    HH   TYR  84           HH       TYR  84  80.962 -12.034 -13.397
  638    HB2  TYR  84           HB2      TYR  84  83.161  -9.859  -7.551
  639    HB3  TYR  84           HB1      TYR  84  81.979 -11.072  -7.058
  640    H    GLY  85           HN       GLY  85  80.144  -9.646  -5.208
  641    HA2  GLY  85           HA2      GLY  85  77.438 -10.246  -6.206
  642    HA3  GLY  85           HA1      GLY  85  78.294 -11.613  -5.494
  643    H    ILE  86           HN       ILE  86  79.390 -10.919  -3.276
  644    HA   ILE  86           HA       ILE  86  77.502 -10.627  -1.308
  645    HB   ILE  86           HB       ILE  86  80.352  -9.628  -1.407
  646   HG12  ILE  86          HG12      ILE  86  79.046 -11.869   0.164
  647   HG13  ILE  86          HG11      ILE  86  79.814 -12.095  -1.408
  648   HG21  ILE  86          HG21      ILE  86  78.300  -9.378   0.781
  649   HG22  ILE  86          HG22      ILE  86  79.485  -8.193   0.234
  650   HG23  ILE  86          HG23      ILE  86  80.004  -9.585   1.184
  651   HD11  ILE  86          HD11      ILE  86  81.317 -12.602   0.555
  652   HD12  ILE  86          HD12      ILE  86  81.228 -10.894   0.987
  653   HD13  ILE  86          HD13      ILE  86  81.953 -11.380  -0.546
  654    H1U  RCY  87           H1U      RCY  87  78.612   1.101  -0.412
  655    H1S  RCY  87           H1S      RCY  87  80.755  -2.981   0.609
  656    HB1  RCY  87           HB1      RCY  87  79.175  -4.362  -2.474
  657    HB2  RCY  87           HB2      RCY  87  80.202  -5.744  -2.092
  658    HA   RCY  87           HA       RCY  87  77.405  -5.990  -1.160
  659    HN1  RCY  87           HN1      RCY  87  79.510  -7.774  -2.104
  Start of MODEL   22
    1    HA   MET   1           HA       MET   1  49.762 -13.836   0.401
    2    HB2  MET   1           HB2      MET   1  52.029 -12.861  -1.355
    3    HB3  MET   1           HB1      MET   1  50.905 -14.179  -1.685
    4    HG2  MET   1           HG2      MET   1  50.057 -12.374  -2.957
    5    HG3  MET   1           HG1      MET   1  49.051 -12.387  -1.508
    6    HE1  MET   1           HE1      MET   1  48.830 -10.212  -3.137
    7    HE2  MET   1           HE2      MET   1  49.400  -8.675  -2.490
    8    HE3  MET   1           HE3      MET   1  48.323  -9.684  -1.527
    9    H    ASN   2           HN       ASN   2  53.065 -12.539   0.822
   10    HA   ASN   2           HA       ASN   2  53.703 -14.724   2.659
   11    HB2  ASN   2           HB2      ASN   2  55.696 -15.455   1.280
   12    HB3  ASN   2           HB1      ASN   2  54.132 -15.912   0.604
   13   HD21  ASN   2          HD21      ASN   2  56.871 -15.201  -0.693
   14   HD22  ASN   2          HD22      ASN   2  56.460 -14.058  -1.878
   15    H    LEU   3           HN       LEU   3  54.571 -11.809   0.932
   16    HA   LEU   3           HA       LEU   3  56.107 -10.884   3.239
   17    HG   LEU   3           HG       LEU   3  59.538 -10.750   2.129
   18    HB2  LEU   3           HB2      LEU   3  57.638 -12.327   1.632
   19    HB3  LEU   3           HB1      LEU   3  57.626 -10.871   0.643
   20   HD11  LEU   3          HD11      LEU   3  59.126  -8.633   3.140
   21   HD12  LEU   3          HD12      LEU   3  57.416  -8.996   3.377
   22   HD13  LEU   3          HD13      LEU   3  58.038  -8.701   1.753
   23   HD21  LEU   3          HD21      LEU   3  58.120 -12.298   3.829
   24   HD22  LEU   3          HD22      LEU   3  57.868 -10.729   4.593
   25   HD23  LEU   3          HD23      LEU   3  59.505 -11.339   4.350
   26    H    GLU   4           HN       GLU   4  54.566  -9.180   3.224
   27    HA   GLU   4           HA       GLU   4  54.290  -7.534   0.797
   28    HB2  GLU   4           HB2      GLU   4  52.359  -8.044   2.339
   29    HB3  GLU   4           HB1      GLU   4  53.143  -7.034   3.554
   30    HG2  GLU   4           HG2      GLU   4  52.962  -5.082   2.191
   31    HG3  GLU   4           HG1      GLU   4  52.528  -6.030   0.768
   32    HA   PRO   5           HA       PRO   5  57.965  -5.142   1.927
   33    HB2  PRO   5           HB2      PRO   5  56.440  -3.130   0.301
   34    HB3  PRO   5           HB1      PRO   5  58.157  -3.571   0.220
   35    HG2  PRO   5           HG2      PRO   5  56.398  -4.470  -1.569
   36    HG3  PRO   5           HG1      PRO   5  57.747  -5.470  -1.008
   37    HD2  PRO   5           HD2      PRO   5  54.849  -5.726  -0.402
   38    HD3  PRO   5           HD1      PRO   5  56.122  -6.966  -0.375
   39    HA   PRO   6           HA       PRO   6  56.479  -2.693   5.312
   40    HB2  PRO   6           HB2      PRO   6  58.458  -0.788   5.496
   41    HB3  PRO   6           HB1      PRO   6  58.648  -2.463   6.050
   42    HG2  PRO   6           HG2      PRO   6  59.586  -1.191   3.531
   43    HG3  PRO   6           HG1      PRO   6  60.389  -2.388   4.561
   44    HD2  PRO   6           HD2      PRO   6  59.141  -3.058   2.224
   45    HD3  PRO   6           HD1      PRO   6  59.257  -4.171   3.605
   46    H    LYS   7           HN       LYS   7  55.712  -0.485   5.890
   47    HA   LYS   7           HA       LYS   7  54.404   0.802   3.652
   48    HB2  LYS   7           HB2      LYS   7  53.858   2.548   5.496
   49    HB3  LYS   7           HB1      LYS   7  53.212   0.918   5.688
   50    HG2  LYS   7           HG2      LYS   7  54.867   0.332   7.287
   51    HG3  LYS   7           HG1      LYS   7  55.870   1.723   6.875
   52    HD2  LYS   7           HD2      LYS   7  54.378   3.248   7.915
   53    HD3  LYS   7           HD1      LYS   7  53.080   2.054   7.984
   54    HE2  LYS   7           HE2      LYS   7  54.130   2.358  10.201
   55    HE3  LYS   7           HE1      LYS   7  54.380   0.720   9.596
   56    HZ1  LYS   7           HZ1      LYS   7  56.578   1.246   8.954
   57    HZ2  LYS   7           HZ2      LYS   7  56.393   1.828  10.539
   58    HZ3  LYS   7           HZ3      LYS   7  56.349   2.905   9.225
   59    H    ALA   8           HN       ALA   8  57.215   0.802   3.248
   60    HA   ALA   8           HA       ALA   8  58.966   2.256   2.672
   61    HB1  ALA   8           HB1      ALA   8  56.835   4.405   2.666
   62    HB2  ALA   8           HB2      ALA   8  56.992   3.222   1.368
   63    HB3  ALA   8           HB3      ALA   8  58.311   4.343   1.702
   64    H    GLU   9           HN       GLU   9  59.456   4.918   3.316
   65    HA   GLU   9           HA       GLU   9  58.963   5.392   6.150
   66    HB2  GLU   9           HB2      GLU   9  60.830   3.607   5.998
   67    HB3  GLU   9           HB1      GLU   9  61.844   4.911   5.380
   68    HG2  GLU   9           HG2      GLU   9  61.473   6.223   7.392
   69    HG3  GLU   9           HG1      GLU   9  60.317   5.036   7.996
   70    H1U  RCY  10           H1U      RCY  10  63.533  13.260   4.184
   71    H1S  RCY  10           H1S      RCY  10  61.399   9.123   2.796
   72    HB1  RCY  10           HB1      RCY  10  59.106  10.842   4.831
   73    HB2  RCY  10           HB2      RCY  10  58.145   9.401   5.164
   74    HA   RCY  10           HA       RCY  10  61.127   9.165   4.854
   75    HN1  RCY  10           HN1      RCY  10  59.588   7.529   6.745
   76    H    ARG  11           HN       ARG  11  58.592  10.193   7.124
   77    HA   ARG  11           HA       ARG  11  58.765  11.579   9.016
   78    HE   ARG  11           HE       ARG  11  56.970  11.061   9.376
   79    HB2  ARG  11           HB2      ARG  11  61.191   9.799   9.404
   80    HB3  ARG  11           HB1      ARG  11  60.523  10.858  10.645
   81    HG2  ARG  11           HG2      ARG  11  58.961   8.665   9.252
   82    HG3  ARG  11           HG1      ARG  11  59.712   8.497  10.839
   83    HD2  ARG  11           HD2      ARG  11  57.622   9.176  11.522
   84    HD3  ARG  11           HD1      ARG  11  58.350  10.764  11.282
   85   HH11  ARG  11          HH21      ARG  11  56.992   7.810  10.521
   86   HH12  ARG  11          HH22      ARG  11  55.694   7.299   9.495
   87   HH21  ARG  11          HH11      ARG  11  55.273  10.413   8.030
   88   HH22  ARG  11          HH12      ARG  11  54.721   8.773   8.085
   89    H    SER  12           HN       SER  12  60.602  12.002   6.443
   90    HA   SER  12           HA       SER  12  62.312  14.121   7.700
   91    HG   SER  12           HG       SER  12  63.341  12.200   4.280
   92    HB2  SER  12           HB2      SER  12  63.861  13.845   5.873
   93    HB3  SER  12           HB1      SER  12  63.522  12.241   6.518
   94    H    ALA  13           HN       ALA  13  60.528  13.328   4.697
   95    HA   ALA  13           HA       ALA  13  59.432  14.741   3.177
   96    HB1  ALA  13           HB1      ALA  13  58.268  16.728   4.351
   97    HB2  ALA  13           HB2      ALA  13  58.932  16.065   5.844
   98    HB3  ALA  13           HB3      ALA  13  57.819  15.104   4.871
   99    H    THR  14           HN       THR  14  60.354  17.422   5.279
  100    HA   THR  14           HA       THR  14  62.411  18.256   3.277
  101    HB   THR  14           HB       THR  14  60.401  20.161   4.501
  102    HG1  THR  14           HG1      THR  14  59.248  19.974   2.648
  103   HG21  THR  14          HG21      THR  14  61.220  21.687   2.797
  104   HG22  THR  14          HG22      THR  14  62.229  20.420   2.098
  105   HG23  THR  14          HG23      THR  14  62.597  21.057   3.701
  106    H    ARG  15           HN       ARG  15  63.690  17.290   5.163
  107    HA   ARG  15           HA       ARG  15  64.704  19.465   6.796
  108    HE   ARG  15           HE       ARG  15  63.401  20.668  11.697
  109    HB2  ARG  15           HB2      ARG  15  62.572  18.584   7.991
  110    HB3  ARG  15           HB1      ARG  15  63.541  17.157   8.358
  111    HG2  ARG  15           HG2      ARG  15  65.207  18.521   9.494
  112    HG3  ARG  15           HG1      ARG  15  64.364  19.998   9.028
  113    HD2  ARG  15           HD2      ARG  15  62.340  19.093  10.280
  114    HD3  ARG  15           HD1      ARG  15  63.405  17.845  10.926
  115   HH11  ARG  15          HH21      ARG  15  65.143  17.703  11.459
  116   HH12  ARG  15          HH22      ARG  15  66.257  18.101  12.724
  117   HH21  ARG  15          HH11      ARG  15  64.845  21.206  13.350
  118   HH22  ARG  15          HH12      ARG  15  66.088  20.085  13.795
  119    H    VAL  16           HN       VAL  16  65.138  16.755   5.080
  120    HA   VAL  16           HA       VAL  16  67.005  15.247   6.670
  121    HB   VAL  16           HB       VAL  16  65.981  14.214   4.725
  122   HG11  VAL  16          HG11      VAL  16  67.531  15.972   2.859
  123   HG12  VAL  16          HG12      VAL  16  66.019  16.582   3.531
  124   HG13  VAL  16          HG13      VAL  16  66.025  15.097   2.579
  125   HG21  VAL  16          HG21      VAL  16  68.878  14.679   3.989
  126   HG22  VAL  16          HG22      VAL  16  67.917  13.219   3.753
  127   HG23  VAL  16          HG23      VAL  16  68.414  13.695   5.377
  128    H    MET  17           HN       MET  17  68.509  16.692   7.587
  129    HA   MET  17           HA       MET  17  70.818  17.298   5.981
  130    HB2  MET  17           HB2      MET  17  69.022  19.138   5.416
  131    HB3  MET  17           HB1      MET  17  69.476  19.800   6.985
  132    HG2  MET  17           HG2      MET  17  71.397  19.187   4.719
  133    HG3  MET  17           HG1      MET  17  70.832  20.795   5.173
  134    HE1  MET  17           HE1      MET  17  74.678  20.110   6.205
  135    HE2  MET  17           HE2      MET  17  73.663  21.134   5.191
  136    HE3  MET  17           HE3      MET  17  73.732  19.399   4.891
  137    H    GLY  18           HN       GLY  18  71.275  15.931   7.998
  138    HA2  GLY  18           HA2      GLY  18  72.705  16.039   9.920
  139    HA3  GLY  18           HA1      GLY  18  72.272  17.738  10.118
  140    H    GLY  19           HN       GLY  19  71.026  18.104  11.869
  141    HA2  GLY  19           HA2      GLY  19  69.757  17.516  13.797
  142    HA3  GLY  19           HA1      GLY  19  68.556  17.226  12.541
  143    HA   PRO  20           HA       PRO  20  67.919  13.034  13.788
  144    HB2  PRO  20           HB2      PRO  20  68.560  12.474  10.905
  145    HB3  PRO  20           HB1      PRO  20  67.234  11.845  11.903
  146    HG2  PRO  20           HG2      PRO  20  66.893  13.851  10.146
  147    HG3  PRO  20           HG1      PRO  20  65.971  13.733  11.652
  148    HD2  PRO  20           HD2      PRO  20  68.041  15.685  10.907
  149    HD3  PRO  20           HD1      PRO  20  66.863  15.752  12.236
  150    H1U  RCY  21           H1U      RCY  21  68.135   8.619   6.630
  151    H1S  RCY  21           H1S      RCY  21  72.130  10.776   7.705
  152    HB1  RCY  21           HB1      RCY  21  71.509  10.526  11.357
  153    HB2  RCY  21           HB2      RCY  21  73.263  10.643  11.492
  154    HA   RCY  21           HA       RCY  21  72.341  11.903  13.321
  155    HN1  RCY  21           HN1      RCY  21  70.635  13.542  11.509
  156    H    THR  22           HN       THR  22  74.007  13.192  13.900
  157    HA   THR  22           HA       THR  22  74.694  15.550  12.316
  158    HB   THR  22           HB       THR  22  74.901  15.984  14.597
  159    HG1  THR  22           HG1      THR  22  77.246  15.844  15.018
  160   HG21  THR  22          HG21      THR  22  76.140  14.332  16.113
  161   HG22  THR  22          HG22      THR  22  76.042  13.192  14.770
  162   HG23  THR  22          HG23      THR  22  74.566  13.813  15.510
  163    HA   PRO  23           HA       PRO  23  77.556  13.408   9.576
  164    HB2  PRO  23           HB2      PRO  23  78.903  16.087   9.791
  165    HB3  PRO  23           HB1      PRO  23  78.570  15.108   8.348
  166    HG2  PRO  23           HG2      PRO  23  77.061  17.204   8.970
  167    HG3  PRO  23           HG1      PRO  23  76.353  15.734   8.279
  168    HD2  PRO  23           HD2      PRO  23  76.174  16.771  11.063
  169    HD3  PRO  23           HD1      PRO  23  75.045  15.727  10.173
  170    H    ARG  24           HN       ARG  24  80.268  15.110  10.097
  171    HA   ARG  24           HA       ARG  24  82.282  14.556  11.176
  172    HE   ARG  24           HE       ARG  24  83.410  16.603  11.384
  173    HB2  ARG  24           HB2      ARG  24  80.341  14.158  13.476
  174    HB3  ARG  24           HB1      ARG  24  82.087  14.330  13.640
  175    HG2  ARG  24           HG2      ARG  24  80.709  16.448  12.076
  176    HG3  ARG  24           HG1      ARG  24  80.388  16.429  13.810
  177    HD2  ARG  24           HD2      ARG  24  82.356  17.847  13.211
  178    HD3  ARG  24           HD1      ARG  24  82.775  16.523  14.298
  179   HH11  ARG  24          HH21      ARG  24  83.688  15.285  14.558
  180   HH12  ARG  24          HH22      ARG  24  85.036  14.272  14.163
  181   HH21  ARG  24          HH11      ARG  24  85.169  15.286  10.850
  182   HH22  ARG  24          HH12      ARG  24  85.874  14.272  12.064
  183    H    LYS  25           HN       LYS  25  81.924  12.515   9.679
  184    HA   LYS  25           HA       LYS  25  81.093  10.025  10.687
  185    HB2  LYS  25           HB2      LYS  25  83.553  10.213   8.965
  186    HB3  LYS  25           HB1      LYS  25  82.229   9.052   8.888
  187    HG2  LYS  25           HG2      LYS  25  81.576  10.363   7.124
  188    HG3  LYS  25           HG1      LYS  25  80.852  11.329   8.410
  189    HD2  LYS  25           HD2      LYS  25  82.070  12.955   7.277
  190    HD3  LYS  25           HD1      LYS  25  83.242  12.449   8.495
  191    HE2  LYS  25           HE2      LYS  25  84.124  10.778   6.802
  192    HE3  LYS  25           HE1      LYS  25  83.103  11.570   5.601
  193    HZ1  LYS  25           HZ1      LYS  25  85.450  12.621   7.027
  194    HZ2  LYS  25           HZ2      LYS  25  84.256  13.698   6.478
  195    HZ3  LYS  25           HZ3      LYS  25  85.074  12.698   5.374
  196    H    GLY  26           HN       GLY  26  81.969   8.580  12.124
  197    HA2  GLY  26           HA2      GLY  26  84.634   8.107  12.749
  198    HA3  GLY  26           HA1      GLY  26  84.173   9.444  13.804
  199    HA   PRO  27           HA       PRO  27  81.932   7.072  16.754
  200    HB2  PRO  27           HB2      PRO  27  79.291   7.737  15.514
  201    HB3  PRO  27           HB1      PRO  27  79.820   7.908  17.199
  202    HG2  PRO  27           HG2      PRO  27  79.631  10.011  15.577
  203    HG3  PRO  27           HG1      PRO  27  80.910   9.889  16.797
  204    HD2  PRO  27           HD2      PRO  27  81.100   9.586  13.837
  205    HD3  PRO  27           HD1      PRO  27  82.326  10.144  14.997
  206    HA   PRO  28           HA       PRO  28  81.698   3.140  14.507
  207    HB2  PRO  28           HB2      PRO  28  80.485   2.352  17.136
  208    HB3  PRO  28           HB1      PRO  28  81.730   1.525  16.178
  209    HG2  PRO  28           HG2      PRO  28  82.352   2.961  18.338
  210    HG3  PRO  28           HG1      PRO  28  83.407   2.915  16.916
  211    HD2  PRO  28           HD2      PRO  28  81.686   5.130  17.900
  212    HD3  PRO  28           HD1      PRO  28  83.151   5.199  16.898
  213    H    LYS  29           HN       LYS  29  80.066   2.501  13.157
  214    HA   LYS  29           HA       LYS  29  77.344   2.124  14.049
  215    HB2  LYS  29           HB2      LYS  29  77.564   4.669  13.833
  216    HB3  LYS  29           HB1      LYS  29  77.733   4.403  12.099
  217    HG2  LYS  29           HG2      LYS  29  75.517   2.851  12.849
  218    HG3  LYS  29           HG1      LYS  29  75.325   4.370  13.727
  219    HD2  LYS  29           HD2      LYS  29  75.966   4.257  10.771
  220    HD3  LYS  29           HD1      LYS  29  74.316   4.330  11.390
  221    HE2  LYS  29           HE2      LYS  29  74.921   6.416  12.629
  222    HE3  LYS  29           HE1      LYS  29  76.511   6.366  11.868
  223    HZ1  LYS  29           HZ1      LYS  29  74.495   6.067   9.915
  224    HZ2  LYS  29           HZ2      LYS  29  75.679   7.278  10.050
  225    HZ3  LYS  29           HZ3      LYS  29  74.184   7.457  10.837
  226    H1U  RCY  30           H1U      RCY  30  76.433   1.299   3.808
  227    H1S  RCY  30           H1S      RCY  30  77.569   1.359   7.840
  228    HB1  RCY  30           HB1      RCY  30  79.486   0.783   8.261
  229    HB2  RCY  30           HB2      RCY  30  80.644   1.533   9.358
  230    HA   RCY  30           HA       RCY  30  78.070   0.118  10.099
  231    HN1  RCY  30           HN1      RCY  30  79.838   1.436  12.102
  232    H    LYS  31           HN       LYS  31  80.475  -0.127  12.379
  233    HA   LYS  31           HA       LYS  31  81.414  -2.708  11.221
  234    HB2  LYS  31           HB2      LYS  31  83.003  -0.456  11.551
  235    HB3  LYS  31           HB1      LYS  31  83.319  -1.361  13.028
  236    HG2  LYS  31           HG2      LYS  31  83.618  -2.354  10.181
  237    HG3  LYS  31           HG1      LYS  31  84.903  -2.109  11.363
  238    HD2  LYS  31           HD2      LYS  31  83.214  -3.784  12.729
  239    HD3  LYS  31           HD1      LYS  31  83.023  -4.361  11.073
  240    HE2  LYS  31           HE2      LYS  31  84.863  -5.593  11.937
  241    HE3  LYS  31           HE1      LYS  31  85.589  -4.332  10.940
  242    HZ1  LYS  31           HZ1      LYS  31  85.907  -2.997  12.934
  243    HZ2  LYS  31           HZ2      LYS  31  86.696  -4.495  13.071
  244    HZ3  LYS  31           HZ3      LYS  31  85.230  -4.227  13.887
  245    H    GLN  32           HN       GLN  32  79.284  -2.912  12.747
  246    HA   GLN  32           HA       GLN  32  80.172  -4.347  15.083
  247    HB2  GLN  32           HB2      GLN  32  80.417  -2.018  15.934
  248    HB3  GLN  32           HB1      GLN  32  78.709  -1.737  15.591
  249    HG2  GLN  32           HG2      GLN  32  78.025  -3.380  17.197
  250    HG3  GLN  32           HG1      GLN  32  79.674  -3.979  17.382
  251   HE21  GLN  32          HE21      GLN  32  78.219  -0.668  17.469
  252   HE22  GLN  32          HE22      GLN  32  78.928  -0.242  18.951
  253    H    ARG  33           HN       ARG  33  77.807  -3.249  12.889
  254    HA   ARG  33           HA       ARG  33  75.428  -4.188  14.193
  255    HE   ARG  33           HE       ARG  33  74.404   0.132  12.558
  256    HB2  ARG  33           HB2      ARG  33  76.056  -3.961  11.233
  257    HB3  ARG  33           HB1      ARG  33  74.445  -4.169  11.917
  258    HG2  ARG  33           HG2      ARG  33  76.175  -1.896  12.854
  259    HG3  ARG  33           HG1      ARG  33  75.287  -1.751  11.336
  260    HD2  ARG  33           HD2      ARG  33  73.203  -2.432  12.609
  261    HD3  ARG  33           HD1      ARG  33  74.143  -2.265  14.092
  262   HH11  ARG  33          HH21      ARG  33  72.142  -1.725  14.380
  263   HH12  ARG  33          HH22      ARG  33  71.206  -0.351  14.867
  264   HH21  ARG  33          HH11      ARG  33  73.195   1.936  13.184
  265   HH22  ARG  33          HH12      ARG  33  71.802   1.721  14.190
  266    H    GLN  34           HN       GLN  34  74.694  -5.890  11.761
  267    HA   GLN  34           HA       GLN  34  76.360  -8.233  11.797
  268    HB2  GLN  34           HB2      GLN  34  74.944  -8.010  14.127
  269    HB3  GLN  34           HB1      GLN  34  73.803  -8.922  13.143
  270    HG2  GLN  34           HG2      GLN  34  76.677  -9.660  13.761
  271    HG3  GLN  34           HG1      GLN  34  75.223 -10.516  14.276
  272   HE21  GLN  34          HE21      GLN  34  77.666 -10.672  12.013
  273   HE22  GLN  34          HE22      GLN  34  76.858 -11.531  10.793
  274    H    THR  35           HN       THR  35  75.083  -6.659   9.822
  275    HA   THR  35           HA       THR  35  72.605  -7.459   8.846
  276    HB   THR  35           HB       THR  35  73.645  -5.814   7.553
  277    HG1  THR  35           HG1      THR  35  74.383  -8.005   5.965
  278   HG21  THR  35          HG21      THR  35  76.066  -7.608   7.697
  279   HG22  THR  35          HG22      THR  35  75.893  -5.953   8.281
  280   HG23  THR  35          HG23      THR  35  75.973  -6.273   6.549
  281    H    ARG  36           HN       ARG  36  75.064  -8.723   6.766
  282    HA   ARG  36           HA       ARG  36  74.799 -11.493   7.600
  283    HE   ARG  36           HE       ARG  36  71.492 -11.842   7.344
  284    HB2  ARG  36           HB2      ARG  36  72.583 -10.859   6.406
  285    HB3  ARG  36           HB1      ARG  36  73.547 -10.828   4.934
  286    HG2  ARG  36           HG2      ARG  36  72.623 -13.046   5.120
  287    HG3  ARG  36           HG1      ARG  36  74.337 -13.167   5.518
  288    HD2  ARG  36           HD2      ARG  36  72.601 -14.331   7.085
  289    HD3  ARG  36           HD1      ARG  36  73.920 -13.413   7.812
  290   HH11  ARG  36          HH21      ARG  36  73.295 -13.908   9.435
  291   HH12  ARG  36          HH22      ARG  36  72.525 -13.339  10.879
  292   HH21  ARG  36          HH11      ARG  36  70.477 -11.087   9.218
  293   HH22  ARG  36          HH12      ARG  36  70.930 -11.742  10.756
  294    H    GLN  37           HN       GLN  37  76.887  -9.535   6.900
  295    HA   GLN  37           HA       GLN  37  78.889  -9.461   5.680
  296    HB2  GLN  37           HB2      GLN  37  78.338 -12.342   4.959
  297    HB3  GLN  37           HB1      GLN  37  79.897 -11.557   5.214
  298    HG2  GLN  37           HG2      GLN  37  79.145 -11.151   7.621
  299    HG3  GLN  37           HG1      GLN  37  77.816 -12.263   7.292
  300   HE21  GLN  37          HE21      GLN  37  79.763 -13.747   5.363
  301   HE22  GLN  37          HE22      GLN  37  80.695 -14.704   6.410
  302    H1U  RCY  38           H1U      RCY  38  79.011  -2.443  -1.935
  303    H1S  RCY  38           H1S      RCY  38  78.107  -6.688   0.229
  304    HB1  RCY  38           HB1      RCY  38  80.558  -9.918   0.734
  305    HB2  RCY  38           HB2      RCY  38  80.381  -8.381   1.580
  306    HA   RCY  38           HA       RCY  38  77.827  -8.882   1.479
  307    HN1  RCY  38           HN1      RCY  38  79.794  -9.800   3.397
  308    H    LYS  39           HN       LYS  39  76.271 -10.518   1.192
  309    HA   LYS  39           HA       LYS  39  77.278 -13.097   0.047
  310    HB2  LYS  39           HB2      LYS  39  75.189 -12.453   1.998
  311    HB3  LYS  39           HB1      LYS  39  74.573 -13.443   0.676
  312    HG2  LYS  39           HG2      LYS  39  75.403 -14.944   2.376
  313    HG3  LYS  39           HG1      LYS  39  76.542 -14.989   1.030
  314    HD2  LYS  39           HD2      LYS  39  77.810 -13.124   2.298
  315    HD3  LYS  39           HD1      LYS  39  76.841 -13.603   3.693
  316    HE2  LYS  39           HE2      LYS  39  78.708 -15.374   2.090
  317    HE3  LYS  39           HE1      LYS  39  78.933 -14.835   3.754
  318    HZ1  LYS  39           HZ1      LYS  39  78.067 -17.042   3.780
  319    HZ2  LYS  39           HZ2      LYS  39  76.798 -16.623   2.731
  320    HZ3  LYS  39           HZ3      LYS  39  76.840 -15.997   4.310
  321    H    SER  40           HN       SER  40  75.602 -10.199  -0.638
  322    HA   SER  40           HA       SER  40  73.677 -10.878  -2.532
  323    HG   SER  40           HG       SER  40  74.055  -8.857  -0.907
  324    HB2  SER  40           HB2      SER  40  75.711  -8.635  -2.618
  325    HB3  SER  40           HB1      SER  40  74.343  -8.751  -3.721
  326    H    LYS  41           HN       LYS  41  73.718 -11.828  -4.534
  327    HA   LYS  41           HA       LYS  41  75.967 -13.249  -5.466
  328    HB2  LYS  41           HB2      LYS  41  74.738 -13.494  -7.580
  329    HB3  LYS  41           HB1      LYS  41  73.640 -13.684  -6.212
  330    HG2  LYS  41           HG2      LYS  41  73.189 -11.153  -6.465
  331    HG3  LYS  41           HG1      LYS  41  73.946 -11.310  -8.051
  332    HD2  LYS  41           HD2      LYS  41  71.527 -12.843  -7.054
  333    HD3  LYS  41           HD1      LYS  41  71.533 -11.583  -8.289
  334    HE2  LYS  41           HE2      LYS  41  71.554 -13.569  -9.553
  335    HE3  LYS  41           HE1      LYS  41  73.254 -13.102  -9.512
  336    HZ1  LYS  41           HZ1      LYS  41  72.304 -15.510  -8.777
  337    HZ2  LYS  41           HZ2      LYS  41  72.415 -14.719  -7.278
  338    HZ3  LYS  41           HZ3      LYS  41  73.787 -14.862  -8.269
  339    HA   PRO  42           HA       PRO  42  78.438 -10.031  -7.273
  340    HB2  PRO  42           HB2      PRO  42  79.931 -11.500  -9.028
  341    HB3  PRO  42           HB1      PRO  42  80.175 -11.560  -7.271
  342    HG2  PRO  42           HG2      PRO  42  78.724 -13.468  -9.037
  343    HG3  PRO  42           HG1      PRO  42  79.796 -13.791  -7.664
  344    HD2  PRO  42           HD2      PRO  42  77.063 -13.884  -7.473
  345    HD3  PRO  42           HD1      PRO  42  78.117 -13.471  -6.103
  346    HA   PRO  43           HA       PRO  43  76.548  -8.798 -11.090
  347    HB2  PRO  43           HB2      PRO  43  78.533  -7.317 -12.253
  348    HB3  PRO  43           HB1      PRO  43  77.610  -6.760 -10.844
  349    HG2  PRO  43           HG2      PRO  43  80.333  -7.952 -10.963
  350    HG3  PRO  43           HG1      PRO  43  79.723  -6.624  -9.961
  351    HD2  PRO  43           HD2      PRO  43  80.059  -9.177  -9.015
  352    HD3  PRO  43           HD1      PRO  43  78.847  -8.051  -8.365
  353    H    LYS  44           HN       LYS  44  76.751  -8.973 -13.507
  354    HA   LYS  44           HA       LYS  44  77.817 -11.543 -14.273
  355    HB2  LYS  44           HB2      LYS  44  77.316 -10.519 -16.658
  356    HB3  LYS  44           HB1      LYS  44  75.985 -10.935 -15.580
  357    HG2  LYS  44           HG2      LYS  44  77.146  -8.201 -15.309
  358    HG3  LYS  44           HG1      LYS  44  76.162  -8.522 -16.738
  359    HD2  LYS  44           HD2      LYS  44  75.142  -9.387 -14.055
  360    HD3  LYS  44           HD1      LYS  44  75.024  -7.685 -14.504
  361    HE2  LYS  44           HE2      LYS  44  74.034  -9.938 -16.269
  362    HE3  LYS  44           HE1      LYS  44  73.003  -9.084 -15.121
  363    HZ1  LYS  44           HZ1      LYS  44  72.689  -7.900 -17.054
  364    HZ2  LYS  44           HZ2      LYS  44  74.303  -8.069 -17.559
  365    HZ3  LYS  44           HZ3      LYS  44  73.911  -6.997 -16.300
  366    H    LYS  45           HN       LYS  45  79.045  -8.272 -14.357
  367    HA   LYS  45           HA       LYS  45  81.736  -9.173 -14.855
  368    HB2  LYS  45           HB2      LYS  45  82.062  -8.151 -17.072
  369    HB3  LYS  45           HB1      LYS  45  80.844  -9.424 -17.154
  370    HG2  LYS  45           HG2      LYS  45  79.087  -7.627 -16.843
  371    HG3  LYS  45           HG1      LYS  45  80.370  -6.435 -17.051
  372    HD2  LYS  45           HD2      LYS  45  80.869  -7.278 -19.272
  373    HD3  LYS  45           HD1      LYS  45  79.728  -8.607 -19.066
  374    HE2  LYS  45           HE2      LYS  45  78.713  -6.805 -20.398
  375    HE3  LYS  45           HE1      LYS  45  77.878  -6.977 -18.855
  376    HZ1  LYS  45           HZ1      LYS  45  79.319  -5.176 -17.994
  377    HZ2  LYS  45           HZ2      LYS  45  78.280  -4.676 -19.242
  378    HZ3  LYS  45           HZ3      LYS  45  79.926  -4.950 -19.562
  379    H    GLY  46           HN       GLY  46  80.231  -7.424 -13.039
  380    HA2  GLY  46           HA2      GLY  46  81.114  -4.695 -13.727
  381    HA3  GLY  46           HA1      GLY  46  80.191  -5.152 -12.296
  382    H    VAL  47           HN       VAL  47  82.366  -7.428 -12.100
  383    HA   VAL  47           HA       VAL  47  83.941  -6.108 -10.090
  384    HB   VAL  47           HB       VAL  47  84.667  -8.684 -11.505
  385   HG11  VAL  47          HG11      VAL  47  85.527  -9.224  -9.198
  386   HG12  VAL  47          HG12      VAL  47  85.161  -7.563  -8.732
  387   HG13  VAL  47          HG13      VAL  47  86.367  -7.884  -9.978
  388   HG21  VAL  47          HG21      VAL  47  83.307  -9.690  -9.543
  389   HG22  VAL  47          HG22      VAL  47  82.402  -9.033 -10.907
  390   HG23  VAL  47          HG23      VAL  47  82.561  -8.096  -9.422
  391    H    GLN  48           HN       GLN  48  86.121  -7.898 -11.912
  392    HA   GLN  48           HA       GLN  48  88.078  -7.243 -13.033
  393    HB2  GLN  48           HB2      GLN  48  85.978  -5.455 -14.280
  394    HB3  GLN  48           HB1      GLN  48  87.647  -5.495 -14.849
  395    HG2  GLN  48           HG2      GLN  48  87.492  -7.790 -15.466
  396    HG3  GLN  48           HG1      GLN  48  85.986  -8.004 -14.572
  397   HE21  GLN  48          HE21      GLN  48  86.027  -4.986 -16.165
  398   HE22  GLN  48          HE22      GLN  48  85.115  -5.424 -17.528
  399    H    GLY  49           HN       GLY  49  88.804  -6.382 -10.868
  400    HA2  GLY  49           HA2      GLY  49  89.892  -3.741 -11.156
  401    HA3  GLY  49           HA1      GLY  49  88.530  -3.704 -10.035
  402    H1U  RCY  50           H1U      RCY  50  85.120  -2.986  -3.319
  403    H1S  RCY  50           H1S      RCY  50  88.130  -3.364  -6.342
  404    HB1  RCY  50           HB1      RCY  50  92.198  -4.162  -7.064
  405    HB2  RCY  50           HB2      RCY  50  91.661  -4.600  -5.443
  406    HA   RCY  50           HA       RCY  50  91.164  -6.257  -7.385
  407    HN1  RCY  50           HN1      RCY  50  88.748  -4.704  -8.002
  408    H    GLY  51           HN       GLY  51  88.374  -6.859  -7.295
  409    HA2  GLY  51           HA2      GLY  51  87.405  -6.581  -4.566
  410    HA3  GLY  51           HA1      GLY  51  86.688  -7.596  -5.818
  411    H    ASP  52           HN       ASP  52  89.619  -7.462  -3.764
  412    HA   ASP  52           HA       ASP  52  89.213 -10.303  -3.074
  413    HB2  ASP  52           HB2      ASP  52  91.817  -9.368  -4.317
  414    HB3  ASP  52           HB1      ASP  52  91.419 -11.007  -3.801
  415    H    ASP  53           HN       ASP  53  89.101  -7.847  -1.558
  416    HA   ASP  53           HA       ASP  53  91.033  -8.554   0.538
  417    HB2  ASP  53           HB2      ASP  53  91.044  -5.758  -0.638
  418    HB3  ASP  53           HB1      ASP  53  92.049  -6.347   0.687
  419    H    ILE  54           HN       ILE  54  88.326  -8.826   0.680
  420    HA   ILE  54           HA       ILE  54  86.686  -6.727   1.448
  421    HB   ILE  54           HB       ILE  54  85.786  -8.472   3.199
  422   HG12  ILE  54          HG12      ILE  54  87.537 -10.264   1.501
  423   HG13  ILE  54          HG11      ILE  54  88.023  -9.714   3.105
  424   HG21  ILE  54          HG21      ILE  54  85.891  -8.947   0.207
  425   HG22  ILE  54          HG22      ILE  54  84.664  -8.043   1.094
  426   HG23  ILE  54          HG23      ILE  54  84.792  -9.790   1.299
  427   HD11  ILE  54          HD11      ILE  54  86.871 -11.969   3.069
  428   HD12  ILE  54          HD12      ILE  54  85.404 -11.133   2.560
  429   HD13  ILE  54          HD13      ILE  54  86.122 -10.777   4.131
  430    HA   PRO  55           HA       PRO  55  89.203  -5.380   4.991
  431    HB2  PRO  55           HB2      PRO  55  88.329  -2.824   5.086
  432    HB3  PRO  55           HB1      PRO  55  89.468  -3.379   3.842
  433    HG2  PRO  55           HG2      PRO  55  86.545  -2.884   3.633
  434    HG3  PRO  55           HG1      PRO  55  87.831  -2.574   2.457
  435    HD2  PRO  55           HD2      PRO  55  86.120  -4.779   2.401
  436    HD3  PRO  55           HD1      PRO  55  87.690  -4.687   1.573
  437    H    GLY  56           HN       GLY  56  85.714  -4.755   4.636
  438    HA2  GLY  56           HA2      GLY  56  85.269  -5.662   7.393
  439    HA3  GLY  56           HA1      GLY  56  84.877  -3.966   7.107
  440    H    MET  57           HN       MET  57  84.421  -6.893   5.104
  441    HA   MET  57           HA       MET  57  82.506  -7.607   3.942
  442    HB2  MET  57           HB2      MET  57  81.107  -6.601   6.437
  443    HB3  MET  57           HB1      MET  57  80.512  -7.822   5.313
  444    HG2  MET  57           HG2      MET  57  82.306  -9.336   5.910
  445    HG3  MET  57           HG1      MET  57  83.080  -8.096   6.897
  446    HE1  MET  57           HE1      MET  57  83.324  -9.821   8.474
  447    HE2  MET  57           HE2      MET  57  82.174 -11.134   8.235
  448    HE3  MET  57           HE3      MET  57  82.164 -10.228   9.746
  449    H    GLU  58           HN       GLU  58  79.900  -6.050   4.879
  450    HA   GLU  58           HA       GLU  58  80.113  -3.377   3.923
  451    HB2  GLU  58           HB2      GLU  58  80.658  -4.282   1.751
  452    HB3  GLU  58           HB1      GLU  58  79.341  -5.450   1.849
  453    HG2  GLU  58           HG2      GLU  58  77.682  -3.750   1.656
  454    HG3  GLU  58           HG1      GLU  58  78.858  -2.468   1.950
  455    H    GLY  59           HN       GLY  59  78.316  -2.435   4.787
  456    HA2  GLY  59           HA2      GLY  59  75.656  -3.098   4.349
  457    HA3  GLY  59           HA1      GLY  59  76.114  -4.070   5.747
  458    H1U  RCY  60           H1U      RCY  60  76.132   3.961   2.549
  459    H1S  RCY  60           H1S      RCY  60  75.160   3.910   7.318
  460    HB1  RCY  60           HB1      RCY  60  73.294   0.209   6.652
  461    HB2  RCY  60           HB2      RCY  60  74.930   0.541   6.087
  462    HA   RCY  60           HA       RCY  60  75.757  -0.506   8.261
  463    HN1  RCY  60           HN1      RCY  60  74.445  -2.680   6.831
  464    H    GLY  61           HN       GLY  61  72.684   0.422   8.458
  465    HA2  GLY  61           HA2      GLY  61  72.174  -1.311  10.802
  466    HA3  GLY  61           HA1      GLY  61  71.306   0.174  10.408
  467    H    THR  62           HN       THR  62  69.736   0.082   8.642
  468    HA   THR  62           HA       THR  62  68.918  -2.632   7.765
  469    HB   THR  62           HB       THR  62  66.696  -2.453   8.590
  470    HG1  THR  62           HG1      THR  62  67.265   0.154   9.516
  471   HG21  THR  62          HG21      THR  62  68.444  -2.974  10.313
  472   HG22  THR  62          HG22      THR  62  66.989  -2.239  10.986
  473   HG23  THR  62          HG23      THR  62  68.444  -1.268  10.762
  474    H    ASP  63           HN       ASP  63  69.985  -0.032   6.589
  475    HA   ASP  63           HA       ASP  63  67.839   1.136   5.045
  476    HB2  ASP  63           HB2      ASP  63  70.787   1.108   4.345
  477    HB3  ASP  63           HB1      ASP  63  69.577   2.286   3.834
  478    H    ILE  64           HN       ILE  64  67.682  -1.679   4.885
  479    HA   ILE  64           HA       ILE  64  67.394  -3.375   3.293
  480    HB   ILE  64           HB       ILE  64  67.750  -1.219   1.215
  481   HG12  ILE  64          HG12      ILE  64  66.107  -0.647   3.106
  482   HG13  ILE  64          HG11      ILE  64  65.450  -0.635   1.468
  483   HG21  ILE  64          HG21      ILE  64  67.646  -3.473   0.321
  484   HG22  ILE  64          HG22      ILE  64  66.103  -2.680   0.003
  485   HG23  ILE  64          HG23      ILE  64  66.240  -3.846   1.318
  486   HD11  ILE  64          HD11      ILE  64  63.985  -1.841   3.103
  487   HD12  ILE  64          HD12      ILE  64  65.288  -3.003   3.355
  488   HD13  ILE  64          HD13      ILE  64  64.524  -2.864   1.771
  489    H    THR  65           HN       THR  65  69.437  -4.313   3.875
  490    HA   THR  65           HA       THR  65  71.860  -3.553   2.510
  491    HB   THR  65           HB       THR  65  71.336  -6.326   3.581
  492    HG1  THR  65           HG1      THR  65  71.400  -5.601   5.584
  493   HG21  THR  65          HG21      THR  65  73.678  -6.282   4.091
  494   HG22  THR  65          HG22      THR  65  73.772  -4.545   3.799
  495   HG23  THR  65          HG23      THR  65  73.509  -5.653   2.452
  496    H    VAL  66           HN       VAL  66  72.106  -6.673   1.928
  497    HA   VAL  66           HA       VAL  66  72.256  -7.751  -0.185
  498    HB   VAL  66           HB       VAL  66  69.289  -7.139  -0.039
  499   HG11  VAL  66          HG11      VAL  66  69.160  -9.371  -1.208
  500   HG12  VAL  66          HG12      VAL  66  70.912  -9.310  -1.393
  501   HG13  VAL  66          HG13      VAL  66  69.900  -8.095  -2.174
  502   HG21  VAL  66          HG21      VAL  66  69.911  -8.091   2.068
  503   HG22  VAL  66          HG22      VAL  66  71.004  -9.243   1.300
  504   HG23  VAL  66          HG23      VAL  66  69.260  -9.422   1.111
  505    H    ILE  67           HN       ILE  67  69.453  -5.925  -1.246
  506    HA   ILE  67           HA       ILE  67  71.201  -4.263  -3.003
  507    HB   ILE  67           HB       ILE  67  68.863  -5.982  -3.876
  508   HG12  ILE  67          HG12      ILE  67  71.665  -5.817  -5.007
  509   HG13  ILE  67          HG11      ILE  67  71.245  -6.924  -3.699
  510   HG21  ILE  67          HG21      ILE  67  68.485  -4.001  -5.072
  511   HG22  ILE  67          HG22      ILE  67  69.536  -4.903  -6.164
  512   HG23  ILE  67          HG23      ILE  67  70.204  -3.614  -5.162
  513   HD11  ILE  67          HD11      ILE  67  69.561  -8.001  -5.085
  514   HD12  ILE  67          HD12      ILE  67  71.090  -7.981  -5.964
  515   HD13  ILE  67          HD13      ILE  67  69.822  -6.826  -6.374
  516    H1U  RCY  68           H1U      RCY  68  68.045   1.914  -6.696
  517    H1S  RCY  68           H1S      RCY  68  68.951   1.653  -2.085
  518    HB1  RCY  68           HB1      RCY  68  70.022  -0.776   0.057
  519    HB2  RCY  68           HB2      RCY  68  68.884   0.466  -0.456
  520    HA   RCY  68           HA       RCY  68  67.948  -1.693  -1.048
  521    HN1  RCY  68           HN1      RCY  68  70.645  -2.443  -1.668
  522    HA   PRO  69           HA       PRO  69  66.453  -0.223  -4.939
  523    HB2  PRO  69           HB2      PRO  69  65.044   2.033  -4.093
  524    HB3  PRO  69           HB1      PRO  69  64.425   0.372  -4.061
  525    HG2  PRO  69           HG2      PRO  69  65.569   2.004  -1.862
  526    HG3  PRO  69           HG1      PRO  69  64.253   0.818  -1.827
  527    HD2  PRO  69           HD2      PRO  69  66.743   0.240  -0.896
  528    HD3  PRO  69           HD1      PRO  69  65.706  -0.992  -1.652
  529    H    TRP  70           HN       TRP  70  68.620   1.546  -3.032
  530    HA   TRP  70           HA       TRP  70  68.798   3.904  -4.751
  531    HD1  TRP  70           HD1      TRP  70  70.326   5.219  -5.445
  532    HE1  TRP  70           HE1      TRP  70  71.097   7.644  -5.036
  533    HE3  TRP  70           HE3      TRP  70  70.872   5.126  -0.369
  534    HZ2  TRP  70           HZ2      TRP  70  71.847   9.326  -2.842
  535    HZ3  TRP  70           HZ3      TRP  70  71.614   7.147   0.853
  536    HH2  TRP  70           HH2      TRP  70  72.102   9.244  -0.373
  537    HB2  TRP  70           HB2      TRP  70  69.474   3.577  -2.207
  538    HB3  TRP  70           HB1      TRP  70  71.003   3.039  -2.894
  539    H    GLU  71           HN       GLU  71  69.877   0.689  -4.903
  540    HA   GLU  71           HA       GLU  71  72.272   1.305  -6.525
  541    HB2  GLU  71           HB2      GLU  71  71.015  -1.240  -5.490
  542    HB3  GLU  71           HB1      GLU  71  72.316  -1.272  -6.683
  543    HG2  GLU  71           HG2      GLU  71  72.528   0.233  -4.066
  544    HG3  GLU  71           HG1      GLU  71  73.064  -1.437  -4.256
  545    H    ALA  72           HN       ALA  72  68.927   0.398  -6.934
  546    HA   ALA  72           HA       ALA  72  69.041  -0.719  -9.547
  547    HB1  ALA  72           HB1      ALA  72  66.821   1.064  -8.517
  548    HB2  ALA  72           HB2      ALA  72  67.020  -0.609  -7.997
  549    HB3  ALA  72           HB3      ALA  72  66.695  -0.245  -9.692
  550    H1U  RCY  73           H1U      RCY  73  72.129   1.602 -14.465
  551    H1S  RCY  73           H1S      RCY  73  70.489   5.347 -12.526
  552    HB1  RCY  73           HB1      RCY  73  71.316   4.371  -8.855
  553    HB2  RCY  73           HB2      RCY  73  69.675   5.004  -8.747
  554    HA   RCY  73           HA       RCY  73  69.072   3.885 -10.836
  555    HN1  RCY  73           HN1      RCY  73  69.970   2.342  -8.548
  556    H    ASN  74           HN       ASN  74  72.091   2.202  -9.985
  557    HA   ASN  74           HA       ASN  74  72.829   2.258 -12.881
  558    HB2  ASN  74           HB2      ASN  74  74.493   3.084 -10.506
  559    HB3  ASN  74           HB1      ASN  74  75.268   2.441 -11.954
  560   HD21  ASN  74          HD21      ASN  74  72.442   3.929 -12.967
  561   HD22  ASN  74          HD22      ASN  74  73.066   5.459 -13.353
  562    H    HIS  75           HN       HIS  75  74.107   0.427 -13.534
  563    HA   HIS  75           HA       HIS  75  73.493  -2.004 -12.086
  564    HD1  HIS  75           HD1      HIS  75  72.209  -0.584 -13.893
  565    HD2  HIS  75           HD2      HIS  75  73.483  -3.956 -15.992
  566    HE1  HIS  75           HE1      HIS  75  70.279  -1.272 -15.381
  567    HE2  HIS  75           HE2      HIS  75  71.041  -3.324 -16.664
  568    HB2  HIS  75           HB2      HIS  75  75.253  -1.402 -14.474
  569    HB3  HIS  75           HB1      HIS  75  75.067  -3.029 -13.820
  570    H1U  RCY  76           H1U      RCY  76  71.857  -2.710  -5.469
  571    H1S  RCY  76           H1S      RCY  76  75.294  -3.080  -7.529
  572    HB1  RCY  76           HB1      RCY  76  77.729  -2.780  -9.465
  573    HB2  RCY  76           HB2      RCY  76  75.984  -2.640  -9.249
  574    HA   RCY  76           HA       RCY  76  76.925   0.002  -9.140
  575    HN1  RCY  76           HN1      RCY  76  75.090  -0.013 -10.598
  576    H    GLU  77           HN       GLU  77  77.144  -0.451 -12.364
  577    HA   GLU  77           HA       GLU  77  79.796  -1.336 -12.839
  578    HB2  GLU  77           HB2      GLU  77  77.684  -0.195 -14.358
  579    HB3  GLU  77           HB1      GLU  77  79.099   0.815 -14.649
  580    HG2  GLU  77           HG2      GLU  77  79.174  -0.949 -16.276
  581    HG3  GLU  77           HG1      GLU  77  80.403  -1.328 -15.069
  582    H    LEU  78           HN       LEU  78  81.552   0.264 -13.695
  583    HA   LEU  78           HA       LEU  78  81.601   2.848 -12.279
  584    HG   LEU  78           HG       LEU  78  82.442  -0.525 -11.488
  585    HB2  LEU  78           HB2      LEU  78  83.979   2.091 -11.387
  586    HB3  LEU  78           HB1      LEU  78  82.523   1.700 -10.473
  587   HD11  LEU  78          HD11      LEU  78  84.782   0.547 -13.068
  588   HD12  LEU  78          HD12      LEU  78  83.301  -0.195 -13.673
  589   HD13  LEU  78          HD13      LEU  78  84.520  -1.186 -12.871
  590   HD21  LEU  78          HD21      LEU  78  83.939   0.002  -9.472
  591   HD22  LEU  78          HD22      LEU  78  85.293  -0.029 -10.602
  592   HD23  LEU  78          HD23      LEU  78  84.316  -1.477 -10.355
  593    H    HIS  79           HN       HIS  79  82.082   1.176 -14.989
  594    HA   HIS  79           HA       HIS  79  84.520   2.705 -15.815
  595    HD1  HIS  79           HD1      HIS  79  84.557   0.984 -19.550
  596    HD2  HIS  79           HD2      HIS  79  87.006   1.355 -16.194
  597    HE1  HIS  79           HE1      HIS  79  86.894   1.438 -20.416
  598    HE2  HIS  79           HE2      HIS  79  88.394   1.666 -18.383
  599    HB2  HIS  79           HB2      HIS  79  84.301   0.089 -16.025
  600    HB3  HIS  79           HB1      HIS  79  83.316   0.473 -17.436
  601    H    GLU  80           HN       GLU  80  81.183   1.890 -16.717
  602    HA   GLU  80           HA       GLU  80  81.294   3.892 -18.917
  603    HB2  GLU  80           HB2      GLU  80  79.300   1.749 -18.153
  604    HB3  GLU  80           HB1      GLU  80  78.935   2.984 -19.358
  605    HG2  GLU  80           HG2      GLU  80  79.790   1.077 -20.550
  606    HG3  GLU  80           HG1      GLU  80  81.061   2.300 -20.557
  607    H    LEU  81           HN       LEU  81  79.188   3.067 -16.133
  608    HA   LEU  81           HA       LEU  81  77.923   5.709 -16.245
  609    HG   LEU  81           HG       LEU  81  77.256   2.466 -16.051
  610    HB2  LEU  81           HB2      LEU  81  77.688   3.689 -14.006
  611    HB3  LEU  81           HB1      LEU  81  76.535   4.943 -14.463
  612   HD11  LEU  81          HD11      LEU  81  75.656   2.003 -14.304
  613   HD12  LEU  81          HD12      LEU  81  74.767   2.092 -15.824
  614   HD13  LEU  81          HD13      LEU  81  74.729   3.450 -14.700
  615   HD21  LEU  81          HD21      LEU  81  76.987   4.133 -17.703
  616   HD22  LEU  81          HD22      LEU  81  75.734   4.966 -16.783
  617   HD23  LEU  81          HD23      LEU  81  75.377   3.427 -17.565
  618    H    ALA  82           HN       ALA  82  80.884   5.410 -15.687
  619    HA   ALA  82           HA       ALA  82  81.399   6.021 -12.937
  620    HB1  ALA  82           HB1      ALA  82  83.044   5.410 -14.887
  621    HB2  ALA  82           HB2      ALA  82  83.588   6.495 -13.609
  622    HB3  ALA  82           HB3      ALA  82  83.074   7.152 -15.163
  623    H    GLN  83           HN       GLN  83  79.416   7.520 -12.765
  624    HA   GLN  83           HA       GLN  83  79.116  10.012 -13.947
  625    HB2  GLN  83           HB2      GLN  83  77.661   9.060 -12.119
  626    HB3  GLN  83           HB1      GLN  83  78.898   9.539 -10.956
  627    HG2  GLN  83           HG2      GLN  83  77.240  11.297 -11.030
  628    HG3  GLN  83           HG1      GLN  83  78.695  11.896 -11.829
  629   HE21  GLN  83          HE21      GLN  83  75.420  10.618 -12.454
  630   HE22  GLN  83          HE22      GLN  83  75.312  11.214 -14.039
  631    H    TYR  84           HN       TYR  84  80.626   9.936 -10.730
  632    HA   TYR  84           HA       TYR  84  82.439  12.115 -11.604
  633    HD1  TYR  84           HD2      TYR  84  80.020  13.416  -9.879
  634    HD2  TYR  84           HD1      TYR  84  81.068   9.613  -8.178
  635    HE1  TYR  84           HE2      TYR  84  77.664  13.079  -9.181
  636    HE2  TYR  84           HE1      TYR  84  78.712   9.277  -7.480
  637    HH   TYR  84           HH       TYR  84  76.671  10.132  -7.429
  638    HB2  TYR  84           HB2      TYR  84  82.783  11.179  -8.847
  639    HB3  TYR  84           HB1      TYR  84  82.377  12.791  -9.434
  640    H    GLY  85           HN       GLY  85  82.538   8.841 -10.234
  641    HA2  GLY  85           HA2      GLY  85  84.330   7.325 -10.042
  642    HA3  GLY  85           HA1      GLY  85  84.626   7.810 -11.710
  643    H    ILE  86           HN       ILE  86  86.719   8.292 -11.961
  644    HA   ILE  86           HA       ILE  86  88.952   8.715 -11.142
  645    HB   ILE  86           HB       ILE  86  89.280  11.164 -11.229
  646   HG12  ILE  86          HG12      ILE  86  86.482  11.797 -11.801
  647   HG13  ILE  86          HG11      ILE  86  86.716  11.241 -10.143
  648   HG21  ILE  86          HG21      ILE  86  87.254  10.145 -13.245
  649   HG22  ILE  86          HG22      ILE  86  88.995   9.873 -13.324
  650   HG23  ILE  86          HG23      ILE  86  88.350  11.507 -13.481
  651   HD11  ILE  86          HD11      ILE  86  87.008  13.764 -10.578
  652   HD12  ILE  86          HD12      ILE  86  88.516  13.326 -11.381
  653   HD13  ILE  86          HD13      ILE  86  88.287  12.955  -9.672
  654    H1U  RCY  87           H1U      RCY  87  85.398   4.312  -0.844
  655    H1S  RCY  87           H1S      RCY  87  86.937   7.901  -3.089
  656    HB1  RCY  87           HB1      RCY  87  88.330   6.441  -6.957
  657    HB2  RCY  87           HB2      RCY  87  86.779   7.123  -6.469
  658    HA   RCY  87           HA       RCY  87  87.594   9.362  -6.669
  659    HN1  RCY  87           HN1      RCY  87  87.853   7.645  -8.942
  Start of MODEL   23
    1    HA   MET   1           HA       MET   1  54.358 -20.411  -1.651
    2    HB2  MET   1           HB2      MET   1  52.308 -21.407  -0.519
    3    HB3  MET   1           HB1      MET   1  52.944 -20.779   1.001
    4    HG2  MET   1           HG2      MET   1  52.933 -18.502   0.101
    5    HG3  MET   1           HG1      MET   1  52.377 -19.103  -1.461
    6    HE1  MET   1           HE1      MET   1  48.776 -19.717  -1.230
    7    HE2  MET   1           HE2      MET   1  50.176 -20.725  -1.588
    8    HE3  MET   1           HE3      MET   1  50.130 -19.058  -2.157
    9    H    ASN   2           HN       ASN   2  54.391 -20.371   1.903
   10    HA   ASN   2           HA       ASN   2  55.656 -19.065   3.384
   11    HB2  ASN   2           HB2      ASN   2  57.426 -20.604   2.303
   12    HB3  ASN   2           HB1      ASN   2  57.871 -19.199   1.334
   13   HD21  ASN   2          HD21      ASN   2  58.319 -20.713   4.389
   14   HD22  ASN   2          HD22      ASN   2  59.115 -19.429   5.163
   15    H    LEU   3           HN       LEU   3  54.584 -17.960   0.502
   16    HA   LEU   3           HA       LEU   3  55.987 -15.363   0.542
   17    HG   LEU   3           HG       LEU   3  54.776 -14.539  -2.760
   18    HB2  LEU   3           HB2      LEU   3  55.133 -16.726  -1.555
   19    HB3  LEU   3           HB1      LEU   3  53.596 -15.952  -1.185
   20   HD11  LEU   3          HD11      LEU   3  55.208 -13.280  -0.045
   21   HD12  LEU   3          HD12      LEU   3  53.598 -13.517  -0.724
   22   HD13  LEU   3          HD13      LEU   3  54.761 -12.483  -1.553
   23   HD21  LEU   3          HD21      LEU   3  57.025 -14.046  -2.652
   24   HD22  LEU   3          HD22      LEU   3  57.054 -15.582  -1.786
   25   HD23  LEU   3          HD23      LEU   3  57.050 -14.064  -0.888
   26    H    GLU   4           HN       GLU   4  55.299 -14.339   2.445
   27    HA   GLU   4           HA       GLU   4  52.440 -14.217   3.101
   28    HB2  GLU   4           HB2      GLU   4  54.956 -13.100   4.338
   29    HB3  GLU   4           HB1      GLU   4  53.366 -12.575   4.891
   30    HG2  GLU   4           HG2      GLU   4  52.745 -14.922   5.343
   31    HG3  GLU   4           HG1      GLU   4  54.339 -15.446   4.799
   32    HA   PRO   5           HA       PRO   5  51.563 -10.526   0.828
   33    HB2  PRO   5           HB2      PRO   5  49.690  -9.351   2.479
   34    HB3  PRO   5           HB1      PRO   5  49.346 -10.727   1.414
   35    HG2  PRO   5           HG2      PRO   5  49.895 -10.690   4.336
   36    HG3  PRO   5           HG1      PRO   5  48.750 -11.676   3.411
   37    HD2  PRO   5           HD2      PRO   5  51.141 -12.649   4.302
   38    HD3  PRO   5           HD1      PRO   5  50.361 -13.234   2.816
   39    HA   PRO   6           HA       PRO   6  53.952  -7.162   2.423
   40    HB2  PRO   6           HB2      PRO   6  52.621  -4.973   1.421
   41    HB3  PRO   6           HB1      PRO   6  53.643  -6.037   0.436
   42    HG2  PRO   6           HG2      PRO   6  50.680  -5.978   0.697
   43    HG3  PRO   6           HG1      PRO   6  51.684  -6.245  -0.739
   44    HD2  PRO   6           HD2      PRO   6  50.460  -8.288   0.602
   45    HD3  PRO   6           HD1      PRO   6  51.995  -8.494  -0.272
   46    H    LYS   7           HN       LYS   7  53.858  -5.205   3.867
   47    HA   LYS   7           HA       LYS   7  51.346  -4.668   5.269
   48    HB2  LYS   7           HB2      LYS   7  52.600  -5.276   7.517
   49    HB3  LYS   7           HB1      LYS   7  51.757  -6.529   6.608
   50    HG2  LYS   7           HG2      LYS   7  54.048  -7.236   7.280
   51    HG3  LYS   7           HG1      LYS   7  53.848  -7.199   5.528
   52    HD2  LYS   7           HD2      LYS   7  55.056  -5.168   5.320
   53    HD3  LYS   7           HD1      LYS   7  54.935  -4.826   7.047
   54    HE2  LYS   7           HE2      LYS   7  56.426  -6.661   7.576
   55    HE3  LYS   7           HE1      LYS   7  56.436  -7.194   5.895
   56    HZ1  LYS   7           HZ1      LYS   7  58.343  -5.967   5.972
   57    HZ2  LYS   7           HZ2      LYS   7  57.737  -4.867   7.118
   58    HZ3  LYS   7           HZ3      LYS   7  57.246  -4.764   5.494
   59    H    ALA   8           HN       ALA   8  52.067  -3.281   7.385
   60    HA   ALA   8           HA       ALA   8  54.477  -1.678   6.941
   61    HB1  ALA   8           HB1      ALA   8  53.145   0.466   6.759
   62    HB2  ALA   8           HB2      ALA   8  51.711  -0.524   6.486
   63    HB3  ALA   8           HB3      ALA   8  53.048  -0.572   5.337
   64    H    GLU   9           HN       GLU   9  54.156  -3.070   9.135
   65    HA   GLU   9           HA       GLU   9  52.511  -2.142  11.223
   66    HB2  GLU   9           HB2      GLU   9  54.150  -3.126  12.750
   67    HB3  GLU   9           HB1      GLU   9  53.948  -4.174  11.345
   68    HG2  GLU   9           HG2      GLU   9  55.951  -2.996  10.318
   69    HG3  GLU   9           HG1      GLU   9  56.213  -2.242  11.890
   70    H1U  RCY  10           H1U      RCY  10  63.151   0.992   9.551
   71    H1S  RCY  10           H1S      RCY  10  60.327   1.892  12.439
   72    HB1  RCY  10           HB1      RCY  10  57.328   1.414   9.669
   73    HB2  RCY  10           HB2      RCY  10  57.641   0.040  10.727
   74    HA   RCY  10           HA       RCY  10  55.696   1.155  12.166
   75    HN1  RCY  10           HN1      RCY  10  55.545  -0.814   9.988
   76    H    ARG  11           HN       ARG  11  55.995   1.878   8.691
   77    HA   ARG  11           HA       ARG  11  53.535   3.323   8.449
   78    HE   ARG  11           HE       ARG  11  52.902   5.191  10.344
   79    HB2  ARG  11           HB2      ARG  11  54.572   4.843  10.091
   80    HB3  ARG  11           HB1      ARG  11  55.993   4.996   9.064
   81    HG2  ARG  11           HG2      ARG  11  54.454   6.917   8.773
   82    HG3  ARG  11           HG1      ARG  11  54.621   5.991   7.281
   83    HD2  ARG  11           HD2      ARG  11  52.225   6.673   8.090
   84    HD3  ARG  11           HD1      ARG  11  52.491   5.041   7.476
   85   HH11  ARG  11          HH21      ARG  11  50.589   5.009   7.794
   86   HH12  ARG  11          HH22      ARG  11  49.382   4.234   8.765
   87   HH21  ARG  11          HH11      ARG  11  51.339   4.180  11.626
   88   HH22  ARG  11          HH12      ARG  11  49.807   3.765  10.935
   89    H    SER  12           HN       SER  12  53.312   4.171   6.311
   90    HA   SER  12           HA       SER  12  54.859   2.950   4.279
   91    HG   SER  12           HG       SER  12  53.236   4.834   1.877
   92    HB2  SER  12           HB2      SER  12  52.709   3.763   3.663
   93    HB3  SER  12           HB1      SER  12  53.055   5.376   4.280
   94    H    ALA  13           HN       ALA  13  54.737   6.471   4.237
   95    HA   ALA  13           HA       ALA  13  57.546   6.596   3.474
   96    HB1  ALA  13           HB1      ALA  13  55.657   8.852   4.215
   97    HB2  ALA  13           HB2      ALA  13  55.829   8.180   2.594
   98    HB3  ALA  13           HB3      ALA  13  57.187   9.011   3.352
   99    H    THR  14           HN       THR  14  58.722   8.622   4.762
  100    HA   THR  14           HA       THR  14  58.295   8.573   7.638
  101    HB   THR  14           HB       THR  14  60.869   7.314   6.674
  102    HG1  THR  14           HG1      THR  14  59.853   5.505   6.486
  103   HG21  THR  14          HG21      THR  14  59.441   7.359   9.348
  104   HG22  THR  14          HG22      THR  14  60.860   8.317   8.925
  105   HG23  THR  14          HG23      THR  14  60.979   6.560   9.020
  106    H    ARG  15           HN       ARG  15  58.270  10.876   6.899
  107    HA   ARG  15           HA       ARG  15  59.305  12.961   6.553
  108    HE   ARG  15           HE       ARG  15  60.292  14.528  10.245
  109    HB2  ARG  15           HB2      ARG  15  61.561  11.676   8.115
  110    HB3  ARG  15           HB1      ARG  15  61.157  13.391   8.036
  111    HG2  ARG  15           HG2      ARG  15  59.010  12.958   9.144
  112    HG3  ARG  15           HG1      ARG  15  59.366  11.231   9.188
  113    HD2  ARG  15           HD2      ARG  15  59.987  12.002  11.339
  114    HD3  ARG  15           HD1      ARG  15  61.512  11.897  10.460
  115   HH11  ARG  15          HH21      ARG  15  62.196  12.385  12.160
  116   HH12  ARG  15          HH22      ARG  15  63.028  13.655  12.994
  117   HH21  ARG  15          HH11      ARG  15  61.367  16.200  11.323
  118   HH22  ARG  15          HH12      ARG  15  62.558  15.815  12.519
  119    H    VAL  16           HN       VAL  16  62.537  12.438   6.758
  120    HA   VAL  16           HA       VAL  16  62.953  11.506   3.990
  121    HB   VAL  16           HB       VAL  16  62.455  13.957   3.807
  122   HG11  VAL  16          HG11      VAL  16  63.888  15.576   4.809
  123   HG12  VAL  16          HG12      VAL  16  65.071  14.352   5.270
  124   HG13  VAL  16          HG13      VAL  16  63.515  14.430   6.096
  125   HG21  VAL  16          HG21      VAL  16  65.370  13.362   3.245
  126   HG22  VAL  16          HG22      VAL  16  64.292  14.425   2.340
  127   HG23  VAL  16          HG23      VAL  16  64.058  12.678   2.286
  128    H    MET  17           HN       MET  17  64.401  12.894   6.935
  129    HA   MET  17           HA       MET  17  66.590  10.894   6.691
  130    HB2  MET  17           HB2      MET  17  66.913  13.890   6.815
  131    HB3  MET  17           HB1      MET  17  68.163  12.827   7.460
  132    HG2  MET  17           HG2      MET  17  67.051  12.549   4.659
  133    HG3  MET  17           HG1      MET  17  68.482  13.510   5.034
  134    HE1  MET  17           HE1      MET  17  69.551  10.185   3.235
  135    HE2  MET  17           HE2      MET  17  70.131  11.842   3.381
  136    HE3  MET  17           HE3      MET  17  68.438  11.539   2.998
  137    H    GLY  18           HN       GLY  18  66.621  13.652   8.871
  138    HA2  GLY  18           HA2      GLY  18  65.170  12.672  11.055
  139    HA3  GLY  18           HA1      GLY  18  66.765  11.929  11.184
  140    H    GLY  19           HN       GLY  19  65.454  14.011  12.891
  141    HA2  GLY  19           HA2      GLY  19  67.138  16.395  12.391
  142    HA3  GLY  19           HA1      GLY  19  65.867  16.267  13.608
  143    HA   PRO  20           HA       PRO  20  68.402  14.940  16.962
  144    HB2  PRO  20           HB2      PRO  20  67.927  12.030  16.430
  145    HB3  PRO  20           HB1      PRO  20  67.753  12.943  17.942
  146    HG2  PRO  20           HG2      PRO  20  65.633  12.222  16.510
  147    HG3  PRO  20           HG1      PRO  20  65.691  13.780  17.352
  148    HD2  PRO  20           HD2      PRO  20  65.931  13.210  14.432
  149    HD3  PRO  20           HD1      PRO  20  65.291  14.651  15.252
  150    H1U  RCY  21           H1U      RCY  21  70.028  12.049   7.247
  151    H1S  RCY  21           H1S      RCY  21  69.041  11.743  11.972
  152    HB1  RCY  21           HB1      RCY  21  70.968  10.927  15.302
  153    HB2  RCY  21           HB2      RCY  21  72.307  10.908  14.154
  154    HA   RCY  21           HA       RCY  21  71.864  13.212  14.531
  155    HN1  RCY  21           HN1      RCY  21  68.931  12.894  14.093
  156    H    THR  22           HN       THR  22  72.998  13.574  12.643
  157    HA   THR  22           HA       THR  22  71.622  13.135  10.044
  158    HB   THR  22           HB       THR  22  71.921  15.378   9.312
  159    HG1  THR  22           HG1      THR  22  73.622  16.362  10.000
  160   HG21  THR  22          HG21      THR  22  70.580  16.633  10.844
  161   HG22  THR  22          HG22      THR  22  71.136  15.676  12.217
  162   HG23  THR  22          HG23      THR  22  70.073  14.952  11.010
  163    HA   PRO  23           HA       PRO  23  75.912  11.477   9.852
  164    HB2  PRO  23           HB2      PRO  23  74.804  10.725   7.175
  165    HB3  PRO  23           HB1      PRO  23  75.727   9.743   8.330
  166    HG2  PRO  23           HG2      PRO  23  73.100   9.441   8.041
  167    HG3  PRO  23           HG1      PRO  23  73.877   9.298   9.627
  168    HD2  PRO  23           HD2      PRO  23  72.194  11.519   8.550
  169    HD3  PRO  23           HD1      PRO  23  72.381  10.954  10.225
  170    H    ARG  24           HN       ARG  24  77.318  11.495   7.529
  171    HA   ARG  24           HA       ARG  24  77.377  14.392   6.801
  172    HE   ARG  24           HE       ARG  24  81.270  10.732   8.120
  173    HB2  ARG  24           HB2      ARG  24  79.584  12.384   6.313
  174    HB3  ARG  24           HB1      ARG  24  79.701  14.141   6.373
  175    HG2  ARG  24           HG2      ARG  24  80.480  13.633   8.492
  176    HG3  ARG  24           HG1      ARG  24  78.755  13.767   8.836
  177    HD2  ARG  24           HD2      ARG  24  79.001  11.685   9.723
  178    HD3  ARG  24           HD1      ARG  24  78.932  11.156   8.042
  179   HH11  ARG  24          HH21      ARG  24  80.116  12.483  10.857
  180   HH12  ARG  24          HH22      ARG  24  81.589  12.314  11.753
  181   HH21  ARG  24          HH11      ARG  24  83.199  10.501   9.274
  182   HH22  ARG  24          HH12      ARG  24  83.334  11.192  10.857
  183    H    LYS  25           HN       LYS  25  76.591  14.871   4.817
  184    HA   LYS  25           HA       LYS  25  77.105  13.001   2.570
  185    HB2  LYS  25           HB2      LYS  25  74.727  13.186   1.835
  186    HB3  LYS  25           HB1      LYS  25  74.897  12.338   3.372
  187    HG2  LYS  25           HG2      LYS  25  74.558  14.697   4.437
  188    HG3  LYS  25           HG1      LYS  25  73.890  15.129   2.863
  189    HD2  LYS  25           HD2      LYS  25  72.233  13.357   3.021
  190    HD3  LYS  25           HD1      LYS  25  72.953  12.772   4.522
  191    HE2  LYS  25           HE2      LYS  25  71.881  15.584   4.217
  192    HE3  LYS  25           HE1      LYS  25  70.890  14.245   4.795
  193    HZ1  LYS  25           HZ1      LYS  25  72.604  13.860   6.521
  194    HZ2  LYS  25           HZ2      LYS  25  71.819  15.359   6.667
  195    HZ3  LYS  25           HZ3      LYS  25  73.388  15.279   6.020
  196    H    GLY  26           HN       GLY  26  75.525  16.090   3.464
  197    HA2  GLY  26           HA2      GLY  26  75.563  18.169   2.375
  198    HA3  GLY  26           HA1      GLY  26  77.215  17.743   1.928
  199    HA   PRO  27           HA       PRO  27  74.608  18.336  -1.948
  200    HB2  PRO  27           HB2      PRO  27  77.400  18.983  -2.812
  201    HB3  PRO  27           HB1      PRO  27  75.876  19.795  -3.222
  202    HG2  PRO  27           HG2      PRO  27  77.572  20.832  -1.454
  203    HG3  PRO  27           HG1      PRO  27  75.818  20.972  -1.250
  204    HD2  PRO  27           HD2      PRO  27  77.751  19.255   0.234
  205    HD3  PRO  27           HD1      PRO  27  76.208  19.950   0.778
  206    HA   PRO  28           HA       PRO  28  75.545  14.024  -3.001
  207    HB2  PRO  28           HB2      PRO  28  74.314  14.978  -5.567
  208    HB3  PRO  28           HB1      PRO  28  73.990  13.495  -4.648
  209    HG2  PRO  28           HG2      PRO  28  72.336  15.583  -4.554
  210    HG3  PRO  28           HG1      PRO  28  72.639  14.573  -3.131
  211    HD2  PRO  28           HD2      PRO  28  73.552  17.347  -3.688
  212    HD3  PRO  28           HD1      PRO  28  73.303  16.533  -2.128
  213    H    LYS  29           HN       LYS  29  77.469  13.257  -3.791
  214    HA   LYS  29           HA       LYS  29  78.567  13.833  -6.331
  215    HB2  LYS  29           HB2      LYS  29  79.010  15.938  -4.414
  216    HB3  LYS  29           HB1      LYS  29  80.556  15.172  -4.773
  217    HG2  LYS  29           HG2      LYS  29  80.258  15.525  -7.146
  218    HG3  LYS  29           HG1      LYS  29  78.603  16.086  -6.904
  219    HD2  LYS  29           HD2      LYS  29  79.331  18.080  -5.819
  220    HD3  LYS  29           HD1      LYS  29  80.974  17.467  -5.634
  221    HE2  LYS  29           HE2      LYS  29  80.501  19.162  -7.552
  222    HE3  LYS  29           HE1      LYS  29  81.464  17.731  -7.919
  223    HZ1  LYS  29           HZ1      LYS  29  79.677  16.699  -8.956
  224    HZ2  LYS  29           HZ2      LYS  29  79.549  18.311  -9.475
  225    HZ3  LYS  29           HZ3      LYS  29  78.530  17.728  -8.248
  226    H1U  RCY  30           H1U      RCY  30  78.137   5.978 -11.295
  227    H1S  RCY  30           H1S      RCY  30  80.262   8.602  -9.036
  228    HB1  RCY  30           HB1      RCY  30  81.458   8.999  -6.077
  229    HB2  RCY  30           HB2      RCY  30  82.040  10.200  -7.229
  230    HA   RCY  30           HA       RCY  30  80.933  10.584  -4.476
  231    HN1  RCY  30           HN1      RCY  30  80.187  12.346  -6.722
  232    H    LYS  31           HN       LYS  31  82.331  12.097  -3.334
  233    HA   LYS  31           HA       LYS  31  85.079  11.884  -4.075
  234    HB2  LYS  31           HB2      LYS  31  84.551  13.609  -5.713
  235    HB3  LYS  31           HB1      LYS  31  83.749  14.582  -4.480
  236    HG2  LYS  31           HG2      LYS  31  86.092  15.343  -5.004
  237    HG3  LYS  31           HG1      LYS  31  85.841  14.933  -3.307
  238    HD2  LYS  31           HD2      LYS  31  86.887  12.778  -3.598
  239    HD3  LYS  31           HD1      LYS  31  86.958  12.992  -5.347
  240    HE2  LYS  31           HE2      LYS  31  88.468  14.934  -5.034
  241    HE3  LYS  31           HE1      LYS  31  88.426  14.670  -3.291
  242    HZ1  LYS  31           HZ1      LYS  31  89.099  12.353  -4.900
  243    HZ2  LYS  31           HZ2      LYS  31  89.767  12.892  -3.434
  244    HZ3  LYS  31           HZ3      LYS  31  90.252  13.597  -4.902
  245    H    GLN  32           HN       GLN  32  82.529  12.868  -2.047
  246    HA   GLN  32           HA       GLN  32  83.790  14.404  -0.055
  247    HB2  GLN  32           HB2      GLN  32  81.643  12.282   0.136
  248    HB3  GLN  32           HB1      GLN  32  82.158  13.236   1.528
  249    HG2  GLN  32           HG2      GLN  32  81.239  14.484  -1.073
  250    HG3  GLN  32           HG1      GLN  32  80.148  14.159   0.275
  251   HE21  GLN  32          HE21      GLN  32  81.326  14.975   2.515
  252   HE22  GLN  32          HE22      GLN  32  81.898  16.570   2.425
  253    H    ARG  33           HN       ARG  33  82.976  11.307   1.214
  254    HA   ARG  33           HA       ARG  33  85.693  11.021   2.292
  255    HE   ARG  33           HE       ARG  33  84.779  11.902   6.897
  256    HB2  ARG  33           HB2      ARG  33  83.131   9.450   2.642
  257    HB3  ARG  33           HB1      ARG  33  84.656   8.946   3.370
  258    HG2  ARG  33           HG2      ARG  33  83.752  11.776   3.763
  259    HG3  ARG  33           HG1      ARG  33  82.976  10.504   4.708
  260    HD2  ARG  33           HD2      ARG  33  85.012   9.862   5.730
  261    HD3  ARG  33           HD1      ARG  33  85.981  10.709   4.526
  262   HH11  ARG  33          HH21      ARG  33  85.841  12.364   3.649
  263   HH12  ARG  33          HH22      ARG  33  86.135  14.060   3.846
  264   HH21  ARG  33          HH11      ARG  33  85.157  14.113   7.172
  265   HH22  ARG  33          HH12      ARG  33  85.747  15.050   5.840
  266    H    GLN  34           HN       GLN  34  87.165   9.429   1.702
  267    HA   GLN  34           HA       GLN  34  86.376   7.323  -0.204
  268    HB2  GLN  34           HB2      GLN  34  88.288   8.014  -1.751
  269    HB3  GLN  34           HB1      GLN  34  86.863   9.052  -1.790
  270    HG2  GLN  34           HG2      GLN  34  87.908  10.718  -0.450
  271    HG3  GLN  34           HG1      GLN  34  89.210   9.627   0.024
  272   HE21  GLN  34          HE21      GLN  34  87.869  11.353  -2.824
  273   HE22  GLN  34          HE22      GLN  34  89.336  11.407  -3.675
  274    H    THR  35           HN       THR  35  88.042   5.658  -0.360
  275    HA   THR  35           HA       THR  35  90.520   5.933   1.134
  276    HB   THR  35           HB       THR  35  88.469   4.033   2.290
  277    HG1  THR  35           HG1      THR  35  89.257   6.271   3.702
  278   HG21  THR  35          HG21      THR  35  90.970   3.633   2.574
  279   HG22  THR  35          HG22      THR  35  90.044   3.772   4.069
  280   HG23  THR  35          HG23      THR  35  91.012   5.132   3.501
  281    H    ARG  36           HN       ARG  36  88.333   3.140   0.604
  282    HA   ARG  36           HA       ARG  36  89.628   2.160  -1.730
  283    HE   ARG  36           HE       ARG  36  92.619  -2.289   1.177
  284    HB2  ARG  36           HB2      ARG  36  91.653   1.739  -0.672
  285    HB3  ARG  36           HB1      ARG  36  90.894   1.469   0.894
  286    HG2  ARG  36           HG2      ARG  36  90.202  -0.722   0.313
  287    HG3  ARG  36           HG1      ARG  36  90.457  -0.435  -1.409
  288    HD2  ARG  36           HD2      ARG  36  92.718  -0.789  -1.273
  289    HD3  ARG  36           HD1      ARG  36  92.832  -0.102   0.347
  290   HH11  ARG  36          HH21      ARG  36  91.225  -1.981  -1.961
  291   HH12  ARG  36          HH22      ARG  36  90.809  -3.657  -2.086
  292   HH21  ARG  36          HH11      ARG  36  92.083  -4.480   1.032
  293   HH22  ARG  36          HH12      ARG  36  91.294  -5.072  -0.392
  294    H    GLN  37           HN       GLN  37  87.867   1.033  -2.492
  295    HA   GLN  37           HA       GLN  37  86.941  -1.329  -1.149
  296    HB2  GLN  37           HB2      GLN  37  85.901   0.697   0.168
  297    HB3  GLN  37           HB1      GLN  37  84.794   0.774  -1.200
  298    HG2  GLN  37           HG2      GLN  37  83.727  -0.668   0.355
  299    HG3  GLN  37           HG1      GLN  37  84.443  -1.751  -0.840
  300   HE21  GLN  37          HE21      GLN  37  85.624  -0.072   2.144
  301   HE22  GLN  37          HE22      GLN  37  86.378  -1.450   2.789
  302    H1U  RCY  38           H1U      RCY  38  82.368   1.562  -0.104
  303    H1S  RCY  38           H1S      RCY  38  81.679  -0.363  -4.350
  304    HB1  RCY  38           HB1      RCY  38  84.807   0.656  -6.415
  305    HB2  RCY  38           HB2      RCY  38  84.643   0.716  -4.662
  306    HA   RCY  38           HA       RCY  38  85.915  -1.759  -5.456
  307    HN1  RCY  38           HN1      RCY  38  87.587  -0.062  -3.924
  308    H    LYS  39           HN       LYS  39  87.802  -2.097  -6.648
  309    HA   LYS  39           HA       LYS  39  88.253  -0.449  -8.911
  310    HB2  LYS  39           HB2      LYS  39  89.298   0.989  -7.015
  311    HB3  LYS  39           HB1      LYS  39  90.582  -0.219  -7.007
  312    HG2  LYS  39           HG2      LYS  39  90.715   0.147  -9.546
  313    HG3  LYS  39           HG1      LYS  39  89.740   1.591  -9.270
  314    HD2  LYS  39           HD2      LYS  39  91.866   2.494  -9.077
  315    HD3  LYS  39           HD1      LYS  39  91.560   2.055  -7.396
  316    HE2  LYS  39           HE2      LYS  39  93.707   1.165  -7.839
  317    HE3  LYS  39           HE1      LYS  39  92.627  -0.220  -7.996
  318    HZ1  LYS  39           HZ1      LYS  39  93.168  -0.438 -10.120
  319    HZ2  LYS  39           HZ2      LYS  39  94.378   0.732  -9.890
  320    HZ3  LYS  39           HZ3      LYS  39  92.841   1.194 -10.449
  321    H    SER  40           HN       SER  40  88.560  -2.212 -10.188
  322    HA   SER  40           HA       SER  40  89.490  -4.205 -11.011
  323    HG   SER  40           HG       SER  40  91.873  -5.186 -11.273
  324    HB2  SER  40           HB2      SER  40  91.475  -2.969 -11.386
  325    HB3  SER  40           HB1      SER  40  91.824  -2.844  -9.664
  326    H    LYS  41           HN       LYS  41  88.625  -6.005 -10.055
  327    HA   LYS  41           HA       LYS  41  90.028  -7.084  -7.692
  328    HB2  LYS  41           HB2      LYS  41  88.114  -7.345  -6.332
  329    HB3  LYS  41           HB1      LYS  41  87.985  -5.705  -6.950
  330    HG2  LYS  41           HG2      LYS  41  86.600  -8.124  -8.152
  331    HG3  LYS  41           HG1      LYS  41  85.821  -6.923  -7.122
  332    HD2  LYS  41           HD2      LYS  41  87.132  -6.383  -9.803
  333    HD3  LYS  41           HD1      LYS  41  85.397  -6.411  -9.486
  334    HE2  LYS  41           HE2      LYS  41  86.092  -4.637  -7.613
  335    HE3  LYS  41           HE1      LYS  41  87.432  -4.361  -8.726
  336    HZ1  LYS  41           HZ1      LYS  41  84.881  -4.557 -10.031
  337    HZ2  LYS  41           HZ2      LYS  41  86.098  -3.384 -10.197
  338    HZ3  LYS  41           HZ3      LYS  41  84.966  -3.264  -8.936
  339    HA   PRO  42           HA       PRO  42  89.428 -10.736 -10.152
  340    HB2  PRO  42           HB2      PRO  42  90.166 -12.632  -8.341
  341    HB3  PRO  42           HB1      PRO  42  91.334 -11.537  -9.108
  342    HG2  PRO  42           HG2      PRO  42  90.108 -11.380  -6.399
  343    HG3  PRO  42           HG1      PRO  42  91.776 -11.061  -6.904
  344    HD2  PRO  42           HD2      PRO  42  89.939  -9.069  -6.450
  345    HD3  PRO  42           HD1      PRO  42  91.300  -8.901  -7.580
  346    HA   PRO  43           HA       PRO  43  85.404 -12.289  -9.016
  347    HB2  PRO  43           HB2      PRO  43  85.267 -14.520 -10.556
  348    HB3  PRO  43           HB1      PRO  43  85.233 -12.887 -11.252
  349    HG2  PRO  43           HG2      PRO  43  87.499 -14.810 -11.077
  350    HG3  PRO  43           HG1      PRO  43  87.028 -13.737 -12.406
  351    HD2  PRO  43           HD2      PRO  43  89.061 -13.162 -10.635
  352    HD3  PRO  43           HD1      PRO  43  88.134 -11.922 -11.508
  353    H    LYS  44           HN       LYS  44  84.877 -13.300  -7.116
  354    HA   LYS  44           HA       LYS  44  86.010 -15.997  -6.565
  355    HB2  LYS  44           HB2      LYS  44  86.115 -13.622  -4.683
  356    HB3  LYS  44           HB1      LYS  44  86.369 -15.287  -4.162
  357    HG2  LYS  44           HG2      LYS  44  87.980 -13.937  -6.348
  358    HG3  LYS  44           HG1      LYS  44  88.505 -14.055  -4.668
  359    HD2  LYS  44           HD2      LYS  44  87.970 -16.627  -5.027
  360    HD3  LYS  44           HD1      LYS  44  88.227 -16.216  -6.723
  361    HE2  LYS  44           HE2      LYS  44  90.171 -15.838  -4.432
  362    HE3  LYS  44           HE1      LYS  44  90.356 -16.902  -5.826
  363    HZ1  LYS  44           HZ1      LYS  44  90.476 -13.956  -5.726
  364    HZ2  LYS  44           HZ2      LYS  44  90.134 -14.765  -7.180
  365    HZ3  LYS  44           HZ3      LYS  44  91.604 -15.044  -6.375
  366    H    LYS  45           HN       LYS  45  84.566 -14.591  -3.862
  367    HA   LYS  45           HA       LYS  45  81.787 -15.093  -4.610
  368    HB2  LYS  45           HB2      LYS  45  81.569 -16.904  -2.798
  369    HB3  LYS  45           HB1      LYS  45  82.327 -17.390  -4.314
  370    HG2  LYS  45           HG2      LYS  45  84.558 -17.036  -3.315
  371    HG3  LYS  45           HG1      LYS  45  83.800 -16.559  -1.795
  372    HD2  LYS  45           HD2      LYS  45  82.815 -18.757  -1.527
  373    HD3  LYS  45           HD1      LYS  45  83.370 -19.248  -3.128
  374    HE2  LYS  45           HE2      LYS  45  85.742 -18.754  -2.291
  375    HE3  LYS  45           HE1      LYS  45  85.041 -18.681  -0.674
  376    HZ1  LYS  45           HZ1      LYS  45  84.018 -20.936  -1.323
  377    HZ2  LYS  45           HZ2      LYS  45  85.654 -20.879  -0.869
  378    HZ3  LYS  45           HZ3      LYS  45  85.228 -20.976  -2.511
  379    H    GLY  46           HN       GLY  46  84.226 -13.985  -2.469
  380    HA2  GLY  46           HA2      GLY  46  82.802 -11.978  -1.236
  381    HA3  GLY  46           HA1      GLY  46  82.441 -13.386  -0.236
  382    H    VAL  47           HN       VAL  47  84.750 -14.749  -0.059
  383    HA   VAL  47           HA       VAL  47  86.322 -13.214   1.767
  384    HB   VAL  47           HB       VAL  47  87.997 -15.156   1.409
  385   HG11  VAL  47          HG11      VAL  47  85.126 -15.744   2.200
  386   HG12  VAL  47          HG12      VAL  47  86.367 -15.071   3.258
  387   HG13  VAL  47          HG13      VAL  47  86.529 -16.716   2.645
  388   HG21  VAL  47          HG21      VAL  47  87.033 -15.638  -0.906
  389   HG22  VAL  47          HG22      VAL  47  85.632 -16.322  -0.081
  390   HG23  VAL  47          HG23      VAL  47  87.226 -17.042   0.144
  391    H    GLN  48           HN       GLN  48  86.633 -11.306   0.254
  392    HA   GLN  48           HA       GLN  48  89.314 -11.435  -0.890
  393    HB2  GLN  48           HB2      GLN  48  88.694 -10.804  -3.164
  394    HB3  GLN  48           HB1      GLN  48  87.902 -12.325  -2.750
  395    HG2  GLN  48           HG2      GLN  48  85.870 -10.977  -2.078
  396    HG3  GLN  48           HG1      GLN  48  86.666  -9.560  -2.764
  397   HE21  GLN  48          HE21      GLN  48  84.195 -10.670  -3.823
  398   HE22  GLN  48          HE22      GLN  48  84.520 -11.234  -5.390
  399    H    GLY  49           HN       GLY  49  90.178  -9.319  -1.224
  400    HA2  GLY  49           HA2      GLY  49  89.036  -7.258   0.414
  401    HA3  GLY  49           HA1      GLY  49  90.385  -7.038  -0.702
  402    H1U  RCY  50           H1U      RCY  50  80.389  -2.823  -3.579
  403    H1S  RCY  50           H1S      RCY  50  85.021  -3.749  -3.383
  404    HB1  RCY  50           HB1      RCY  50  86.838  -3.198  -3.163
  405    HB2  RCY  50           HB2      RCY  50  87.887  -3.363  -1.754
  406    HA   RCY  50           HA       RCY  50  87.453  -5.623  -3.717
  407    HN1  RCY  50           HN1      RCY  50  89.886  -5.410  -2.090
  408    H    GLY  51           HN       GLY  51  89.169  -2.607  -3.077
  409    HA2  GLY  51           HA2      GLY  51  91.058  -2.957  -5.263
  410    HA3  GLY  51           HA1      GLY  51  89.700  -1.925  -5.709
  411    H    ASP  52           HN       ASP  52  89.996   0.212  -5.314
  412    HA   ASP  52           HA       ASP  52  91.330   1.116  -2.874
  413    HB2  ASP  52           HB2      ASP  52  93.107   0.564  -4.759
  414    HB3  ASP  52           HB1      ASP  52  92.589   2.119  -5.407
  415    H    ASP  53           HN       ASP  53  88.721   1.531  -3.733
  416    HA   ASP  53           HA       ASP  53  88.576   4.419  -3.729
  417    HB2  ASP  53           HB2      ASP  53  89.105   3.808  -6.174
  418    HB3  ASP  53           HB1      ASP  53  87.481   3.121  -6.229
  419    H    ILE  54           HN       ILE  54  86.482   5.100  -3.139
  420    HA   ILE  54           HA       ILE  54  84.691   2.947  -2.245
  421    HB   ILE  54           HB       ILE  54  85.141   5.779  -1.595
  422   HG12  ILE  54          HG12      ILE  54  84.135   4.969   0.580
  423   HG13  ILE  54          HG11      ILE  54  83.891   3.400  -0.189
  424   HG21  ILE  54          HG21      ILE  54  82.310   4.730  -1.854
  425   HG22  ILE  54          HG22      ILE  54  82.997   6.147  -2.648
  426   HG23  ILE  54          HG23      ILE  54  82.743   6.150  -0.903
  427   HD11  ILE  54          HD11      ILE  54  86.520   4.811   0.322
  428   HD12  ILE  54          HD12      ILE  54  86.373   3.405  -0.732
  429   HD13  ILE  54          HD13      ILE  54  85.982   3.266   0.982
  430    HA   PRO  55           HA       PRO  55  82.143   3.335  -5.885
  431    HB2  PRO  55           HB2      PRO  55  79.978   1.916  -5.076
  432    HB3  PRO  55           HB1      PRO  55  81.538   1.141  -5.419
  433    HG2  PRO  55           HG2      PRO  55  80.343   1.873  -2.791
  434    HG3  PRO  55           HG1      PRO  55  81.230   0.413  -3.260
  435    HD2  PRO  55           HD2      PRO  55  82.375   2.509  -1.883
  436    HD3  PRO  55           HD1      PRO  55  83.292   1.399  -2.926
  437    H    GLY  56           HN       GLY  56  82.053   5.616  -4.070
  438    HA2  GLY  56           HA2      GLY  56  80.695   7.500  -3.723
  439    HA3  GLY  56           HA1      GLY  56  79.589   6.815  -4.915
  440    H    MET  57           HN       MET  57  80.467   6.764  -1.488
  441    HA   MET  57           HA       MET  57  78.663   4.970  -0.405
  442    HB2  MET  57           HB2      MET  57  78.618   6.345   1.600
  443    HB3  MET  57           HB1      MET  57  80.237   6.416   0.903
  444    HG2  MET  57           HG2      MET  57  79.428   8.527  -0.329
  445    HG3  MET  57           HG1      MET  57  78.062   8.508   0.787
  446    HE1  MET  57           HE1      MET  57  78.772  10.855   1.261
  447    HE2  MET  57           HE2      MET  57  79.620  11.171   2.772
  448    HE3  MET  57           HE3      MET  57  78.196  10.134   2.769
  449    H    GLU  58           HN       GLU  58  77.920   8.283  -1.498
  450    HA   GLU  58           HA       GLU  58  75.164   7.502  -2.054
  451    HB2  GLU  58           HB2      GLU  58  75.216   7.978   0.449
  452    HB3  GLU  58           HB1      GLU  58  75.588   9.652   0.035
  453    HG2  GLU  58           HG2      GLU  58  73.520   9.765  -1.323
  454    HG3  GLU  58           HG1      GLU  58  73.139   8.105  -0.865
  455    H    GLY  59           HN       GLY  59  74.190   8.971  -3.488
  456    HA2  GLY  59           HA2      GLY  59  75.165  11.658  -3.890
  457    HA3  GLY  59           HA1      GLY  59  75.799  10.570  -5.126
  458    H1U  RCY  60           H1U      RCY  60  75.596   4.016  -5.230
  459    H1S  RCY  60           H1S      RCY  60  72.383   6.901  -7.432
  460    HB1  RCY  60           HB1      RCY  60  70.814   9.436  -7.580
  461    HB2  RCY  60           HB2      RCY  60  71.180   8.072  -6.523
  462    HA   RCY  60           HA       RCY  60  71.222  11.006  -5.925
  463    HN1  RCY  60           HN1      RCY  60  72.901   9.289  -4.195
  464    H    GLY  61           HN       GLY  61  69.181   8.925  -6.156
  465    HA2  GLY  61           HA2      GLY  61  68.166   9.046  -3.371
  466    HA3  GLY  61           HA1      GLY  61  67.193   8.707  -4.806
  467    H    THR  62           HN       THR  62  66.445   6.640  -4.658
  468    HA   THR  62           HA       THR  62  68.105   4.379  -4.842
  469    HB   THR  62           HB       THR  62  68.987   4.460  -2.707
  470    HG1  THR  62           HG1      THR  62  67.457   3.224  -1.307
  471   HG21  THR  62          HG21      THR  62  67.221   5.188  -0.793
  472   HG22  THR  62          HG22      THR  62  66.553   6.072  -2.165
  473   HG23  THR  62          HG23      THR  62  68.222   6.348  -1.666
  474    H    ASP  63           HN       ASP  63  65.297   5.722  -5.239
  475    HA   ASP  63           HA       ASP  63  63.355   3.873  -4.223
  476    HB2  ASP  63           HB2      ASP  63  63.170   5.416  -6.827
  477    HB3  ASP  63           HB1      ASP  63  61.835   4.842  -5.826
  478    H    ILE  64           HN       ILE  64  64.827   1.942  -4.664
  479    HA   ILE  64           HA       ILE  64  65.627   0.203  -6.069
  480    HB   ILE  64           HB       ILE  64  63.549  -0.711  -5.364
  481   HG12  ILE  64          HG12      ILE  64  63.078  -0.957  -8.295
  482   HG13  ILE  64          HG11      ILE  64  64.673  -1.431  -7.710
  483   HG21  ILE  64          HG21      ILE  64  61.414  -0.107  -6.533
  484   HG22  ILE  64          HG22      ILE  64  62.298   1.136  -7.419
  485   HG23  ILE  64          HG23      ILE  64  62.139   1.248  -5.666
  486   HD11  ILE  64          HD11      ILE  64  63.672  -2.978  -6.111
  487   HD12  ILE  64          HD12      ILE  64  63.053  -3.331  -7.724
  488   HD13  ILE  64          HD13      ILE  64  62.053  -2.448  -6.570
  489    H    THR  65           HN       THR  65  66.798   1.833  -7.464
  490    HA   THR  65           HA       THR  65  65.695   2.802  -9.904
  491    HB   THR  65           HB       THR  65  68.544   1.811  -9.592
  492    HG1  THR  65           HG1      THR  65  67.603   3.273  -7.881
  493   HG21  THR  65          HG21      THR  65  69.053   3.533 -11.206
  494   HG22  THR  65          HG22      THR  65  67.410   4.168 -11.119
  495   HG23  THR  65          HG23      THR  65  67.708   2.586 -11.840
  496    H    VAL  66           HN       VAL  66  66.580  -0.323  -8.832
  497    HA   VAL  66           HA       VAL  66  65.455  -1.585 -11.206
  498    HB   VAL  66           HB       VAL  66  67.774  -3.027 -11.172
  499   HG11  VAL  66          HG11      VAL  66  67.466  -0.481 -12.783
  500   HG12  VAL  66          HG12      VAL  66  66.545  -1.948 -13.115
  501   HG13  VAL  66          HG13      VAL  66  68.302  -1.959 -13.260
  502   HG21  VAL  66          HG21      VAL  66  68.667  -1.278  -9.515
  503   HG22  VAL  66          HG22      VAL  66  68.686  -0.158 -10.877
  504   HG23  VAL  66          HG23      VAL  66  69.679  -1.615 -10.919
  505    H    ILE  67           HN       ILE  67  67.885  -2.760  -8.901
  506    HA   ILE  67           HA       ILE  67  65.765  -4.151  -7.377
  507    HB   ILE  67           HB       ILE  67  66.818  -5.649  -9.229
  508   HG12  ILE  67          HG12      ILE  67  67.130  -6.741  -6.433
  509   HG13  ILE  67          HG11      ILE  67  65.539  -6.322  -7.068
  510   HG21  ILE  67          HG21      ILE  67  68.990  -6.453  -8.926
  511   HG22  ILE  67          HG22      ILE  67  69.017  -6.024  -7.215
  512   HG23  ILE  67          HG23      ILE  67  69.166  -4.766  -8.442
  513   HD11  ILE  67          HD11      ILE  67  66.523  -8.766  -7.391
  514   HD12  ILE  67          HD12      ILE  67  67.343  -8.011  -8.757
  515   HD13  ILE  67          HD13      ILE  67  65.582  -7.998  -8.669
  516    H1U  RCY  68           H1U      RCY  68  70.450  -0.941   0.338
  517    H1S  RCY  68           H1S      RCY  68  68.915   1.027  -3.186
  518    HB1  RCY  68           HB1      RCY  68  67.513  -1.757  -2.432
  519    HB2  RCY  68           HB2      RCY  68  66.083  -2.097  -3.399
  520    HA   RCY  68           HA       RCY  68  68.816  -2.147  -4.666
  521    HN1  RCY  68           HN1      RCY  68  66.174  -2.795  -5.578
  522    HA   PRO  69           HA       PRO  69  70.309  -5.739  -2.593
  523    HB2  PRO  69           HB2      PRO  69  70.340  -4.212  -0.021
  524    HB3  PRO  69           HB1      PRO  69  71.644  -5.124  -0.807
  525    HG2  PRO  69           HG2      PRO  69  71.579  -2.460  -0.853
  526    HG3  PRO  69           HG1      PRO  69  72.165  -3.398  -2.237
  527    HD2  PRO  69           HD2      PRO  69  69.588  -1.921  -1.922
  528    HD3  PRO  69           HD1      PRO  69  70.533  -2.243  -3.393
  529    H    TRP  70           HN       TRP  70  67.405  -4.230  -1.622
  530    HA   TRP  70           HA       TRP  70  66.720  -6.171   0.453
  531    HD1  TRP  70           HD1      TRP  70  65.841  -4.850  -2.891
  532    HE1  TRP  70           HE1      TRP  70  63.903  -4.033  -4.379
  533    HE3  TRP  70           HE3      TRP  70  62.516  -3.410   0.707
  534    HZ2  TRP  70           HZ2      TRP  70  61.283  -2.913  -4.082
  535    HZ3  TRP  70           HZ3      TRP  70  60.313  -2.474   0.079
  536    HH2  TRP  70           HH2      TRP  70  59.690  -2.223  -2.306
  537    HB2  TRP  70           HB2      TRP  70  64.702  -4.982   0.707
  538    HB3  TRP  70           HB1      TRP  70  65.866  -3.741   0.260
  539    H    GLU  71           HN       GLU  71  67.105  -6.591  -2.740
  540    HA   GLU  71           HA       GLU  71  64.976  -8.689  -2.830
  541    HB2  GLU  71           HB2      GLU  71  65.535  -6.487  -4.778
  542    HB3  GLU  71           HB1      GLU  71  65.085  -8.062  -5.434
  543    HG2  GLU  71           HG2      GLU  71  63.059  -8.073  -4.025
  544    HG3  GLU  71           HG1      GLU  71  63.505  -6.497  -3.370
  545    H    ALA  72           HN       ALA  72  67.719  -7.541  -4.841
  546    HA   ALA  72           HA       ALA  72  68.487 -10.288  -5.453
  547    HB1  ALA  72           HB1      ALA  72  68.835  -8.391  -7.043
  548    HB2  ALA  72           HB2      ALA  72  70.320  -9.279  -6.705
  549    HB3  ALA  72           HB3      ALA  72  70.028  -7.721  -5.932
  550    H1U  RCY  73           H1U      RCY  73  74.176  -5.639   0.830
  551    H1S  RCY  73           H1S      RCY  73  72.901 -10.029   0.835
  552    HB1  RCY  73           HB1      RCY  73  69.091 -11.585  -0.607
  553    HB2  RCY  73           HB2      RCY  73  68.924  -9.856  -0.299
  554    HA   RCY  73           HA       RCY  73  71.023  -9.474  -1.614
  555    HN1  RCY  73           HN1      RCY  73  68.517 -10.346  -2.792
  556    H    ASN  74           HN       ASN  74  72.339 -10.487  -3.436
  557    HA   ASN  74           HA       ASN  74  72.563 -13.393  -3.482
  558    HB2  ASN  74           HB2      ASN  74  74.279 -11.189  -4.659
  559    HB3  ASN  74           HB1      ASN  74  74.581 -12.908  -4.917
  560   HD21  ASN  74          HD21      ASN  74  73.220 -14.036  -6.405
  561   HD22  ASN  74          HD22      ASN  74  71.992 -13.274  -7.296
  562    H    HIS  75           HN       HIS  75  75.684 -12.382  -3.582
  563    HA   HIS  75           HA       HIS  75  76.221 -13.465  -0.894
  564    HD1  HIS  75           HD1      HIS  75  78.223 -14.360  -4.868
  565    HD2  HIS  75           HD2      HIS  75  76.768 -15.857  -1.257
  566    HE1  HIS  75           HE1      HIS  75  77.662 -16.795  -5.278
  567    HE2  HIS  75           HE2      HIS  75  76.775 -17.719  -3.088
  568    HB2  HIS  75           HB2      HIS  75  78.056 -12.572  -3.138
  569    HB3  HIS  75           HB1      HIS  75  78.616 -13.262  -1.615
  570    H1U  RCY  76           H1U      RCY  76  72.436  -3.540   2.281
  571    H1S  RCY  76           H1S      RCY  76  74.922  -6.525   0.904
  572    HB1  RCY  76           HB1      RCY  76  75.614  -9.949   1.980
  573    HB2  RCY  76           HB2      RCY  76  75.640  -9.325   0.331
  574    HA   RCY  76           HA       RCY  76  78.156  -9.529   0.383
  575    HN1  RCY  76           HN1      RCY  76  77.351 -12.278   0.743
  576    H    GLU  77           HN       GLU  77  79.443 -11.737   1.479
  577    HA   GLU  77           HA       GLU  77  79.168 -11.819   4.364
  578    HB2  GLU  77           HB2      GLU  77  80.258 -13.531   2.636
  579    HB3  GLU  77           HB1      GLU  77  81.719 -12.621   3.009
  580    HG2  GLU  77           HG2      GLU  77  81.635 -14.419   4.589
  581    HG3  GLU  77           HG1      GLU  77  81.161 -12.967   5.471
  582    H    LEU  78           HN       LEU  78  81.071 -11.200   5.813
  583    HA   LEU  78           HA       LEU  78  82.355  -9.452   6.714
  584    HG   LEU  78           HG       LEU  78  85.259 -10.636   4.876
  585    HB2  LEU  78           HB2      LEU  78  83.304  -9.650   3.858
  586    HB3  LEU  78           HB1      LEU  78  83.992  -8.450   4.947
  587   HD11  LEU  78          HD11      LEU  78  84.967  -8.949   6.902
  588   HD12  LEU  78          HD12      LEU  78  85.813 -10.481   7.124
  589   HD13  LEU  78          HD13      LEU  78  84.132 -10.320   7.633
  590   HD21  LEU  78          HD21      LEU  78  84.296 -12.596   5.861
  591   HD22  LEU  78          HD22      LEU  78  83.100 -11.994   4.714
  592   HD23  LEU  78          HD23      LEU  78  82.894 -11.697   6.440
  593    H    HIS  79           HN       HIS  79  83.198  -7.025   5.300
  594    HA   HIS  79           HA       HIS  79  82.383  -4.864   4.950
  595    HD1  HIS  79           HD1      HIS  79  78.944  -3.648   4.227
  596    HD2  HIS  79           HD2      HIS  79  78.735  -7.790   3.775
  597    HE1  HIS  79           HE1      HIS  79  76.518  -4.285   4.582
  598    HE2  HIS  79           HE2      HIS  79  76.377  -6.804   4.309
  599    HB2  HIS  79           HB2      HIS  79  81.078  -4.749   3.092
  600    HB3  HIS  79           HB1      HIS  79  81.151  -6.507   3.093
  601    H    GLU  80           HN       GLU  80  81.546  -6.578   7.358
  602    HA   GLU  80           HA       GLU  80  78.939  -5.894   8.212
  603    HB2  GLU  80           HB2      GLU  80  81.355  -6.054  10.029
  604    HB3  GLU  80           HB1      GLU  80  79.678  -6.426  10.430
  605    HG2  GLU  80           HG2      GLU  80  79.718  -8.301   8.811
  606    HG3  GLU  80           HG1      GLU  80  81.410  -7.946   8.458
  607    H    LEU  81           HN       LEU  81  80.719  -4.507  10.629
  608    HA   LEU  81           HA       LEU  81  79.785  -1.805   9.848
  609    HG   LEU  81           HG       LEU  81  78.584  -2.470  13.244
  610    HB2  LEU  81           HB2      LEU  81  80.855  -2.956  12.439
  611    HB3  LEU  81           HB1      LEU  81  80.491  -1.245  12.229
  612   HD11  LEU  81          HD11      LEU  81  77.631  -1.849  10.488
  613   HD12  LEU  81          HD12      LEU  81  78.467  -0.563  11.358
  614   HD13  LEU  81          HD13      LEU  81  77.014  -1.290  12.042
  615   HD21  LEU  81          HD21      LEU  81  79.231  -4.592  11.844
  616   HD22  LEU  81          HD22      LEU  81  78.200  -3.870  10.608
  617   HD23  LEU  81          HD23      LEU  81  77.529  -4.278  12.187
  618    H    ALA  82           HN       ALA  82  82.476  -3.516   9.224
  619    HA   ALA  82           HA       ALA  82  84.589  -1.742  10.050
  620    HB1  ALA  82           HB1      ALA  82  84.456  -3.748   7.780
  621    HB2  ALA  82           HB2      ALA  82  85.081  -4.041   9.403
  622    HB3  ALA  82           HB3      ALA  82  85.930  -2.942   8.316
  623    H    GLN  83           HN       GLN  83  84.081  -2.344   6.608
  624    HA   GLN  83           HA       GLN  83  84.196  -0.822   4.818
  625    HB2  GLN  83           HB2      GLN  83  82.589   1.128   6.433
  626    HB3  GLN  83           HB1      GLN  83  82.386   0.626   4.754
  627    HG2  GLN  83           HG2      GLN  83  81.751  -1.678   5.679
  628    HG3  GLN  83           HG1      GLN  83  81.624  -0.891   7.253
  629   HE21  GLN  83          HE21      GLN  83  79.474  -2.039   5.371
  630   HE22  GLN  83          HE22      GLN  83  78.361  -0.769   5.196
  631    H    TYR  84           HN       TYR  84  86.461  -0.397   5.164
  632    HA   TYR  84           HA       TYR  84  87.710   1.318   6.913
  633    HD1  TYR  84           HD1      TYR  84  88.990  -0.729   6.976
  634    HD2  TYR  84           HD2      TYR  84  88.436  -0.475   2.724
  635    HE1  TYR  84           HE1      TYR  84  89.206  -3.194   6.801
  636    HE2  TYR  84           HE2      TYR  84  88.652  -2.940   2.549
  637    HH   TYR  84           HH       TYR  84  89.262  -4.813   3.652
  638    HB2  TYR  84           HB2      TYR  84  88.395   1.475   3.986
  639    HB3  TYR  84           HB1      TYR  84  89.478   1.469   5.379
  640    H    GLY  85           HN       GLY  85  86.371   3.102   7.502
  641    HA2  GLY  85           HA2      GLY  85  86.313   5.517   7.294
  642    HA3  GLY  85           HA1      GLY  85  86.501   5.342   5.552
  643    H    ILE  86           HN       ILE  86  84.176   3.218   6.989
  644    HA   ILE  86           HA       ILE  86  81.965   5.134   6.554
  645    HB   ILE  86           HB       ILE  86  81.322   2.636   5.194
  646   HG12  ILE  86          HG12      ILE  86  83.611   4.284   4.066
  647   HG13  ILE  86          HG11      ILE  86  83.761   2.650   4.715
  648   HG21  ILE  86          HG21      ILE  86  81.508   5.482   4.162
  649   HG22  ILE  86          HG22      ILE  86  80.123   4.838   5.043
  650   HG23  ILE  86          HG23      ILE  86  80.557   4.167   3.471
  651   HD11  ILE  86          HD11      ILE  86  82.329   3.558   2.224
  652   HD12  ILE  86          HD12      ILE  86  81.909   2.033   3.003
  653   HD13  ILE  86          HD13      ILE  86  83.544   2.292   2.396
  654    H1U  RCY  87           H1U      RCY  87  77.860  -1.461   4.550
  655    H1S  RCY  87           H1S      RCY  87  77.758  -0.282   9.131
  656    HB1  RCY  87           HB1      RCY  87  77.753   2.888   7.701
  657    HB2  RCY  87           HB2      RCY  87  77.944   3.981   9.072
  658    HA   RCY  87           HA       RCY  87  79.993   2.915   9.739
  659    HN1  RCY  87           HN1      RCY  87  79.814   4.030   7.133
  Start of MODEL   24
    1    HA   MET   1           HA       MET   1  58.786 -18.314  -1.259
    2    HB2  MET   1           HB2      MET   1  60.609 -16.950  -3.249
    3    HB3  MET   1           HB1      MET   1  60.851 -17.153  -1.514
    4    HG2  MET   1           HG2      MET   1  60.841 -19.360  -3.592
    5    HG3  MET   1           HG1      MET   1  62.248 -18.755  -2.717
    6    HE1  MET   1           HE1      MET   1  63.149 -19.895  -0.711
    7    HE2  MET   1           HE2      MET   1  62.129 -20.101   0.712
    8    HE3  MET   1           HE3      MET   1  62.204 -18.535  -0.092
    9    H    ASN   2           HN       ASN   2  57.116 -17.224  -3.870
   10    HA   ASN   2           HA       ASN   2  55.939 -15.245  -4.351
   11    HB2  ASN   2           HB2      ASN   2  55.076 -16.002  -2.038
   12    HB3  ASN   2           HB1      ASN   2  56.091 -14.719  -1.379
   13   HD21  ASN   2          HD21      ASN   2  55.377 -13.420  -4.254
   14   HD22  ASN   2          HD22      ASN   2  53.914 -12.634  -3.905
   15    H    LEU   3           HN       LEU   3  56.155 -12.830  -2.560
   16    HA   LEU   3           HA       LEU   3  58.438 -11.627  -3.920
   17    HG   LEU   3           HG       LEU   3  58.962  -9.366  -2.657
   18    HB2  LEU   3           HB2      LEU   3  56.250 -10.442  -3.401
   19    HB3  LEU   3           HB1      LEU   3  56.753 -10.417  -1.712
   20   HD11  LEU   3          HD11      LEU   3  56.962  -8.900  -4.884
   21   HD12  LEU   3          HD12      LEU   3  58.547  -9.661  -5.011
   22   HD13  LEU   3          HD13      LEU   3  58.423  -7.934  -4.678
   23   HD21  LEU   3          HD21      LEU   3  56.324  -7.867  -2.553
   24   HD22  LEU   3          HD22      LEU   3  57.913  -7.103  -2.509
   25   HD23  LEU   3          HD23      LEU   3  57.410  -8.167  -1.196
   26    H    GLU   4           HN       GLU   4  58.280 -10.248  -0.883
   27    HA   GLU   4           HA       GLU   4  60.601 -11.880   0.079
   28    HB2  GLU   4           HB2      GLU   4  60.120  -8.899   0.111
   29    HB3  GLU   4           HB1      GLU   4  61.259  -9.652   1.226
   30    HG2  GLU   4           HG2      GLU   4  61.361 -10.055  -1.773
   31    HG3  GLU   4           HG1      GLU   4  62.293  -8.817  -0.929
   32    HA   PRO   5           HA       PRO   5  58.597 -12.941   3.859
   33    HB2  PRO   5           HB2      PRO   5  60.761 -11.322   5.166
   34    HB3  PRO   5           HB1      PRO   5  60.164 -12.941   5.580
   35    HG2  PRO   5           HG2      PRO   5  62.434 -12.562   4.204
   36    HG3  PRO   5           HG1      PRO   5  61.381 -13.959   3.934
   37    HD2  PRO   5           HD2      PRO   5  61.888 -11.654   2.167
   38    HD3  PRO   5           HD1      PRO   5  61.186 -13.238   1.774
   39    HA   PRO   6           HA       PRO   6  56.489  -8.934   4.412
   40    HB2  PRO   6           HB2      PRO   6  54.056  -9.921   5.091
   41    HB3  PRO   6           HB1      PRO   6  54.638  -9.912   3.415
   42    HG2  PRO   6           HG2      PRO   6  54.519 -12.156   5.358
   43    HG3  PRO   6           HG1      PRO   6  54.231 -12.156   3.611
   44    HD2  PRO   6           HD2      PRO   6  56.596 -12.989   4.820
   45    HD3  PRO   6           HD1      PRO   6  56.452 -12.478   3.124
   46    H    LYS   7           HN       LYS   7  55.867  -7.734   6.282
   47    HA   LYS   7           HA       LYS   7  55.501  -9.062   8.856
   48    HB2  LYS   7           HB2      LYS   7  57.505  -7.752   9.843
   49    HB3  LYS   7           HB1      LYS   7  57.862  -9.217   8.929
   50    HG2  LYS   7           HG2      LYS   7  58.502  -7.980   6.997
   51    HG3  LYS   7           HG1      LYS   7  57.808  -6.488   7.632
   52    HD2  LYS   7           HD2      LYS   7  60.227  -6.402   7.894
   53    HD3  LYS   7           HD1      LYS   7  59.485  -6.553   9.487
   54    HE2  LYS   7           HE2      LYS   7  60.054  -8.845   9.662
   55    HE3  LYS   7           HE1      LYS   7  60.383  -8.981   7.935
   56    HZ1  LYS   7           HZ1      LYS   7  61.994  -7.621  10.007
   57    HZ2  LYS   7           HZ2      LYS   7  62.196  -7.281   8.355
   58    HZ3  LYS   7           HZ3      LYS   7  62.469  -8.852   8.941
   59    H    ALA   8           HN       ALA   8  57.016  -6.107   9.335
   60    HA   ALA   8           HA       ALA   8  54.932  -4.266   8.628
   61    HB1  ALA   8           HB1      ALA   8  54.886  -5.393  11.439
   62    HB2  ALA   8           HB2      ALA   8  53.565  -5.365  10.270
   63    HB3  ALA   8           HB3      ALA   8  54.124  -3.862  11.005
   64    H    GLU   9           HN       GLU   9  55.507  -2.113   9.239
   65    HA   GLU   9           HA       GLU   9  57.701  -1.617  11.088
   66    HB2  GLU   9           HB2      GLU   9  58.835  -2.479   8.976
   67    HB3  GLU   9           HB1      GLU   9  58.231  -1.035   8.164
   68    HG2  GLU   9           HG2      GLU   9  59.447   0.408   9.669
   69    HG3  GLU   9           HG1      GLU   9  59.900  -0.957  10.691
   70    H1U  RCY  10           H1U      RCY  10  52.489   5.474  15.761
   71    H1S  RCY  10           H1S      RCY  10  55.480   3.888  12.296
   72    HB1  RCY  10           HB1      RCY  10  57.644   4.265  11.061
   73    HB2  RCY  10           HB2      RCY  10  58.773   2.926  11.266
   74    HA   RCY  10           HA       RCY  10  55.838   2.327  11.290
   75    HN1  RCY  10           HN1      RCY  10  58.152   0.738  11.240
   76    H    ARG  11           HN       ARG  11  58.416   3.433   9.141
   77    HA   ARG  11           HA       ARG  11  56.824   3.089   6.724
   78    HE   ARG  11           HE       ARG  11  57.188   7.289  11.130
   79    HB2  ARG  11           HB2      ARG  11  56.618   5.555   6.291
   80    HB3  ARG  11           HB1      ARG  11  55.613   4.982   7.621
   81    HG2  ARG  11           HG2      ARG  11  58.132   5.632   8.747
   82    HG3  ARG  11           HG1      ARG  11  57.703   6.967   7.677
   83    HD2  ARG  11           HD2      ARG  11  55.507   7.156   8.769
   84    HD3  ARG  11           HD1      ARG  11  55.907   5.802   9.826
   85   HH11  ARG  11          HH21      ARG  11  56.598   8.524   7.966
   86   HH12  ARG  11          HH22      ARG  11  57.307  10.070   8.293
   87   HH21  ARG  11          HH11      ARG  11  58.117   9.301  11.576
   88   HH22  ARG  11          HH12      ARG  11  58.167  10.510  10.337
   89    H    SER  12           HN       SER  12  59.570   4.588   8.364
   90    HA   SER  12           HA       SER  12  61.308   3.842   6.130
   91    HG   SER  12           HG       SER  12  63.059   5.618   6.071
   92    HB2  SER  12           HB2      SER  12  60.726   5.895   5.151
   93    HB3  SER  12           HB1      SER  12  60.582   6.705   6.708
   94    H    ALA  13           HN       ALA  13  60.770   4.059   9.308
   95    HA   ALA  13           HA       ALA  13  62.145   4.000  11.209
   96    HB1  ALA  13           HB1      ALA  13  63.211   2.222   9.703
   97    HB2  ALA  13           HB2      ALA  13  64.252   2.910  10.949
   98    HB3  ALA  13           HB3      ALA  13  64.406   3.447   9.277
   99    H    THR  14           HN       THR  14  62.263   6.389   9.014
  100    HA   THR  14           HA       THR  14  63.541   8.261  10.742
  101    HB   THR  14           HB       THR  14  65.670   7.377  10.269
  102    HG1  THR  14           HG1      THR  14  65.319   9.658   9.638
  103   HG21  THR  14          HG21      THR  14  64.515   6.875   7.537
  104   HG22  THR  14          HG22      THR  14  65.279   5.734   8.643
  105   HG23  THR  14          HG23      THR  14  66.262   6.912   7.773
  106    H    ARG  15           HN       ARG  15  62.592   7.366   7.472
  107    HA   ARG  15           HA       ARG  15  61.565   8.619   5.778
  108    HE   ARG  15           HE       ARG  15  58.745  10.743   3.791
  109    HB2  ARG  15           HB2      ARG  15  60.032   9.132   7.750
  110    HB3  ARG  15           HB1      ARG  15  60.942  10.626   7.958
  111    HG2  ARG  15           HG2      ARG  15  59.256  11.377   6.556
  112    HG3  ARG  15           HG1      ARG  15  60.456  10.888   5.360
  113    HD2  ARG  15           HD2      ARG  15  59.322   8.586   5.395
  114    HD3  ARG  15           HD1      ARG  15  58.003   9.372   6.263
  115   HH11  ARG  15          HH21      ARG  15  56.896   8.257   5.304
  116   HH12  ARG  15          HH22      ARG  15  55.683   8.223   4.068
  117   HH21  ARG  15          HH11      ARG  15  57.172  10.713   2.168
  118   HH22  ARG  15          HH12      ARG  15  55.839   9.614   2.293
  119    H    VAL  16           HN       VAL  16  62.584  11.350   7.831
  120    HA   VAL  16           HA       VAL  16  64.939  11.931   6.261
  121    HB   VAL  16           HB       VAL  16  63.200  12.531   4.596
  122   HG11  VAL  16          HG11      VAL  16  62.325  14.802   6.342
  123   HG12  VAL  16          HG12      VAL  16  61.618  13.210   6.617
  124   HG13  VAL  16          HG13      VAL  16  61.452  13.989   5.043
  125   HG21  VAL  16          HG21      VAL  16  65.406  13.908   5.128
  126   HG22  VAL  16          HG22      VAL  16  64.251  15.154   5.600
  127   HG23  VAL  16          HG23      VAL  16  64.234  14.513   3.957
  128    H    MET  17           HN       MET  17  64.892  11.760   8.897
  129    HA   MET  17           HA       MET  17  64.075  13.913  10.493
  130    HB2  MET  17           HB2      MET  17  65.160  11.827  11.342
  131    HB3  MET  17           HB1      MET  17  66.706  12.420  10.736
  132    HG2  MET  17           HG2      MET  17  66.528  12.964  13.104
  133    HG3  MET  17           HG1      MET  17  66.435  14.454  12.166
  134    HE1  MET  17           HE1      MET  17  65.707  15.167  14.609
  135    HE2  MET  17           HE2      MET  17  64.019  15.658  14.726
  136    HE3  MET  17           HE3      MET  17  64.988  16.179  13.350
  137    H    GLY  18           HN       GLY  18  67.265  13.576   8.886
  138    HA2  GLY  18           HA2      GLY  18  68.539  15.297   7.860
  139    HA3  GLY  18           HA1      GLY  18  67.295  16.457   8.327
  140    H    GLY  19           HN       GLY  19  68.173  14.502  10.938
  141    HA2  GLY  19           HA2      GLY  19  69.184  16.638  12.501
  142    HA3  GLY  19           HA1      GLY  19  69.426  14.931  12.876
  143    HA   PRO  20           HA       PRO  20  73.597  16.967  12.140
  144    HB2  PRO  20           HB2      PRO  20  74.212  14.622  13.898
  145    HB3  PRO  20           HB1      PRO  20  74.846  16.278  13.965
  146    HG2  PRO  20           HG2      PRO  20  73.005  15.419  15.686
  147    HG3  PRO  20           HG1      PRO  20  73.002  17.081  15.073
  148    HD2  PRO  20           HD2      PRO  20  71.175  14.825  14.394
  149    HD3  PRO  20           HD1      PRO  20  70.863  16.575  14.381
  150    H1U  RCY  21           H1U      RCY  21  73.938   4.457  10.514
  151    H1S  RCY  21           H1S      RCY  21  74.070   9.204  11.383
  152    HB1  RCY  21           HB1      RCY  21  71.705  11.724   9.959
  153    HB2  RCY  21           HB2      RCY  21  72.706  11.457  11.387
  154    HA   RCY  21           HA       RCY  21  74.515  12.814  10.131
  155    HN1  RCY  21           HN1      RCY  21  72.143  13.925  11.485
  156    H    THR  22           HN       THR  22  75.006  13.473   8.100
  157    HA   THR  22           HA       THR  22  73.359  15.126   6.497
  158    HB   THR  22           HB       THR  22  74.932  14.630   4.677
  159    HG1  THR  22           HG1      THR  22  75.147  12.424   4.954
  160   HG21  THR  22          HG21      THR  22  75.670  16.153   6.457
  161   HG22  THR  22          HG22      THR  22  77.030  15.202   5.859
  162   HG23  THR  22          HG23      THR  22  76.268  14.783   7.394
  163    HA   PRO  23           HA       PRO  23  70.590  11.858   5.093
  164    HB2  PRO  23           HB2      PRO  23  68.894  13.400   3.639
  165    HB3  PRO  23           HB1      PRO  23  68.896  13.410   5.414
  166    HG2  PRO  23           HG2      PRO  23  70.093  15.369   3.521
  167    HG3  PRO  23           HG1      PRO  23  69.243  15.650   5.049
  168    HD2  PRO  23           HD2      PRO  23  71.998  15.683   4.787
  169    HD3  PRO  23           HD1      PRO  23  71.147  15.345   6.311
  170    H    ARG  24           HN       ARG  24  69.346  11.963   2.559
  171    HA   ARG  24           HA       ARG  24  71.221  10.791   0.847
  172    HE   ARG  24           HE       ARG  24  66.243   9.378   1.544
  173    HB2  ARG  24           HB2      ARG  24  68.887  12.463  -0.113
  174    HB3  ARG  24           HB1      ARG  24  69.625  11.083  -0.927
  175    HG2  ARG  24           HG2      ARG  24  68.971   9.699   1.119
  176    HG3  ARG  24           HG1      ARG  24  67.984  11.074   1.614
  177    HD2  ARG  24           HD2      ARG  24  67.025  10.931  -0.818
  178    HD3  ARG  24           HD1      ARG  24  67.667   9.289  -0.785
  179   HH11  ARG  24          HH21      ARG  24  65.585  10.329  -1.703
  180   HH12  ARG  24          HH22      ARG  24  63.884  10.022  -1.589
  181   HH21  ARG  24          HH11      ARG  24  64.026   8.971   1.712
  182   HH22  ARG  24          HH12      ARG  24  63.002   9.253   0.344
  183    H    LYS  25           HN       LYS  25  69.859  13.954  -0.041
  184    HA   LYS  25           HA       LYS  25  70.885  15.818  -1.023
  185    HB2  LYS  25           HB2      LYS  25  72.417  15.110   1.246
  186    HB3  LYS  25           HB1      LYS  25  73.591  15.401  -0.035
  187    HG2  LYS  25           HG2      LYS  25  73.259  17.543   0.895
  188    HG3  LYS  25           HG1      LYS  25  72.209  17.547  -0.522
  189    HD2  LYS  25           HD2      LYS  25  70.290  16.913   0.908
  190    HD3  LYS  25           HD1      LYS  25  71.343  16.949   2.323
  191    HE2  LYS  25           HE2      LYS  25  71.835  19.339   1.877
  192    HE3  LYS  25           HE1      LYS  25  70.733  19.295   0.500
  193    HZ1  LYS  25           HZ1      LYS  25  70.104  19.746   3.169
  194    HZ2  LYS  25           HZ2      LYS  25  69.447  18.232   2.766
  195    HZ3  LYS  25           HZ3      LYS  25  69.034  19.608   1.860
  196    H    GLY  26           HN       GLY  26  73.293  16.280  -2.182
  197    HA2  GLY  26           HA2      GLY  26  74.825  15.543  -3.846
  198    HA3  GLY  26           HA1      GLY  26  74.180  13.910  -3.678
  199    HA   PRO  27           HA       PRO  27  71.536  16.768  -6.745
  200    HB2  PRO  27           HB2      PRO  27  73.930  17.465  -8.375
  201    HB3  PRO  27           HB1      PRO  27  72.537  18.470  -7.929
  202    HG2  PRO  27           HG2      PRO  27  74.938  18.806  -6.814
  203    HG3  PRO  27           HG1      PRO  27  73.436  19.057  -5.909
  204    HD2  PRO  27           HD2      PRO  27  75.358  16.765  -5.772
  205    HD3  PRO  27           HD1      PRO  27  74.376  17.494  -4.481
  206    HA   PRO  28           HA       PRO  28  71.262  13.644  -9.861
  207    HB2  PRO  28           HB2      PRO  28  72.009  15.527 -12.061
  208    HB3  PRO  28           HB1      PRO  28  70.584  14.480 -11.907
  209    HG2  PRO  28           HG2      PRO  28  70.422  17.104 -11.517
  210    HG3  PRO  28           HG1      PRO  28  69.482  15.967 -10.535
  211    HD2  PRO  28           HD2      PRO  28  71.927  17.526  -9.789
  212    HD3  PRO  28           HD1      PRO  28  70.546  17.039  -8.779
  213    H    LYS  29           HN       LYS  29  72.502  12.352 -11.486
  214    HA   LYS  29           HA       LYS  29  74.487  11.553 -12.480
  215    HB2  LYS  29           HB2      LYS  29  75.071  14.157 -12.457
  216    HB3  LYS  29           HB1      LYS  29  76.168  13.661 -11.170
  217    HG2  LYS  29           HG2      LYS  29  77.602  13.170 -12.868
  218    HG3  LYS  29           HG1      LYS  29  76.621  11.716 -13.057
  219    HD2  LYS  29           HD2      LYS  29  76.020  14.329 -14.466
  220    HD3  LYS  29           HD1      LYS  29  76.960  13.025 -15.192
  221    HE2  LYS  29           HE2      LYS  29  74.086  12.876 -14.239
  222    HE3  LYS  29           HE1      LYS  29  74.653  12.789 -15.907
  223    HZ1  LYS  29           HZ1      LYS  29  74.413  10.713 -14.025
  224    HZ2  LYS  29           HZ2      LYS  29  76.050  10.874 -14.453
  225    HZ3  LYS  29           HZ3      LYS  29  74.876  10.616 -15.654
  226    H1U  RCY  30           H1U      RCY  30  77.260   4.394 -13.575
  227    H1S  RCY  30           H1S      RCY  30  78.611   6.042 -10.118
  228    HB1  RCY  30           HB1      RCY  30  77.755   8.242 -10.859
  229    HB2  RCY  30           HB2      RCY  30  76.023   8.024 -10.615
  230    HA   RCY  30           HA       RCY  30  76.216   9.806  -8.780
  231    HN1  RCY  30           HN1      RCY  30  76.560  10.533 -11.660
  232    H    LYS  31           HN       LYS  31  77.849  12.049 -10.203
  233    HA   LYS  31           HA       LYS  31  80.017  12.969 -10.055
  234    HB2  LYS  31           HB2      LYS  31  79.032  12.986  -7.668
  235    HB3  LYS  31           HB1      LYS  31  80.088  11.609  -7.358
  236    HG2  LYS  31           HG2      LYS  31  81.486  13.356  -6.735
  237    HG3  LYS  31           HG1      LYS  31  81.926  13.185  -8.435
  238    HD2  LYS  31           HD2      LYS  31  80.395  14.985  -9.051
  239    HD3  LYS  31           HD1      LYS  31  79.841  15.119  -7.382
  240    HE2  LYS  31           HE2      LYS  31  81.480  16.859  -7.762
  241    HE3  LYS  31           HE1      LYS  31  82.210  15.644  -6.713
  242    HZ1  LYS  31           HZ1      LYS  31  82.519  15.357  -9.613
  243    HZ2  LYS  31           HZ2      LYS  31  83.570  14.895  -8.361
  244    HZ3  LYS  31           HZ3      LYS  31  83.456  16.527  -8.819
  245    H    GLN  32           HN       GLN  32  80.422  10.981 -11.661
  246    HA   GLN  32           HA       GLN  32  81.936   8.743 -10.725
  247    HB2  GLN  32           HB2      GLN  32  82.507   9.843 -13.444
  248    HB3  GLN  32           HB1      GLN  32  82.168   8.185 -12.952
  249    HG2  GLN  32           HG2      GLN  32  80.178   8.702 -14.025
  250    HG3  GLN  32           HG1      GLN  32  79.780   9.197 -12.379
  251   HE21  GLN  32          HE21      GLN  32  78.958  11.284 -12.221
  252   HE22  GLN  32          HE22      GLN  32  79.246  12.534 -13.334
  253    H    ARG  33           HN       ARG  33  84.182   8.435 -10.569
  254    HA   ARG  33           HA       ARG  33  86.141  10.337 -11.426
  255    HE   ARG  33           HE       ARG  33  83.340  11.026  -6.357
  256    HB2  ARG  33           HB2      ARG  33  86.818  11.101  -9.093
  257    HB3  ARG  33           HB1      ARG  33  85.339  11.821  -9.726
  258    HG2  ARG  33           HG2      ARG  33  83.957  10.481  -8.364
  259    HG3  ARG  33           HG1      ARG  33  85.243   9.313  -8.055
  260    HD2  ARG  33           HD2      ARG  33  86.082  10.522  -6.331
  261    HD3  ARG  33           HD1      ARG  33  85.914  12.045  -7.204
  262   HH11  ARG  33          HH21      ARG  33  86.223  12.637  -5.370
  263   HH12  ARG  33          HH22      ARG  33  85.459  13.497  -4.076
  264   HH21  ARG  33          HH11      ARG  33  82.324  12.140  -4.673
  265   HH22  ARG  33          HH12      ARG  33  83.251  13.215  -3.681
  266    H    GLN  34           HN       GLN  34  86.336   7.788 -11.877
  267    HA   GLN  34           HA       GLN  34  87.626   5.857 -11.540
  268    HB2  GLN  34           HB2      GLN  34  89.283   7.521  -9.640
  269    HB3  GLN  34           HB1      GLN  34  89.811   6.195 -10.677
  270    HG2  GLN  34           HG2      GLN  34  89.281   7.577 -12.675
  271    HG3  GLN  34           HG1      GLN  34  88.839   8.913 -11.610
  272   HE21  GLN  34          HE21      GLN  34  90.518  10.352 -11.203
  273   HE22  GLN  34          HE22      GLN  34  92.171   9.975 -11.289
  274    H    THR  35           HN       THR  35  88.558   4.423  -9.651
  275    HA   THR  35           HA       THR  35  87.098   4.822  -7.104
  276    HB   THR  35           HB       THR  35  86.045   2.632  -7.179
  277    HG1  THR  35           HG1      THR  35  86.228   1.637  -9.426
  278   HG21  THR  35          HG21      THR  35  84.912   4.595  -8.289
  279   HG22  THR  35          HG22      THR  35  84.403   3.021  -8.900
  280   HG23  THR  35          HG23      THR  35  85.535   4.003  -9.829
  281    H    ARG  36           HN       ARG  36  89.723   5.114  -7.158
  282    HA   ARG  36           HA       ARG  36  91.768   4.277  -6.369
  283    HE   ARG  36           HE       ARG  36  88.046   2.863  -4.033
  284    HB2  ARG  36           HB2      ARG  36  89.905   2.295  -5.024
  285    HB3  ARG  36           HB1      ARG  36  91.587   2.584  -4.578
  286    HG2  ARG  36           HG2      ARG  36  91.123   4.808  -3.863
  287    HG3  ARG  36           HG1      ARG  36  89.537   4.804  -4.635
  288    HD2  ARG  36           HD2      ARG  36  90.257   2.885  -2.411
  289    HD3  ARG  36           HD1      ARG  36  89.546   4.469  -2.099
  290   HH11  ARG  36          HH21      ARG  36  88.626   3.688  -0.736
  291   HH12  ARG  36          HH22      ARG  36  87.049   3.213  -0.201
  292   HH21  ARG  36          HH11      ARG  36  85.983   2.238  -3.353
  293   HH22  ARG  36          HH12      ARG  36  85.552   2.392  -1.683
  294    H    GLN  37           HN       GLN  37  90.525   1.043  -6.115
  295    HA   GLN  37           HA       GLN  37  91.166   0.138  -8.765
  296    HB2  GLN  37           HB2      GLN  37  93.460   0.777  -7.609
  297    HB3  GLN  37           HB1      GLN  37  93.245  -0.769  -6.790
  298    HG2  GLN  37           HG2      GLN  37  93.315  -0.304  -9.786
  299    HG3  GLN  37           HG1      GLN  37  94.531  -1.141  -8.820
  300   HE21  GLN  37          HE21      GLN  37  91.614  -1.576 -10.597
  301   HE22  GLN  37          HE22      GLN  37  91.296  -3.173 -10.117
  302    H1U  RCY  38           H1U      RCY  38  82.345  -3.931  -6.323
  303    H1S  RCY  38           H1S      RCY  38  86.309  -3.316  -4.879
  304    HB1  RCY  38           HB1      RCY  38  88.109  -3.574  -5.587
  305    HB2  RCY  38           HB2      RCY  38  88.394  -2.252  -6.719
  306    HA   RCY  38           HA       RCY  38  90.052  -2.498  -4.216
  307    HN1  RCY  38           HN1      RCY  38  90.961  -0.634  -5.316
  308    H    LYS  39           HN       LYS  39  91.993  -3.774  -4.327
  309    HA   LYS  39           HA       LYS  39  92.652  -5.404  -6.607
  310    HB2  LYS  39           HB2      LYS  39  93.468  -6.342  -3.894
  311    HB3  LYS  39           HB1      LYS  39  94.436  -6.138  -5.352
  312    HG2  LYS  39           HG2      LYS  39  95.243  -4.347  -4.147
  313    HG3  LYS  39           HG1      LYS  39  93.859  -3.558  -4.903
  314    HD2  LYS  39           HD2      LYS  39  92.532  -4.379  -2.827
  315    HD3  LYS  39           HD1      LYS  39  94.118  -4.607  -2.090
  316    HE2  LYS  39           HE2      LYS  39  93.117  -2.014  -3.303
  317    HE3  LYS  39           HE1      LYS  39  93.186  -2.367  -1.576
  318    HZ1  LYS  39           HZ1      LYS  39  95.141  -1.203  -2.053
  319    HZ2  LYS  39           HZ2      LYS  39  95.434  -2.081  -3.478
  320    HZ3  LYS  39           HZ3      LYS  39  95.626  -2.826  -1.963
  321    H    SER  40           HN       SER  40  90.661  -6.460  -7.174
  322    HA   SER  40           HA       SER  40  88.994  -8.117  -7.019
  323    HG   SER  40           HG       SER  40  92.134  -9.606  -7.412
  324    HB2  SER  40           HB2      SER  40  91.247  -9.507  -5.539
  325    HB3  SER  40           HB1      SER  40  89.845 -10.299  -6.250
  326    H    LYS  41           HN       LYS  41  88.442  -9.991  -5.004
  327    HA   LYS  41           HA       LYS  41  88.036  -8.349  -2.547
  328    HB2  LYS  41           HB2      LYS  41  85.861 -10.009  -3.843
  329    HB3  LYS  41           HB1      LYS  41  85.702  -8.954  -2.439
  330    HG2  LYS  41           HG2      LYS  41  86.207  -6.994  -3.813
  331    HG3  LYS  41           HG1      LYS  41  86.464  -8.024  -5.223
  332    HD2  LYS  41           HD2      LYS  41  84.093  -8.833  -4.973
  333    HD3  LYS  41           HD1      LYS  41  83.868  -7.620  -3.713
  334    HE2  LYS  41           HE2      LYS  41  83.087  -6.587  -5.709
  335    HE3  LYS  41           HE1      LYS  41  84.690  -5.905  -5.436
  336    HZ1  LYS  41           HZ1      LYS  41  83.967  -6.927  -7.749
  337    HZ2  LYS  41           HZ2      LYS  41  84.534  -8.351  -7.015
  338    HZ3  LYS  41           HZ3      LYS  41  85.565  -7.011  -7.186
  339    HA   PRO  42           HA       PRO  42  89.404 -12.506  -1.278
  340    HB2  PRO  42           HB2      PRO  42  90.654 -11.758   1.013
  341    HB3  PRO  42           HB1      PRO  42  91.393 -11.539  -0.586
  342    HG2  PRO  42           HG2      PRO  42  90.076  -9.545   1.174
  343    HG3  PRO  42           HG1      PRO  42  91.469  -9.360   0.099
  344    HD2  PRO  42           HD2      PRO  42  88.865  -8.548  -0.504
  345    HD3  PRO  42           HD1      PRO  42  90.153  -8.818  -1.698
  346    HA   PRO  43           HA       PRO  43  86.201 -13.471   1.633
  347    HB2  PRO  43           HB2      PRO  43  87.261 -15.618   2.950
  348    HB3  PRO  43           HB1      PRO  43  86.699 -15.698   1.269
  349    HG2  PRO  43           HG2      PRO  43  89.471 -15.439   2.319
  350    HG3  PRO  43           HG1      PRO  43  88.863 -16.396   0.958
  351    HD2  PRO  43           HD2      PRO  43  90.141 -13.987   0.642
  352    HD3  PRO  43           HD1      PRO  43  88.934 -14.607  -0.506
  353    H    LYS  44           HN       LYS  44  85.616 -13.373   3.904
  354    HA   LYS  44           HA       LYS  44  85.767 -12.393   6.033
  355    HB2  LYS  44           HB2      LYS  44  88.584 -13.506   5.855
  356    HB3  LYS  44           HB1      LYS  44  87.743 -13.049   7.336
  357    HG2  LYS  44           HG2      LYS  44  86.002 -14.745   6.860
  358    HG3  LYS  44           HG1      LYS  44  86.876 -15.221   5.404
  359    HD2  LYS  44           HD2      LYS  44  88.859 -15.766   6.821
  360    HD3  LYS  44           HD1      LYS  44  87.895 -15.403   8.254
  361    HE2  LYS  44           HE2      LYS  44  87.239 -17.521   6.184
  362    HE3  LYS  44           HE1      LYS  44  87.907 -17.828   7.787
  363    HZ1  LYS  44           HZ1      LYS  44  85.209 -17.060   7.013
  364    HZ2  LYS  44           HZ2      LYS  44  85.813 -16.350   8.433
  365    HZ3  LYS  44           HZ3      LYS  44  85.734 -18.041   8.293
  366    H    LYS  45           HN       LYS  45  85.665 -10.175   5.729
  367    HA   LYS  45           HA       LYS  45  87.523  -8.505   4.463
  368    HB2  LYS  45           HB2      LYS  45  85.447  -8.138   6.561
  369    HB3  LYS  45           HB1      LYS  45  86.665  -6.867   6.464
  370    HG2  LYS  45           HG2      LYS  45  84.794  -6.305   4.997
  371    HG3  LYS  45           HG1      LYS  45  86.214  -6.672   4.017
  372    HD2  LYS  45           HD2      LYS  45  85.388  -8.961   3.651
  373    HD3  LYS  45           HD1      LYS  45  83.975  -8.618   4.650
  374    HE2  LYS  45           HE2      LYS  45  83.440  -6.720   3.052
  375    HE3  LYS  45           HE1      LYS  45  84.704  -7.353   1.998
  376    HZ1  LYS  45           HZ1      LYS  45  83.401  -9.010   1.332
  377    HZ2  LYS  45           HZ2      LYS  45  82.108  -8.156   2.030
  378    HZ3  LYS  45           HZ3      LYS  45  82.895  -9.378   2.909
  379    H    GLY  46           HN       GLY  46  89.697  -8.753   4.868
  380    HA2  GLY  46           HA2      GLY  46  90.743  -9.286   7.522
  381    HA3  GLY  46           HA1      GLY  46  91.704  -8.896   6.095
  382    H    VAL  47           HN       VAL  47  92.119  -6.677   5.613
  383    HA   VAL  47           HA       VAL  47  91.131  -4.632   7.505
  384    HB   VAL  47           HB       VAL  47  93.556  -3.869   7.855
  385   HG11  VAL  47          HG11      VAL  47  92.783  -6.553   9.036
  386   HG12  VAL  47          HG12      VAL  47  92.128  -5.008   9.577
  387   HG13  VAL  47          HG13      VAL  47  93.849  -5.349   9.760
  388   HG21  VAL  47          HG21      VAL  47  95.285  -5.557   7.583
  389   HG22  VAL  47          HG22      VAL  47  94.462  -5.351   6.037
  390   HG23  VAL  47          HG23      VAL  47  94.094  -6.745   7.053
  391    H    GLN  48           HN       GLN  48  90.429  -4.736   4.889
  392    HA   GLN  48           HA       GLN  48  92.205  -3.450   3.053
  393    HB2  GLN  48           HB2      GLN  48  90.134  -4.650   2.372
  394    HB3  GLN  48           HB1      GLN  48  89.171  -3.371   3.109
  395    HG2  GLN  48           HG2      GLN  48  89.377  -2.969   0.701
  396    HG3  GLN  48           HG1      GLN  48  90.245  -1.719   1.592
  397   HE21  GLN  48          HE21      GLN  48  92.557  -1.642   1.393
  398   HE22  GLN  48          HE22      GLN  48  93.418  -2.645   0.327
  399    H    GLY  49           HN       GLY  49  89.331  -1.996   4.630
  400    HA2  GLY  49           HA2      GLY  49  89.156   0.135   5.660
  401    HA3  GLY  49           HA1      GLY  49  90.871   0.395   5.341
  402    H1U  RCY  50           H1U      RCY  50  82.299  -1.297   4.435
  403    H1S  RCY  50           H1S      RCY  50  85.583   1.573   4.464
  404    HB1  RCY  50           HB1      RCY  50  87.262   3.510   1.599
  405    HB2  RCY  50           HB2      RCY  50  87.032   3.654   3.342
  406    HA   RCY  50           HA       RCY  50  89.493   2.704   1.863
  407    HN1  RCY  50           HN1      RCY  50  89.414   2.546   4.812
  408    H    GLY  51           HN       GLY  51  88.215   5.273   1.757
  409    HA2  GLY  51           HA2      GLY  51  88.566   7.545   2.327
  410    HA3  GLY  51           HA1      GLY  51  89.527   7.016   3.708
  411    H    ASP  52           HN       ASP  52  90.190   5.815   0.488
  412    HA   ASP  52           HA       ASP  52  92.908   6.909   0.646
  413    HB2  ASP  52           HB2      ASP  52  91.636   5.418  -1.663
  414    HB3  ASP  52           HB1      ASP  52  93.356   5.589  -1.314
  415    H    ASP  53           HN       ASP  53  89.953   7.490  -1.205
  416    HA   ASP  53           HA       ASP  53  90.828  10.178  -1.869
  417    HB2  ASP  53           HB2      ASP  53  91.367   8.011  -3.741
  418    HB3  ASP  53           HB1      ASP  53  90.285   9.204  -4.458
  419    H    ILE  54           HN       ILE  54  88.519   7.817  -1.407
  420    HA   ILE  54           HA       ILE  54  86.365   9.421  -2.717
  421    HB   ILE  54           HB       ILE  54  86.283   6.588  -1.635
  422   HG12  ILE  54          HG12      ILE  54  87.679   7.220  -3.781
  423   HG13  ILE  54          HG11      ILE  54  86.605   5.820  -3.817
  424   HG21  ILE  54          HG21      ILE  54  84.076   7.448  -1.549
  425   HG22  ILE  54          HG22      ILE  54  84.152   6.601  -3.094
  426   HG23  ILE  54          HG23      ILE  54  84.284   8.359  -3.045
  427   HD11  ILE  54          HD11      ILE  54  86.443   7.500  -5.779
  428   HD12  ILE  54          HD12      ILE  54  85.627   8.557  -4.627
  429   HD13  ILE  54          HD13      ILE  54  84.937   6.983  -5.021
  430    HA   PRO  55           HA       PRO  55  85.703  10.413   1.686
  431    HB2  PRO  55           HB2      PRO  55  84.576  12.849   1.317
  432    HB3  PRO  55           HB1      PRO  55  86.326  12.588   1.182
  433    HG2  PRO  55           HG2      PRO  55  84.295  12.903  -0.962
  434    HG3  PRO  55           HG1      PRO  55  85.971  13.472  -0.898
  435    HD2  PRO  55           HD2      PRO  55  85.109  11.193  -2.263
  436    HD3  PRO  55           HD1      PRO  55  86.787  11.518  -1.778
  437    H    GLY  56           HN       GLY  56  83.906   8.656   0.281
  438    HA2  GLY  56           HA2      GLY  56  81.708   7.868   0.514
  439    HA3  GLY  56           HA1      GLY  56  81.502   9.064   1.795
  440    H    MET  57           HN       MET  57  81.863   9.038  -1.774
  441    HA   MET  57           HA       MET  57  80.386  11.502  -2.092
  442    HB2  MET  57           HB2      MET  57  80.480  11.023  -4.472
  443    HB3  MET  57           HB1      MET  57  82.035  10.600  -3.757
  444    HG2  MET  57           HG2      MET  57  81.656   8.666  -4.958
  445    HG3  MET  57           HG1      MET  57  80.827   8.231  -3.464
  446    HE1  MET  57           HE1      MET  57  80.280   6.612  -5.592
  447    HE2  MET  57           HE2      MET  57  80.358   7.626  -7.031
  448    HE3  MET  57           HE3      MET  57  78.841   6.843  -6.593
  449    H    GLU  58           HN       GLU  58  78.204  11.770  -2.100
  450    HA   GLU  58           HA       GLU  58  76.494   9.317  -2.266
  451    HB2  GLU  58           HB2      GLU  58  76.105  11.965  -0.854
  452    HB3  GLU  58           HB1      GLU  58  74.786  10.821  -1.104
  453    HG2  GLU  58           HG2      GLU  58  76.078   9.076   0.077
  454    HG3  GLU  58           HG1      GLU  58  77.386  10.229   0.343
  455    H    GLY  59           HN       GLY  59  74.117  10.157  -2.978
  456    HA2  GLY  59           HA2      GLY  59  73.032  11.845  -4.506
  457    HA3  GLY  59           HA1      GLY  59  74.517  11.791  -5.457
  458    H1U  RCY  60           H1U      RCY  60  75.323   4.466   0.225
  459    H1S  RCY  60           H1S      RCY  60  73.036   6.486  -3.276
  460    HB1  RCY  60           HB1      RCY  60  73.681   7.385  -7.090
  461    HB2  RCY  60           HB2      RCY  60  72.882   6.010  -6.326
  462    HA   RCY  60           HA       RCY  60  71.572   8.269  -6.586
  463    HN1  RCY  60           HN1      RCY  60  72.587   9.153  -4.014
  464    H    GLY  61           HN       GLY  61  70.957   8.706  -3.585
  465    HA2  GLY  61           HA2      GLY  61  70.030   6.022  -2.787
  466    HA3  GLY  61           HA1      GLY  61  69.887   7.493  -1.825
  467    H    THR  62           HN       THR  62  68.893   8.309  -4.869
  468    HA   THR  62           HA       THR  62  66.029   7.807  -4.153
  469    HB   THR  62           HB       THR  62  65.474   9.817  -5.304
  470    HG1  THR  62           HG1      THR  62  68.120   9.662  -6.303
  471   HG21  THR  62          HG21      THR  62  68.147  10.466  -4.055
  472   HG22  THR  62          HG22      THR  62  66.739  10.026  -3.087
  473   HG23  THR  62          HG23      THR  62  66.696  11.468  -4.102
  474    H    ASP  63           HN       ASP  63  68.329   7.877  -6.872
  475    HA   ASP  63           HA       ASP  63  66.444   6.841  -8.797
  476    HB2  ASP  63           HB2      ASP  63  68.435   8.057  -9.520
  477    HB3  ASP  63           HB1      ASP  63  69.477   6.837  -8.788
  478    H    ILE  64           HN       ILE  64  67.323   5.347  -6.095
  479    HA   ILE  64           HA       ILE  64  67.278   2.657  -7.388
  480    HB   ILE  64           HB       ILE  64  68.948   3.291  -4.945
  481   HG12  ILE  64          HG12      ILE  64  69.710   4.584  -6.976
  482   HG13  ILE  64          HG11      ILE  64  70.895   3.420  -6.380
  483   HG21  ILE  64          HG21      ILE  64  70.042   1.150  -5.594
  484   HG22  ILE  64          HG22      ILE  64  68.891   0.989  -6.920
  485   HG23  ILE  64          HG23      ILE  64  68.325   0.944  -5.251
  486   HD11  ILE  64          HD11      ILE  64  70.892   2.373  -8.369
  487   HD12  ILE  64          HD12      ILE  64  69.743   3.563  -8.981
  488   HD13  ILE  64          HD13      ILE  64  69.159   2.081  -8.224
  489    H    THR  65           HN       THR  65  65.876   4.818  -5.297
  490    HA   THR  65           HA       THR  65  65.137   3.521  -2.982
  491    HB   THR  65           HB       THR  65  62.994   4.792  -4.675
  492    HG1  THR  65           HG1      THR  65  64.477   6.290  -4.972
  493   HG21  THR  65          HG21      THR  65  62.275   5.685  -2.527
  494   HG22  THR  65          HG22      THR  65  63.722   5.048  -1.744
  495   HG23  THR  65          HG23      THR  65  62.503   3.942  -2.379
  496    H    VAL  66           HN       VAL  66  63.541   3.074  -6.152
  497    HA   VAL  66           HA       VAL  66  61.563   1.266  -5.574
  498    HB   VAL  66           HB       VAL  66  63.497   0.652  -7.809
  499   HG11  VAL  66          HG11      VAL  66  60.468   0.669  -7.715
  500   HG12  VAL  66          HG12      VAL  66  61.445  -0.760  -7.375
  501   HG13  VAL  66          HG13      VAL  66  61.493  -0.019  -8.975
  502   HG21  VAL  66          HG21      VAL  66  63.304   3.022  -7.971
  503   HG22  VAL  66          HG22      VAL  66  61.600   2.990  -7.518
  504   HG23  VAL  66          HG23      VAL  66  62.104   2.389  -9.098
  505    H    ILE  67           HN       ILE  67  64.889   0.180  -6.351
  506    HA   ILE  67           HA       ILE  67  64.546  -1.975  -4.313
  507    HB   ILE  67           HB       ILE  67  65.545  -2.352  -7.149
  508   HG12  ILE  67          HG12      ILE  67  63.073  -2.338  -6.828
  509   HG13  ILE  67          HG11      ILE  67  63.672  -3.925  -7.312
  510   HG21  ILE  67          HG21      ILE  67  65.688  -4.794  -6.315
  511   HG22  ILE  67          HG22      ILE  67  65.676  -4.102  -4.693
  512   HG23  ILE  67          HG23      ILE  67  66.972  -3.692  -5.817
  513   HD11  ILE  67          HD11      ILE  67  62.447  -4.645  -5.526
  514   HD12  ILE  67          HD12      ILE  67  62.468  -3.063  -4.747
  515   HD13  ILE  67          HD13      ILE  67  63.863  -4.133  -4.607
  516    H1U  RCY  68           H1U      RCY  68  68.274   7.166  -0.504
  517    H1S  RCY  68           H1S      RCY  68  69.169   2.420  -0.871
  518    HB1  RCY  68           HB1      RCY  68  68.087   0.719  -1.370
  519    HB2  RCY  68           HB2      RCY  68  67.227   1.333  -2.778
  520    HA   RCY  68           HA       RCY  68  68.791  -0.646  -3.892
  521    HN1  RCY  68           HN1      RCY  68  65.967  -0.870  -2.928
  522    HA   PRO  69           HA       PRO  69  70.347  -4.012  -1.519
  523    HB2  PRO  69           HB2      PRO  69  71.647  -1.871   0.128
  524    HB3  PRO  69           HB1      PRO  69  72.336  -3.378  -0.502
  525    HG2  PRO  69           HG2      PRO  69  72.620  -0.920  -1.691
  526    HG3  PRO  69           HG1      PRO  69  72.777  -2.471  -2.527
  527    HD2  PRO  69           HD2      PRO  69  70.764  -0.459  -2.942
  528    HD3  PRO  69           HD1      PRO  69  70.893  -2.044  -3.737
  529    H    TRP  70           HN       TRP  70  69.541  -1.277   0.727
  530    HA   TRP  70           HA       TRP  70  68.892  -3.007   2.896
  531    HD1  TRP  70           HD1      TRP  70  69.738   1.132   1.717
  532    HE1  TRP  70           HE1      TRP  70  68.356   2.598   0.111
  533    HE3  TRP  70           HE3      TRP  70  65.178  -1.121   2.172
  534    HZ2  TRP  70           HZ2      TRP  70  65.666   2.790  -0.856
  535    HZ3  TRP  70           HZ3      TRP  70  63.228  -0.279   0.901
  536    HH2  TRP  70           HH2      TRP  70  63.463   1.670  -0.611
  537    HB2  TRP  70           HB2      TRP  70  67.485  -1.051   3.730
  538    HB3  TRP  70           HB1      TRP  70  69.184  -0.703   3.429
  539    H    GLU  71           HN       GLU  71  67.438  -2.934  -0.040
  540    HA   GLU  71           HA       GLU  71  64.711  -3.505   1.025
  541    HB2  GLU  71           HB2      GLU  71  65.243  -1.864  -0.957
  542    HB3  GLU  71           HB1      GLU  71  65.408  -3.343  -1.902
  543    HG2  GLU  71           HG2      GLU  71  62.978  -2.645  -0.225
  544    HG3  GLU  71           HG1      GLU  71  63.090  -2.403  -1.969
  545    H    ALA  72           HN       ALA  72  66.609  -4.777  -1.728
  546    HA   ALA  72           HA       ALA  72  65.461  -7.431  -1.362
  547    HB1  ALA  72           HB1      ALA  72  67.770  -6.561  -3.126
  548    HB2  ALA  72           HB2      ALA  72  66.072  -6.513  -3.600
  549    HB3  ALA  72           HB3      ALA  72  66.852  -8.060  -3.270
  550    H1U  RCY  73           H1U      RCY  73  68.520  -5.559  -6.166
  551    H1S  RCY  73           H1S      RCY  73  69.894  -6.120  -2.414
  552    HB1  RCY  73           HB1      RCY  73  71.760  -7.016   0.712
  553    HB2  RCY  73           HB2      RCY  73  70.803  -5.722  -0.010
  554    HA   RCY  73           HA       RCY  73  69.969  -8.623  -0.185
  555    HN1  RCY  73           HN1      RCY  73  68.861  -6.275  -1.301
  556    H    ASN  74           HN       ASN  74  68.187  -6.019   1.329
  557    HA   ASN  74           HA       ASN  74  67.346  -5.824   3.509
  558    HB2  ASN  74           HB2      ASN  74  68.310  -8.599   4.148
  559    HB3  ASN  74           HB1      ASN  74  66.826  -7.791   4.653
  560   HD21  ASN  74          HD21      ASN  74  67.752 -10.290   2.766
  561   HD22  ASN  74          HD22      ASN  74  66.586 -10.200   1.536
  562    H    HIS  75           HN       HIS  75  70.101  -8.046   4.033
  563    HA   HIS  75           HA       HIS  75  71.289  -5.960   5.825
  564    HD1  HIS  75           HD1      HIS  75  71.465  -5.794   8.045
  565    HD2  HIS  75           HD2      HIS  75  74.087  -9.015   7.652
  566    HE1  HIS  75           HE1      HIS  75  73.265  -5.470   9.797
  567    HE2  HIS  75           HE2      HIS  75  74.867  -7.424   9.568
  568    HB2  HIS  75           HB2      HIS  75  70.590  -8.280   6.745
  569    HB3  HIS  75           HB1      HIS  75  71.989  -8.897   5.867
  570    H1U  RCY  76           H1U      RCY  76  70.503  -1.137   6.223
  571    H1S  RCY  76           H1S      RCY  76  73.388  -3.872   5.262
  572    HB1  RCY  76           HB1      RCY  76  74.665  -3.777   3.527
  573    HB2  RCY  76           HB2      RCY  76  76.310  -4.405   3.474
  574    HA   RCY  76           HA       RCY  76  74.588  -6.125   2.889
  575    HN1  RCY  76           HN1      RCY  76  73.462  -5.401   5.520
  576    H    GLU  77           HN       GLU  77  75.845  -6.031   6.251
  577    HA   GLU  77           HA       GLU  77  78.214  -7.475   5.790
  578    HB2  GLU  77           HB2      GLU  77  76.403  -7.441   8.222
  579    HB3  GLU  77           HB1      GLU  77  78.007  -8.177   8.209
  580    HG2  GLU  77           HG2      GLU  77  78.960  -5.980   7.489
  581    HG3  GLU  77           HG1      GLU  77  77.355  -5.267   7.656
  582    H    LEU  78           HN       LEU  78  78.425  -9.817   6.960
  583    HA   LEU  78           HA       LEU  78  77.881 -12.102   6.863
  584    HG   LEU  78           HG       LEU  78  76.246 -13.777   6.801
  585    HB2  LEU  78           HB2      LEU  78  75.490 -10.922   7.381
  586    HB3  LEU  78           HB1      LEU  78  75.141 -11.615   5.800
  587   HD11  LEU  78          HD11      LEU  78  75.450 -12.212   9.274
  588   HD12  LEU  78          HD12      LEU  78  77.066 -12.791   8.866
  589   HD13  LEU  78          HD13      LEU  78  75.790 -13.943   9.263
  590   HD21  LEU  78          HD21      LEU  78  73.504 -12.691   7.468
  591   HD22  LEU  78          HD22      LEU  78  73.975 -14.343   7.864
  592   HD23  LEU  78          HD23      LEU  78  73.945 -13.814   6.182
  593    H    HIS  79           HN       HIS  79  76.463 -13.554   4.989
  594    HA   HIS  79           HA       HIS  79  76.894 -12.496   2.305
  595    HD1  HIS  79           HD1      HIS  79  78.258 -12.440   0.281
  596    HD2  HIS  79           HD2      HIS  79  79.119 -16.415   1.208
  597    HE1  HIS  79           HE1      HIS  79  78.597 -13.632  -1.928
  598    HE2  HIS  79           HE2      HIS  79  79.122 -16.053  -1.378
  599    HB2  HIS  79           HB2      HIS  79  79.209 -13.081   2.906
  600    HB3  HIS  79           HB1      HIS  79  78.694 -14.714   3.330
  601    H    GLU  80           HN       GLU  80  74.530 -13.302   3.063
  602    HA   GLU  80           HA       GLU  80  74.033 -15.705   1.501
  603    HB2  GLU  80           HB2      GLU  80  74.758 -16.618   3.741
  604    HB3  GLU  80           HB1      GLU  80  73.358 -15.813   4.452
  605    HG2  GLU  80           HG2      GLU  80  71.872 -17.072   2.915
  606    HG3  GLU  80           HG1      GLU  80  73.280 -17.910   2.262
  607    H    LEU  81           HN       LEU  81  72.905 -13.126   3.599
  608    HA   LEU  81           HA       LEU  81  70.086 -13.519   2.939
  609    HG   LEU  81           HG       LEU  81  71.812 -13.182   5.442
  610    HB2  LEU  81           HB2      LEU  81  71.475 -11.093   4.120
  611    HB3  LEU  81           HB1      LEU  81  69.739 -11.402   4.124
  612   HD11  LEU  81          HD11      LEU  81  71.720 -11.193   6.740
  613   HD12  LEU  81          HD12      LEU  81  70.615 -12.308   7.544
  614   HD13  LEU  81          HD13      LEU  81  69.979 -11.030   6.509
  615   HD21  LEU  81          HD21      LEU  81  69.992 -14.573   4.956
  616   HD22  LEU  81          HD22      LEU  81  68.821 -13.265   5.130
  617   HD23  LEU  81          HD23      LEU  81  69.571 -13.974   6.561
  618    H    ALA  82           HN       ALA  82  72.523 -12.716   0.991
  619    HA   ALA  82           HA       ALA  82  71.640 -10.268  -0.242
  620    HB1  ALA  82           HB1      ALA  82  73.081 -12.392  -1.801
  621    HB2  ALA  82           HB2      ALA  82  73.910 -11.609  -0.456
  622    HB3  ALA  82           HB3      ALA  82  73.321 -10.644  -1.810
  623    H    GLN  83           HN       GLN  83  69.784 -12.807   0.111
  624    HA   GLN  83           HA       GLN  83  68.017 -13.775  -1.098
  625    HB2  GLN  83           HB2      GLN  83  68.269 -10.968  -2.034
  626    HB3  GLN  83           HB1      GLN  83  67.346 -12.033  -3.092
  627    HG2  GLN  83           HG2      GLN  83  66.820 -12.036  -0.130
  628    HG3  GLN  83           HG1      GLN  83  66.103 -10.790  -1.152
  629   HE21  GLN  83          HE21      GLN  83  65.162 -13.537   0.237
  630   HE22  GLN  83          HE22      GLN  83  64.183 -14.209  -0.976
  631    H    TYR  84           HN       TYR  84  69.270 -12.030  -3.903
  632    HA   TYR  84           HA       TYR  84  69.184 -14.125  -5.718
  633    HD1  TYR  84           HD1      TYR  84  68.006 -12.579  -7.104
  634    HD2  TYR  84           HD2      TYR  84  70.857  -9.918  -5.303
  635    HE1  TYR  84           HE1      TYR  84  66.370 -10.721  -7.259
  636    HE2  TYR  84           HE2      TYR  84  69.221  -8.060  -5.459
  637    HH   TYR  84           HH       TYR  84  67.260  -7.437  -6.680
  638    HB2  TYR  84           HB2      TYR  84  71.459 -12.132  -5.681
  639    HB3  TYR  84           HB1      TYR  84  70.718 -12.900  -7.085
  640    H    GLY  85           HN       GLY  85  72.210 -13.154  -4.047
  641    HA2  GLY  85           HA2      GLY  85  72.955 -15.685  -3.094
  642    HA3  GLY  85           HA1      GLY  85  73.558 -15.608  -4.750
  643    H    ILE  86           HN       ILE  86  73.868 -12.612  -4.454
  644    HA   ILE  86           HA       ILE  86  75.909 -12.284  -2.384
  645    HB   ILE  86           HB       ILE  86  77.222 -13.461  -4.092
  646   HG12  ILE  86          HG12      ILE  86  77.900 -10.519  -4.283
  647   HG13  ILE  86          HG11      ILE  86  78.133 -11.436  -2.794
  648   HG21  ILE  86          HG21      ILE  86  75.709 -12.788  -5.996
  649   HG22  ILE  86          HG22      ILE  86  77.429 -12.613  -6.348
  650   HG23  ILE  86          HG23      ILE  86  76.460 -11.193  -5.953
  651   HD11  ILE  86          HD11      ILE  86  79.427 -11.924  -5.486
  652   HD12  ILE  86          HD12      ILE  86  79.472 -13.105  -4.176
  653   HD13  ILE  86          HD13      ILE  86  80.222 -11.522  -3.963
  654    H1U  RCY  87           H1U      RCY  87  72.700  -7.584 -12.844
  655    H1S  RCY  87           H1S      RCY  87  75.596  -9.482  -9.446
  656    HB1  RCY  87           HB1      RCY  87  73.205  -7.869  -6.507
  657    HB2  RCY  87           HB2      RCY  87  73.241  -9.620  -6.713
  658    HA   RCY  87           HA       RCY  87  75.004  -8.268  -4.674
  659    HN1  RCY  87           HN1      RCY  87  74.296 -11.045  -5.279
  Start of MODEL   25
    1    HA   MET   1           HA       MET   1  55.906  13.297 -13.473
    2    HB2  MET   1           HB2      MET   1  54.073  15.042 -13.234
    3    HB3  MET   1           HB1      MET   1  55.377  15.475 -14.341
    4    HG2  MET   1           HG2      MET   1  54.054  14.969 -16.258
    5    HG3  MET   1           HG1      MET   1  52.841  14.132 -15.290
    6    HE1  MET   1           HE1      MET   1  50.315  16.741 -15.685
    7    HE2  MET   1           HE2      MET   1  50.697  15.097 -15.179
    8    HE3  MET   1           HE3      MET   1  51.160  15.646 -16.787
    9    H    ASN   2           HN       ASN   2  55.028  10.814 -13.994
   10    HA   ASN   2           HA       ASN   2  52.567  10.650 -12.381
   11    HB2  ASN   2           HB2      ASN   2  52.757   9.570 -15.206
   12    HB3  ASN   2           HB1      ASN   2  51.529   9.055 -14.049
   13   HD21  ASN   2          HD21      ASN   2  51.520  10.846 -16.647
   14   HD22  ASN   2          HD22      ASN   2  50.594  12.186 -16.168
   15    H    LEU   3           HN       LEU   3  54.782   9.892 -11.269
   16    HA   LEU   3           HA       LEU   3  55.583   7.171 -11.981
   17    HG   LEU   3           HG       LEU   3  55.625   8.156  -8.439
   18    HB2  LEU   3           HB2      LEU   3  57.168   7.338 -10.197
   19    HB3  LEU   3           HB1      LEU   3  57.127   8.921 -10.966
   20   HD11  LEU   3          HD11      LEU   3  58.079   9.872  -8.909
   21   HD12  LEU   3          HD12      LEU   3  58.023   8.336  -8.044
   22   HD13  LEU   3          HD13      LEU   3  57.216   9.754  -7.375
   23   HD21  LEU   3          HD21      LEU   3  55.370  10.733  -8.385
   24   HD22  LEU   3          HD22      LEU   3  54.341   9.844  -9.506
   25   HD23  LEU   3          HD23      LEU   3  55.779  10.677 -10.099
   26    H    GLU   4           HN       GLU   4  54.973   5.287 -10.940
   27    HA   GLU   4           HA       GLU   4  52.988   5.539  -8.715
   28    HB2  GLU   4           HB2      GLU   4  52.835   3.948 -11.267
   29    HB3  GLU   4           HB1      GLU   4  52.002   3.373  -9.824
   30    HG2  GLU   4           HG2      GLU   4  50.829   5.547  -9.645
   31    HG3  GLU   4           HG1      GLU   4  51.641   6.095 -11.112
   32    HA   PRO   5           HA       PRO   5  55.320   2.778  -6.201
   33    HB2  PRO   5           HB2      PRO   5  52.981   0.913  -6.467
   34    HB3  PRO   5           HB1      PRO   5  53.876   1.389  -5.011
   35    HG2  PRO   5           HG2      PRO   5  51.495   2.460  -5.646
   36    HG3  PRO   5           HG1      PRO   5  52.758   3.374  -4.807
   37    HD2  PRO   5           HD2      PRO   5  51.763   3.702  -7.564
   38    HD3  PRO   5           HD1      PRO   5  52.721   4.825  -6.574
   39    HA   PRO   6           HA       PRO   6  57.064  -0.003  -9.248
   40    HB2  PRO   6           HB2      PRO   6  58.883  -1.289  -7.680
   41    HB3  PRO   6           HB1      PRO   6  59.091   0.396  -8.200
   42    HG2  PRO   6           HG2      PRO   6  58.131  -0.671  -5.586
   43    HG3  PRO   6           HG1      PRO   6  59.222   0.686  -5.919
   44    HD2  PRO   6           HD2      PRO   6  56.563   1.016  -5.310
   45    HD3  PRO   6           HD1      PRO   6  57.485   2.161  -6.309
   46    H    LYS   7           HN       LYS   7  56.525  -2.044  -9.989
   47    HA   LYS   7           HA       LYS   7  54.635  -3.657  -8.581
   48    HB2  LYS   7           HB2      LYS   7  55.168  -5.376 -10.336
   49    HB3  LYS   7           HB1      LYS   7  54.797  -3.785 -11.002
   50    HG2  LYS   7           HG2      LYS   7  57.219  -3.294 -11.162
   51    HG3  LYS   7           HG1      LYS   7  57.578  -4.898 -10.524
   52    HD2  LYS   7           HD2      LYS   7  57.729  -5.299 -12.812
   53    HD3  LYS   7           HD1      LYS   7  56.039  -5.707 -12.516
   54    HE2  LYS   7           HE2      LYS   7  56.274  -4.240 -14.494
   55    HE3  LYS   7           HE1      LYS   7  55.361  -3.442 -13.214
   56    HZ1  LYS   7           HZ1      LYS   7  57.138  -2.089 -12.673
   57    HZ2  LYS   7           HZ2      LYS   7  57.242  -2.163 -14.367
   58    HZ3  LYS   7           HZ3      LYS   7  58.283  -3.103 -13.408
   59    H    ALA   8           HN       ALA   8  54.988  -5.866  -7.745
   60    HA   ALA   8           HA       ALA   8  57.721  -6.723  -7.164
   61    HB1  ALA   8           HB1      ALA   8  55.925  -5.775  -4.910
   62    HB2  ALA   8           HB2      ALA   8  57.428  -5.011  -5.426
   63    HB3  ALA   8           HB3      ALA   8  57.460  -6.617  -4.699
   64    H    GLU   9           HN       GLU   9  57.466  -8.858  -7.623
   65    HA   GLU   9           HA       GLU   9  54.909 -10.212  -7.104
   66    HB2  GLU   9           HB2      GLU   9  57.551 -11.200  -8.220
   67    HB3  GLU   9           HB1      GLU   9  56.105 -12.199  -8.070
   68    HG2  GLU   9           HG2      GLU   9  54.871 -10.753  -9.567
   69    HG3  GLU   9           HG1      GLU   9  56.195  -9.587  -9.604
   70    H1U  RCY  10           H1U      RCY  10  51.049 -15.759  -2.133
   71    H1S  RCY  10           H1S      RCY  10  55.697 -14.766  -3.488
   72    HB1  RCY  10           HB1      RCY  10  59.433 -12.793  -3.927
   73    HB2  RCY  10           HB2      RCY  10  58.178 -12.963  -5.153
   74    HA   RCY  10           HA       RCY  10  57.143 -11.182  -3.207
   75    HN1  RCY  10           HN1      RCY  10  58.105  -9.996  -5.676
   76    H    ARG  11           HN       ARG  11  57.961  -9.334  -2.197
   77    HA   ARG  11           HA       ARG  11  60.793  -8.600  -2.634
   78    HE   ARG  11           HE       ARG  11  61.683  -4.106  -2.532
   79    HB2  ARG  11           HB2      ARG  11  58.708  -6.998  -2.306
   80    HB3  ARG  11           HB1      ARG  11  59.035  -7.268  -0.595
   81    HG2  ARG  11           HG2      ARG  11  61.376  -6.539  -0.934
   82    HG3  ARG  11           HG1      ARG  11  61.033  -6.250  -2.639
   83    HD2  ARG  11           HD2      ARG  11  59.074  -4.758  -1.677
   84    HD3  ARG  11           HD1      ARG  11  60.086  -4.727  -0.233
   85   HH11  ARG  11          HH21      ARG  11  59.186  -2.891  -0.485
   86   HH12  ARG  11          HH22      ARG  11  59.608  -1.230  -0.736
   87   HH21  ARG  11          HH11      ARG  11  62.244  -1.944  -2.872
   88   HH22  ARG  11          HH12      ARG  11  61.338  -0.694  -2.087
   89    H    SER  12           HN       SER  12  60.479 -11.140  -1.471
   90    HA   SER  12           HA       SER  12  61.274 -12.398   0.339
   91    HG   SER  12           HG       SER  12  63.406  -9.635  -0.398
   92    HB2  SER  12           HB2      SER  12  62.464  -9.858   1.449
   93    HB3  SER  12           HB1      SER  12  63.079 -11.505   1.567
   94    H    ALA  13           HN       ALA  13  60.383 -13.026   2.286
   95    HA   ALA  13           HA       ALA  13  58.826 -12.995   4.046
   96    HB1  ALA  13           HB1      ALA  13  59.035 -11.102   5.569
   97    HB2  ALA  13           HB2      ALA  13  59.796 -10.133   4.308
   98    HB3  ALA  13           HB3      ALA  13  60.636 -11.536   4.970
   99    H    THR  14           HN       THR  14  56.933 -11.488   4.976
  100    HA   THR  14           HA       THR  14  54.946 -11.265   3.008
  101    HB   THR  14           HB       THR  14  55.108  -9.525   5.481
  102    HG1  THR  14           HG1      THR  14  55.046 -12.197   5.234
  103   HG21  THR  14          HG21      THR  14  52.731  -9.474   5.363
  104   HG22  THR  14          HG22      THR  14  52.689 -10.765   4.163
  105   HG23  THR  14          HG23      THR  14  53.288  -9.167   3.718
  106    H    ARG  15           HN       ARG  15  56.815  -8.557   4.428
  107    HA   ARG  15           HA       ARG  15  57.243  -7.255   1.927
  108    HE   ARG  15           HE       ARG  15  52.494  -6.965   0.365
  109    HB2  ARG  15           HB2      ARG  15  54.591  -6.985   2.946
  110    HB3  ARG  15           HB1      ARG  15  55.376  -5.426   3.149
  111    HG2  ARG  15           HG2      ARG  15  56.036  -5.433   0.776
  112    HG3  ARG  15           HG1      ARG  15  55.275  -7.010   0.566
  113    HD2  ARG  15           HD2      ARG  15  53.780  -4.555   1.524
  114    HD3  ARG  15           HD1      ARG  15  53.852  -5.051  -0.165
  115   HH11  ARG  15          HH21      ARG  15  53.320  -5.016   3.096
  116   HH12  ARG  15          HH22      ARG  15  52.115  -5.718   4.122
  117   HH21  ARG  15          HH11      ARG  15  50.923  -7.885   1.697
  118   HH22  ARG  15          HH12      ARG  15  50.761  -7.339   3.332
  119    H    VAL  16           HN       VAL  16  58.840  -7.773   4.114
  120    HA   VAL  16           HA       VAL  16  60.042  -6.784   5.914
  121    HB   VAL  16           HB       VAL  16  61.226  -4.685   4.982
  122   HG11  VAL  16          HG11      VAL  16  62.523  -6.072   3.380
  123   HG12  VAL  16          HG12      VAL  16  61.259  -7.300   3.445
  124   HG13  VAL  16          HG13      VAL  16  62.203  -6.929   4.888
  125   HG21  VAL  16          HG21      VAL  16  60.941  -4.279   2.598
  126   HG22  VAL  16          HG22      VAL  16  59.374  -4.122   3.387
  127   HG23  VAL  16          HG23      VAL  16  59.761  -5.583   2.480
  128    H    MET  17           HN       MET  17  59.876  -3.537   5.135
  129    HA   MET  17           HA       MET  17  59.036  -1.751   6.427
  130    HB2  MET  17           HB2      MET  17  56.741  -3.375   5.446
  131    HB3  MET  17           HB1      MET  17  56.368  -2.213   6.716
  132    HG2  MET  17           HG2      MET  17  56.078  -1.135   4.556
  133    HG3  MET  17           HG1      MET  17  57.482  -0.433   5.358
  134    HE1  MET  17           HE1      MET  17  57.877   0.578   3.278
  135    HE2  MET  17           HE2      MET  17  58.863  -0.092   1.981
  136    HE3  MET  17           HE3      MET  17  59.557   0.119   3.587
  137    H    GLY  18           HN       GLY  18  60.303  -3.460   8.106
  138    HA2  GLY  18           HA2      GLY  18  58.846  -4.726  10.152
  139    HA3  GLY  18           HA1      GLY  18  60.426  -3.979  10.396
  140    H    GLY  19           HN       GLY  19  59.178  -3.607  12.573
  141    HA2  GLY  19           HA2      GLY  19  57.648  -1.036  12.388
  142    HA3  GLY  19           HA1      GLY  19  57.441  -2.211  13.685
  143    HA   PRO  20           HA       PRO  20  60.522  -0.544  16.341
  144    HB2  PRO  20           HB2      PRO  20  62.385  -2.804  15.720
  145    HB3  PRO  20           HB1      PRO  20  61.832  -2.198  17.294
  146    HG2  PRO  20           HG2      PRO  20  60.861  -4.449  16.244
  147    HG3  PRO  20           HG1      PRO  20  59.847  -3.346  17.191
  148    HD2  PRO  20           HD2      PRO  20  59.862  -3.821  14.247
  149    HD3  PRO  20           HD1      PRO  20  58.530  -3.305  15.303
  150    H1U  RCY  21           H1U      RCY  21  68.421   3.182  15.155
  151    H1S  RCY  21           H1S      RCY  21  67.813   0.755  11.029
  152    HB1  RCY  21           HB1      RCY  21  64.584  -2.160  12.908
  153    HB2  RCY  21           HB2      RCY  21  65.158  -0.858  13.948
  154    HA   RCY  21           HA       RCY  21  63.527   0.669  13.096
  155    HN1  RCY  21           HN1      RCY  21  61.966  -1.860  13.352
  156    H    THR  22           HN       THR  22  62.573   1.516  11.292
  157    HA   THR  22           HA       THR  22  62.606  -0.137   8.825
  158    HB   THR  22           HB       THR  22  60.201   1.305   9.958
  159    HG1  THR  22           HG1      THR  22  60.737  -1.335   9.084
  160   HG21  THR  22          HG21      THR  22  60.228   1.964   7.667
  161   HG22  THR  22          HG22      THR  22  59.128   0.588   7.749
  162   HG23  THR  22          HG23      THR  22  60.768   0.370   7.141
  163    HA   PRO  23           HA       PRO  23  64.715   3.585   7.418
  164    HB2  PRO  23           HB2      PRO  23  63.491   2.704   4.827
  165    HB3  PRO  23           HB1      PRO  23  65.160   3.197   5.175
  166    HG2  PRO  23           HG2      PRO  23  64.489   0.632   4.885
  167    HG3  PRO  23           HG1      PRO  23  65.726   1.150   6.042
  168    HD2  PRO  23           HD2      PRO  23  62.975   0.157   6.563
  169    HD3  PRO  23           HD1      PRO  23  64.408   0.123   7.614
  170    H    ARG  24           HN       ARG  24  63.230   4.514   4.811
  171    HA   ARG  24           HA       ARG  24  60.677   5.520   5.739
  172    HE   ARG  24           HE       ARG  24  58.677   7.049   5.262
  173    HB2  ARG  24           HB2      ARG  24  62.405   6.911   7.021
  174    HB3  ARG  24           HB1      ARG  24  62.859   7.596   5.462
  175    HG2  ARG  24           HG2      ARG  24  61.227   9.067   6.485
  176    HG3  ARG  24           HG1      ARG  24  60.464   8.260   5.117
  177    HD2  ARG  24           HD2      ARG  24  60.228   6.864   7.733
  178    HD3  ARG  24           HD1      ARG  24  59.332   8.375   7.578
  179   HH11  ARG  24          HH21      ARG  24  58.745   6.230   8.610
  180   HH12  ARG  24          HH22      ARG  24  57.428   5.111   8.500
  181   HH21  ARG  24          HH11      ARG  24  56.956   5.593   5.098
  182   HH22  ARG  24          HH12      ARG  24  56.414   4.750   6.511
  183    H    LYS  25           HN       LYS  25  63.184   5.218   3.410
  184    HA   LYS  25           HA       LYS  25  63.213   5.571   1.090
  185    HB2  LYS  25           HB2      LYS  25  61.179   4.084   1.355
  186    HB3  LYS  25           HB1      LYS  25  60.196   5.546   1.368
  187    HG2  LYS  25           HG2      LYS  25  60.212   4.731  -0.895
  188    HG3  LYS  25           HG1      LYS  25  61.236   6.165  -0.851
  189    HD2  LYS  25           HD2      LYS  25  63.194   4.949  -1.119
  190    HD3  LYS  25           HD1      LYS  25  62.523   3.497  -0.378
  191    HE2  LYS  25           HE2      LYS  25  61.099   3.143  -2.369
  192    HE3  LYS  25           HE1      LYS  25  61.791   4.585  -3.113
  193    HZ1  LYS  25           HZ1      LYS  25  63.989   3.222  -2.430
  194    HZ2  LYS  25           HZ2      LYS  25  63.251   3.135  -3.958
  195    HZ3  LYS  25           HZ3      LYS  25  62.929   1.947  -2.787
  196    H    GLY  26           HN       GLY  26  64.021   7.794   1.547
  197    HA2  GLY  26           HA2      GLY  26  62.082   9.984   1.532
  198    HA3  GLY  26           HA1      GLY  26  63.836  10.157   1.507
  199    HA   PRO  27           HA       PRO  27  61.587  11.052  -2.702
  200    HB2  PRO  27           HB2      PRO  27  63.393  13.409  -2.290
  201    HB3  PRO  27           HB1      PRO  27  61.783  13.342  -3.033
  202    HG2  PRO  27           HG2      PRO  27  62.140  14.254  -0.551
  203    HG3  PRO  27           HG1      PRO  27  60.700  13.329  -1.010
  204    HD2  PRO  27           HD2      PRO  27  63.004  12.491   0.674
  205    HD3  PRO  27           HD1      PRO  27  61.332  11.889   0.663
  206    HA   PRO  28           HA       PRO  28  65.027   9.023  -4.751
  207    HB2  PRO  28           HB2      PRO  28  64.138  10.749  -7.036
  208    HB3  PRO  28           HB1      PRO  28  64.487   9.010  -7.009
  209    HG2  PRO  28           HG2      PRO  28  61.982   9.958  -7.011
  210    HG3  PRO  28           HG1      PRO  28  62.432   8.473  -6.158
  211    HD2  PRO  28           HD2      PRO  28  61.699  11.116  -5.035
  212    HD3  PRO  28           HD1      PRO  28  61.648   9.510  -4.274
  213    H    LYS  29           HN       LYS  29  67.179   9.608  -4.743
  214    HA   LYS  29           HA       LYS  29  68.150  12.056  -5.889
  215    HB2  LYS  29           HB2      LYS  29  67.025  12.690  -3.579
  216    HB3  LYS  29           HB1      LYS  29  68.523  12.051  -2.908
  217    HG2  LYS  29           HG2      LYS  29  68.877  14.400  -3.236
  218    HG3  LYS  29           HG1      LYS  29  69.770  13.575  -4.513
  219    HD2  LYS  29           HD2      LYS  29  68.334  14.293  -6.177
  220    HD3  LYS  29           HD1      LYS  29  66.938  14.342  -5.102
  221    HE2  LYS  29           HE2      LYS  29  67.964  16.595  -5.915
  222    HE3  LYS  29           HE1      LYS  29  67.538  16.429  -4.212
  223    HZ1  LYS  29           HZ1      LYS  29  69.742  16.136  -3.605
  224    HZ2  LYS  29           HZ2      LYS  29  69.835  17.341  -4.799
  225    HZ3  LYS  29           HZ3      LYS  29  70.238  15.735  -5.176
  226    H1U  RCY  30           H1U      RCY  30  73.636  12.479 -12.663
  227    H1S  RCY  30           H1S      RCY  30  71.800  10.456 -10.104
  228    HB1  RCY  30           HB1      RCY  30  72.918   9.144  -6.060
  229    HB2  RCY  30           HB2      RCY  30  71.955  10.621  -6.017
  230    HA   RCY  30           HA       RCY  30  70.691   7.876  -5.977
  231    HN1  RCY  30           HN1      RCY  30  68.857   9.346  -6.139
  232    H    LYS  31           HN       LYS  31  72.533  10.206  -4.162
  233    HA   LYS  31           HA       LYS  31  71.793   9.132  -1.553
  234    HB2  LYS  31           HB2      LYS  31  74.357   8.415  -1.290
  235    HB3  LYS  31           HB1      LYS  31  73.144   7.287  -1.892
  236    HG2  LYS  31           HG2      LYS  31  75.190   7.328  -3.311
  237    HG3  LYS  31           HG1      LYS  31  73.746   7.805  -4.202
  238    HD2  LYS  31           HD2      LYS  31  74.348  10.088  -4.194
  239    HD3  LYS  31           HD1      LYS  31  75.491   9.873  -2.869
  240    HE2  LYS  31           HE2      LYS  31  76.968   8.563  -4.329
  241    HE3  LYS  31           HE1      LYS  31  75.814   8.717  -5.654
  242    HZ1  LYS  31           HZ1      LYS  31  77.149  10.992  -4.290
  243    HZ2  LYS  31           HZ2      LYS  31  76.103  11.091  -5.626
  244    HZ3  LYS  31           HZ3      LYS  31  77.621  10.345  -5.785
  245    H    GLN  32           HN       GLN  32  73.043  11.510  -3.507
  246    HA   GLN  32           HA       GLN  32  74.201  13.522  -3.088
  247    HB2  GLN  32           HB2      GLN  32  72.730  13.095  -0.469
  248    HB3  GLN  32           HB1      GLN  32  73.489  14.613  -0.950
  249    HG2  GLN  32           HG2      GLN  32  72.063  14.469  -3.081
  250    HG3  GLN  32           HG1      GLN  32  71.151  13.208  -2.251
  251   HE21  GLN  32          HE21      GLN  32  69.790  13.834  -0.458
  252   HE22  GLN  32          HE22      GLN  32  69.485  15.461  -0.081
  253    H    ARG  33           HN       ARG  33  76.400  13.073  -3.038
  254    HA   ARG  33           HA       ARG  33  77.643  11.673  -0.822
  255    HE   ARG  33           HE       ARG  33  78.628  11.021  -5.123
  256    HB2  ARG  33           HB2      ARG  33  79.784  12.461  -1.926
  257    HB3  ARG  33           HB1      ARG  33  78.717  11.511  -2.957
  258    HG2  ARG  33           HG2      ARG  33  78.101  14.380  -3.060
  259    HG3  ARG  33           HG1      ARG  33  79.752  14.030  -3.568
  260    HD2  ARG  33           HD2      ARG  33  77.200  12.854  -4.700
  261    HD3  ARG  33           HD1      ARG  33  78.358  13.894  -5.528
  262   HH11  ARG  33          HH21      ARG  33  80.228  14.046  -5.544
  263   HH12  ARG  33          HH22      ARG  33  81.674  13.342  -6.185
  264   HH21  ARG  33          HH11      ARG  33  80.508  10.085  -5.955
  265   HH22  ARG  33          HH12      ARG  33  81.833  11.100  -6.417
  266    H    GLN  34           HN       GLN  34  76.115  13.969   0.065
  267    HA   GLN  34           HA       GLN  34  77.608  16.304   0.566
  268    HB2  GLN  34           HB2      GLN  34  75.539  14.840   2.214
  269    HB3  GLN  34           HB1      GLN  34  76.269  16.342   2.782
  270    HG2  GLN  34           HG2      GLN  34  74.996  16.097   0.051
  271    HG3  GLN  34           HG1      GLN  34  74.082  16.585   1.479
  272   HE21  GLN  34          HE21      GLN  34  76.058  17.766  -1.042
  273   HE22  GLN  34          HE22      GLN  34  76.387  19.298  -0.388
  274    H    THR  35           HN       THR  35  77.082  14.480   3.483
  275    HA   THR  35           HA       THR  35  79.917  14.756   4.183
  276    HB   THR  35           HB       THR  35  78.023  13.129   5.851
  277    HG1  THR  35           HG1      THR  35  76.636  14.669   5.941
  278   HG21  THR  35          HG21      THR  35  79.837  15.418   6.627
  279   HG22  THR  35          HG22      THR  35  80.436  13.771   6.440
  280   HG23  THR  35          HG23      THR  35  79.210  14.131   7.657
  281    H    ARG  36           HN       ARG  36  79.173  11.923   5.619
  282    HA   ARG  36           HA       ARG  36  79.938   9.736   5.182
  283    HE   ARG  36           HE       ARG  36  79.319   5.437   3.702
  284    HB2  ARG  36           HB2      ARG  36  77.815   9.675   4.005
  285    HB3  ARG  36           HB1      ARG  36  78.509  10.496   2.614
  286    HG2  ARG  36           HG2      ARG  36  78.193   7.956   2.437
  287    HG3  ARG  36           HG1      ARG  36  79.765   8.591   1.978
  288    HD2  ARG  36           HD2      ARG  36  80.734   7.910   4.083
  289    HD3  ARG  36           HD1      ARG  36  79.144   7.531   4.748
  290   HH11  ARG  36          HH21      ARG  36  81.331   7.789   2.173
  291   HH12  ARG  36          HH22      ARG  36  81.941   6.686   0.986
  292   HH21  ARG  36          HH11      ARG  36  80.108   3.993   2.162
  293   HH22  ARG  36          HH12      ARG  36  81.253   4.538   0.982
  294    H    GLN  37           HN       GLN  37  81.697  12.077   4.450
  295    HA   GLN  37           HA       GLN  37  83.118  11.895   2.094
  296    HB2  GLN  37           HB2      GLN  37  84.563  11.972   4.748
  297    HB3  GLN  37           HB1      GLN  37  85.015  12.763   3.238
  298    HG2  GLN  37           HG2      GLN  37  82.646  13.438   5.003
  299    HG3  GLN  37           HG1      GLN  37  84.069  14.437   4.713
  300   HE21  GLN  37          HE21      GLN  37  83.999  15.839   2.925
  301   HE22  GLN  37          HE22      GLN  37  82.783  15.818   1.742
  302    H1U  RCY  38           H1U      RCY  38  85.645  -0.361   1.247
  303    H1S  RCY  38           H1S      RCY  38  83.870   3.968   1.328
  304    HB1  RCY  38           HB1      RCY  38  83.288   7.663   3.165
  305    HB2  RCY  38           HB2      RCY  38  83.654   6.837   4.677
  306    HA   RCY  38           HA       RCY  38  85.530   8.110   5.078
  307    HN1  RCY  38           HN1      RCY  38  84.402  10.160   4.942
  308    H    LYS  39           HN       LYS  39  87.115   6.741   3.929
  309    HA   LYS  39           HA       LYS  39  89.072   6.694   2.623
  310    HB2  LYS  39           HB2      LYS  39  86.782   7.040   0.705
  311    HB3  LYS  39           HB1      LYS  39  88.425   6.984   0.086
  312    HG2  LYS  39           HG2      LYS  39  87.118   4.857   1.818
  313    HG3  LYS  39           HG1      LYS  39  87.357   4.740   0.080
  314    HD2  LYS  39           HD2      LYS  39  89.431   4.667   2.272
  315    HD3  LYS  39           HD1      LYS  39  89.158   3.514   0.975
  316    HE2  LYS  39           HE2      LYS  39  90.390   6.267   0.760
  317    HE3  LYS  39           HE1      LYS  39  91.125   4.716   0.370
  318    HZ1  LYS  39           HZ1      LYS  39  89.933   6.327  -1.416
  319    HZ2  LYS  39           HZ2      LYS  39  88.669   5.255  -1.042
  320    HZ3  LYS  39           HZ3      LYS  39  90.150   4.658  -1.623
  321    H    SER  40           HN       SER  40  90.253   8.489   3.306
  322    HA   SER  40           HA       SER  40  89.901  10.975   1.668
  323    HG   SER  40           HG       SER  40  91.520  12.549   2.847
  324    HB2  SER  40           HB2      SER  40  89.387  11.242   4.114
  325    HB3  SER  40           HB1      SER  40  91.045  10.767   4.470
  326    H    LYS  41           HN       LYS  41  91.683   8.358   1.622
  327    HA   LYS  41           HA       LYS  41  94.252   9.831   1.186
  328    HB2  LYS  41           HB2      LYS  41  94.070   6.900   1.892
  329    HB3  LYS  41           HB1      LYS  41  95.479   7.954   1.969
  330    HG2  LYS  41           HG2      LYS  41  94.991   8.263   4.160
  331    HG3  LYS  41           HG1      LYS  41  93.618   9.227   3.624
  332    HD2  LYS  41           HD2      LYS  41  92.625   7.627   5.033
  333    HD3  LYS  41           HD1      LYS  41  92.378   6.942   3.428
  334    HE2  LYS  41           HE2      LYS  41  94.386   5.535   3.712
  335    HE3  LYS  41           HE1      LYS  41  94.647   6.228   5.312
  336    HZ1  LYS  41           HZ1      LYS  41  93.275   4.001   4.903
  337    HZ2  LYS  41           HZ2      LYS  41  92.006   5.126   4.801
  338    HZ3  LYS  41           HZ3      LYS  41  92.966   5.048   6.200
  339    HA   PRO  42           HA       PRO  42  94.154   8.635  -3.078
  340    HB2  PRO  42           HB2      PRO  42  96.926   7.591  -2.656
  341    HB3  PRO  42           HB1      PRO  42  96.325   8.727  -3.878
  342    HG2  PRO  42           HG2      PRO  42  97.744   9.538  -1.758
  343    HG3  PRO  42           HG1      PRO  42  96.458  10.525  -2.472
  344    HD2  PRO  42           HD2      PRO  42  96.466   9.036   0.101
  345    HD3  PRO  42           HD1      PRO  42  95.522  10.463  -0.381
  346    HA   PRO  43           HA       PRO  43  93.341   4.260  -3.112
  347    HB2  PRO  43           HB2      PRO  43  93.611   3.667  -5.760
  348    HB3  PRO  43           HB1      PRO  43  92.253   4.618  -5.126
  349    HG2  PRO  43           HG2      PRO  43  94.734   5.544  -6.495
  350    HG3  PRO  43           HG1      PRO  43  93.066   6.119  -6.671
  351    HD2  PRO  43           HD2      PRO  43  94.952   7.424  -5.159
  352    HD3  PRO  43           HD1      PRO  43  93.208   7.506  -4.827
  353    H    LYS  44           HN       LYS  44  94.694   2.651  -2.409
  354    HA   LYS  44           HA       LYS  44  96.931   1.733  -3.996
  355    HB2  LYS  44           HB2      LYS  44  97.430   3.860  -2.122
  356    HB3  LYS  44           HB1      LYS  44  98.235   2.403  -1.542
  357    HG2  LYS  44           HG2      LYS  44  99.310   2.116  -3.747
  358    HG3  LYS  44           HG1      LYS  44  98.507   3.576  -4.327
  359    HD2  LYS  44           HD2      LYS  44  99.622   4.815  -2.406
  360    HD3  LYS  44           HD1      LYS  44 100.586   3.362  -2.138
  361    HE2  LYS  44           HE2      LYS  44 100.450   4.901  -4.748
  362    HE3  LYS  44           HE1      LYS  44 101.770   4.997  -3.583
  363    HZ1  LYS  44           HZ1      LYS  44 102.167   2.641  -3.874
  364    HZ2  LYS  44           HZ2      LYS  44 102.257   3.439  -5.371
  365    HZ3  LYS  44           HZ3      LYS  44 100.879   2.528  -4.972
  366    H    LYS  45           HN       LYS  45  96.410   1.887  -0.458
  367    HA   LYS  45           HA       LYS  45  95.777  -1.028  -0.492
  368    HB2  LYS  45           HB2      LYS  45  97.971   0.357   1.053
  369    HB3  LYS  45           HB1      LYS  45  97.266  -1.156   1.624
  370    HG2  LYS  45           HG2      LYS  45  98.038  -2.370  -0.229
  371    HG3  LYS  45           HG1      LYS  45  98.231  -0.923  -1.219
  372    HD2  LYS  45           HD2      LYS  45 100.408  -1.885  -0.415
  373    HD3  LYS  45           HD1      LYS  45 100.149  -0.214   0.083
  374    HE2  LYS  45           HE2      LYS  45  99.258  -2.442   1.892
  375    HE3  LYS  45           HE1      LYS  45 100.960  -1.983   1.853
  376    HZ1  LYS  45           HZ1      LYS  45  99.775   0.405   2.003
  377    HZ2  LYS  45           HZ2      LYS  45 100.312  -0.473   3.355
  378    HZ3  LYS  45           HZ3      LYS  45  98.679  -0.536   2.891
  379    H    GLY  46           HN       GLY  46  93.611  -0.553   0.064
  380    HA2  GLY  46           HA2      GLY  46  92.959   1.227   2.269
  381    HA3  GLY  46           HA1      GLY  46  91.831   0.148   1.445
  382    H    VAL  47           HN       VAL  47  93.977   0.493   4.157
  383    HA   VAL  47           HA       VAL  47  93.787  -2.322   4.954
  384    HB   VAL  47           HB       VAL  47  94.972  -1.574   6.986
  385   HG11  VAL  47          HG11      VAL  47  96.110  -0.272   4.495
  386   HG12  VAL  47          HG12      VAL  47  96.216  -1.996   4.852
  387   HG13  VAL  47          HG13      VAL  47  97.017  -0.827   5.902
  388   HG21  VAL  47          HG21      VAL  47  95.644   0.877   7.059
  389   HG22  VAL  47          HG22      VAL  47  93.939   0.564   7.383
  390   HG23  VAL  47          HG23      VAL  47  94.441   1.165   5.802
  391    H    GLN  48           HN       GLN  48  93.381  -1.781   7.792
  392    HA   GLN  48           HA       GLN  48  90.503  -1.962   7.864
  393    HB2  GLN  48           HB2      GLN  48  92.481  -2.739   9.559
  394    HB3  GLN  48           HB1      GLN  48  91.951  -1.267  10.370
  395    HG2  GLN  48           HG2      GLN  48  90.592  -2.995  11.278
  396    HG3  GLN  48           HG1      GLN  48  89.562  -2.174  10.105
  397   HE21  GLN  48          HE21      GLN  48  88.908  -4.810  10.735
  398   HE22  GLN  48          HE22      GLN  48  89.290  -5.832   9.434
  399    H    GLY  49           HN       GLY  49  89.449  -0.424   9.736
  400    HA2  GLY  49           HA2      GLY  49  88.943   1.786  10.432
  401    HA3  GLY  49           HA1      GLY  49  90.358   2.357   9.545
  402    H1U  RCY  50           H1U      RCY  50  81.963  -3.023   9.313
  403    H1S  RCY  50           H1S      RCY  50  84.063   1.371   9.709
  404    HB1  RCY  50           HB1      RCY  50  85.221   3.955   6.798
  405    HB2  RCY  50           HB2      RCY  50  85.612   4.317   8.478
  406    HA   RCY  50           HA       RCY  50  87.533   3.364   6.334
  407    HN1  RCY  50           HN1      RCY  50  88.477   4.010   9.057
  408    H    GLY  51           HN       GLY  51  87.805   5.705   8.975
  409    HA2  GLY  51           HA2      GLY  51  88.894   7.737   7.276
  410    HA3  GLY  51           HA1      GLY  51  87.184   8.069   7.561
  411    H    ASP  52           HN       ASP  52  86.485   8.268   9.833
  412    HA   ASP  52           HA       ASP  52  88.556   8.555  11.887
  413    HB2  ASP  52           HB2      ASP  52  86.954  10.987  11.040
  414    HB3  ASP  52           HB1      ASP  52  88.183  10.921  12.305
  415    H    ASP  53           HN       ASP  53  85.297   8.280  10.851
  416    HA   ASP  53           HA       ASP  53  84.429   7.417  13.472
  417    HB2  ASP  53           HB2      ASP  53  82.763   9.189  13.873
  418    HB3  ASP  53           HB1      ASP  53  84.393   9.863  13.844
  419    H    ILE  54           HN       ILE  54  81.711   8.778  12.354
  420    HA   ILE  54           HA       ILE  54  81.201   6.930  10.108
  421    HB   ILE  54           HB       ILE  54  80.768   5.540  12.094
  422   HG12  ILE  54          HG12      ILE  54  78.084   6.363  10.975
  423   HG13  ILE  54          HG11      ILE  54  79.277   5.533   9.975
  424   HG21  ILE  54          HG21      ILE  54  80.043   7.815  13.366
  425   HG22  ILE  54          HG22      ILE  54  79.528   6.218  13.905
  426   HG23  ILE  54          HG23      ILE  54  78.444   7.210  12.931
  427   HD11  ILE  54          HD11      ILE  54  79.311   3.634  11.461
  428   HD12  ILE  54          HD12      ILE  54  77.620   3.999  11.115
  429   HD13  ILE  54          HD13      ILE  54  78.330   4.485  12.655
  430    HA   PRO  55           HA       PRO  55  78.726  10.809   9.877
  431    HB2  PRO  55           HB2      PRO  55  79.924  11.937   7.753
  432    HB3  PRO  55           HB1      PRO  55  80.660  12.004   9.365
  433    HG2  PRO  55           HG2      PRO  55  81.383  10.329   7.027
  434    HG3  PRO  55           HG1      PRO  55  82.415  11.008   8.294
  435    HD2  PRO  55           HD2      PRO  55  81.413   8.345   8.179
  436    HD3  PRO  55           HD1      PRO  55  82.243   9.106   9.554
  437    H    GLY  56           HN       GLY  56  77.499   8.533   9.079
  438    HA2  GLY  56           HA2      GLY  56  76.329   9.296   6.489
  439    HA3  GLY  56           HA1      GLY  56  77.135   7.727   6.506
  440    H    MET  57           HN       MET  57  76.218   7.731   9.526
  441    HA   MET  57           HA       MET  57  74.500   6.560  10.635
  442    HB2  MET  57           HB2      MET  57  72.775   8.239   8.786
  443    HB3  MET  57           HB1      MET  57  72.283   7.531  10.325
  444    HG2  MET  57           HG2      MET  57  73.956   8.903  11.503
  445    HG3  MET  57           HG1      MET  57  74.470   9.603   9.968
  446    HE1  MET  57           HE1      MET  57  72.866  10.704   8.319
  447    HE2  MET  57           HE2      MET  57  73.683  11.895   9.328
  448    HE3  MET  57           HE3      MET  57  71.974  12.094   8.953
  449    H    GLU  58           HN       GLU  58  71.986   6.604   8.471
  450    HA   GLU  58           HA       GLU  58  72.698   4.500   6.651
  451    HB2  GLU  58           HB2      GLU  58  71.438   2.646   7.699
  452    HB3  GLU  58           HB1      GLU  58  72.793   3.143   8.709
  453    HG2  GLU  58           HG2      GLU  58  69.933   4.087   9.085
  454    HG3  GLU  58           HG1      GLU  58  70.696   2.802  10.017
  455    H    GLY  59           HN       GLY  59  71.267   6.987   6.599
  456    HA2  GLY  59           HA2      GLY  59  68.409   6.325   6.432
  457    HA3  GLY  59           HA1      GLY  59  69.129   7.899   6.104
  458    H1U  RCY  60           H1U      RCY  60  70.000  -0.050   4.000
  459    H1S  RCY  60           H1S      RCY  60  71.098   2.799   0.070
  460    HB1  RCY  60           HB1      RCY  60  70.220   4.968   2.483
  461    HB2  RCY  60           HB2      RCY  60  71.635   5.869   1.937
  462    HA   RCY  60           HA       RCY  60  70.366   7.882   1.677
  463    HN1  RCY  60           HN1      RCY  60  70.487   7.977   4.026
  464    H    GLY  61           HN       GLY  61  68.356   5.023   1.873
  465    HA2  GLY  61           HA2      GLY  61  65.855   5.206   1.997
  466    HA3  GLY  61           HA1      GLY  61  65.999   6.681   1.044
  467    H    THR  62           HN       THR  62  67.760   5.923  -0.950
  468    HA   THR  62           HA       THR  62  66.031   4.131  -2.521
  469    HB   THR  62           HB       THR  62  67.224   4.903  -4.424
  470    HG1  THR  62           HG1      THR  62  69.276   5.292  -4.328
  471   HG21  THR  62          HG21      THR  62  65.841   6.619  -3.153
  472   HG22  THR  62          HG22      THR  62  67.058   7.282  -4.243
  473   HG23  THR  62          HG23      THR  62  67.361   7.236  -2.506
  474    H    ASP  63           HN       ASP  63  66.523   2.123  -1.370
  475    HA   ASP  63           HA       ASP  63  69.226   1.095  -1.230
  476    HB2  ASP  63           HB2      ASP  63  67.965  -1.136  -0.923
  477    HB3  ASP  63           HB1      ASP  63  67.671   0.117   0.284
  478    H    ILE  64           HN       ILE  64  67.148   1.633  -3.790
  479    HA   ILE  64           HA       ILE  64  68.855   0.399  -5.725
  480    HB   ILE  64           HB       ILE  64  67.981  -1.718  -5.035
  481   HG12  ILE  64          HG12      ILE  64  66.068  -1.173  -7.279
  482   HG13  ILE  64          HG11      ILE  64  67.788  -0.934  -7.585
  483   HG21  ILE  64          HG21      ILE  64  65.304  -0.307  -5.050
  484   HG22  ILE  64          HG22      ILE  64  66.121  -1.061  -3.682
  485   HG23  ILE  64          HG23      ILE  64  65.456  -2.061  -4.974
  486   HD11  ILE  64          HD11      ILE  64  66.926  -3.259  -8.103
  487   HD12  ILE  64          HD12      ILE  64  66.654  -3.466  -6.373
  488   HD13  ILE  64          HD13      ILE  64  68.288  -3.209  -6.984
  489    H    THR  65           HN       THR  65  68.307   2.796  -6.077
  490    HA   THR  65           HA       THR  65  65.838   3.827  -6.819
  491    HB   THR  65           HB       THR  65  68.386   4.330  -8.387
  492    HG1  THR  65           HG1      THR  65  67.606   5.913  -6.235
  493   HG21  THR  65          HG21      THR  65  66.354   5.329  -9.339
  494   HG22  THR  65          HG22      THR  65  67.395   6.582  -8.662
  495   HG23  THR  65          HG23      THR  65  65.965   6.050  -7.777
  496    H    VAL  66           HN       VAL  66  67.738   1.440  -8.449
  497    HA   VAL  66           HA       VAL  66  65.529   0.855 -10.273
  498    HB   VAL  66           HB       VAL  66  67.561   0.910 -12.139
  499   HG11  VAL  66          HG11      VAL  66  65.693   3.220 -11.529
  500   HG12  VAL  66          HG12      VAL  66  65.211   1.748 -12.371
  501   HG13  VAL  66          HG13      VAL  66  66.408   2.824 -13.091
  502   HG21  VAL  66          HG21      VAL  66  67.818   3.490 -10.580
  503   HG22  VAL  66          HG22      VAL  66  68.811   2.931 -11.926
  504   HG23  VAL  66          HG23      VAL  66  68.930   2.140 -10.354
  505    H    ILE  67           HN       ILE  67  69.037   0.248 -10.452
  506    HA   ILE  67           HA       ILE  67  68.542  -2.583  -9.661
  507    HB   ILE  67           HB       ILE  67  70.042  -1.610 -12.109
  508   HG12  ILE  67          HG12      ILE  67  67.860  -3.696 -11.873
  509   HG13  ILE  67          HG11      ILE  67  67.512  -1.991 -12.160
  510   HG21  ILE  67          HG21      ILE  67  71.455  -3.296 -11.236
  511   HG22  ILE  67          HG22      ILE  67  70.431  -4.157 -12.384
  512   HG23  ILE  67          HG23      ILE  67  70.094  -4.257 -10.655
  513   HD11  ILE  67          HD11      ILE  67  67.617  -3.189 -14.295
  514   HD12  ILE  67          HD12      ILE  67  69.234  -3.775 -13.904
  515   HD13  ILE  67          HD13      ILE  67  68.962  -2.054 -14.175
  516    H1U  RCY  68           H1U      RCY  68  71.949   4.039  -9.293
  517    H1S  RCY  68           H1S      RCY  68  71.228   2.297  -6.341
  518    HB1  RCY  68           HB1      RCY  68  71.849  -2.603  -5.255
  519    HB2  RCY  68           HB2      RCY  68  70.205  -2.104  -5.645
  520    HA   RCY  68           HA       RCY  68  72.068  -0.776  -7.407
  521    HN1  RCY  68           HN1      RCY  68  69.553  -2.141  -7.632
  522    HA   PRO  69           HA       PRO  69  74.991  -3.655  -9.106
  523    HB2  PRO  69           HB2      PRO  69  76.459  -3.083  -6.554
  524    HB3  PRO  69           HB1      PRO  69  77.061  -3.082  -8.223
  525    HG2  PRO  69           HG2      PRO  69  76.480  -0.817  -6.889
  526    HG3  PRO  69           HG1      PRO  69  76.293  -0.974  -8.642
  527    HD2  PRO  69           HD2      PRO  69  74.204  -0.750  -6.573
  528    HD3  PRO  69           HD1      PRO  69  74.079  -0.508  -8.330
  529    H    TRP  70           HN       TRP  70  73.563  -4.019  -5.955
  530    HA   TRP  70           HA       TRP  70  74.732  -6.486  -5.153
  531    HD1  TRP  70           HD1      TRP  70  74.750  -7.634  -3.102
  532    HE1  TRP  70           HE1      TRP  70  73.684  -9.667  -1.927
  533    HE3  TRP  70           HE3      TRP  70  69.814  -6.686  -4.007
  534    HZ2  TRP  70           HZ2      TRP  70  71.081 -10.748  -1.437
  535    HZ3  TRP  70           HZ3      TRP  70  68.064  -8.232  -3.177
  536    HH2  TRP  70           HH2      TRP  70  68.690 -10.260  -1.894
  537    HB2  TRP  70           HB2      TRP  70  73.296  -5.110  -3.673
  538    HB3  TRP  70           HB1      TRP  70  71.897  -5.522  -4.665
  539    H    GLU  71           HN       GLU  71  73.173  -5.916  -7.980
  540    HA   GLU  71           HA       GLU  71  72.282  -8.766  -8.182
  541    HB2  GLU  71           HB2      GLU  71  70.902  -6.306  -9.295
  542    HB3  GLU  71           HB1      GLU  71  70.477  -7.962  -9.730
  543    HG2  GLU  71           HG2      GLU  71  69.862  -8.480  -7.458
  544    HG3  GLU  71           HG1      GLU  71  70.504  -6.943  -6.878
  545    H    ALA  72           HN       ALA  72  73.191  -5.848 -10.040
  546    HA   ALA  72           HA       ALA  72  73.784  -7.266 -12.462
  547    HB1  ALA  72           HB1      ALA  72  75.012  -5.213 -13.103
  548    HB2  ALA  72           HB2      ALA  72  74.884  -4.629 -11.444
  549    HB3  ALA  72           HB3      ALA  72  73.431  -4.831 -12.422
  550    H1U  RCY  73           H1U      RCY  73  85.125  -8.082 -14.139
  551    H1S  RCY  73           H1S      RCY  73  81.421  -7.535 -12.626
  552    HB1  RCY  73           HB1      RCY  73  78.819  -5.639  -9.126
  553    HB2  RCY  73           HB2      RCY  73  78.451  -4.912 -10.690
  554    HA   RCY  73           HA       RCY  73  78.286  -7.498 -11.399
  555    HN1  RCY  73           HN1      RCY  73  76.274  -5.569 -10.561
  556    H    ASN  74           HN       ASN  74  76.216  -8.836 -10.038
  557    HA   ASN  74           HA       ASN  74  77.032  -9.284  -7.262
  558    HB2  ASN  74           HB2      ASN  74  74.652  -9.481  -8.083
  559    HB3  ASN  74           HB1      ASN  74  75.137 -10.937  -8.953
  560   HD21  ASN  74          HD21      ASN  74  74.850  -9.549  -5.670
  561   HD22  ASN  74          HD22      ASN  74  74.822 -11.043  -4.867
  562    H    HIS  75           HN       HIS  75  78.651 -10.009  -9.907
  563    HA   HIS  75           HA       HIS  75  79.087 -12.885  -9.514
  564    HD1  HIS  75           HD1      HIS  75  79.162 -14.455 -11.325
  565    HD2  HIS  75           HD2      HIS  75  78.382 -10.915 -13.390
  566    HE1  HIS  75           HE1      HIS  75  77.475 -15.032 -13.127
  567    HE2  HIS  75           HE2      HIS  75  76.994 -12.885 -14.389
  568    HB2  HIS  75           HB2      HIS  75  80.214 -10.773 -11.338
  569    HB3  HIS  75           HB1      HIS  75  81.053 -12.314 -11.168
  570    H1U  RCY  76           H1U      RCY  76  78.511  -7.892   0.169
  571    H1S  RCY  76           H1S      RCY  76  78.981  -7.090  -5.290
  572    HB1  RCY  76           HB1      RCY  76  83.096  -8.828  -8.152
  573    HB2  RCY  76           HB2      RCY  76  83.335  -8.901  -6.406
  574    HA   RCY  76           HA       RCY  76  82.979 -11.149  -7.514
  575    HN1  RCY  76           HN1      RCY  76  80.473  -9.896  -8.391
  576    H    GLU  77           HN       GLU  77  79.986 -11.616  -6.456
  577    HA   GLU  77           HA       GLU  77  80.116 -11.015  -3.649
  578    HB2  GLU  77           HB2      GLU  77  78.041 -11.606  -5.010
  579    HB3  GLU  77           HB1      GLU  77  78.559 -13.288  -4.903
  580    HG2  GLU  77           HG2      GLU  77  78.529 -13.158  -2.448
  581    HG3  GLU  77           HG1      GLU  77  78.058 -11.461  -2.534
  582    H    LEU  78           HN       LEU  78  79.425 -14.296  -3.849
  583    HA   LEU  78           HA       LEU  78  80.506 -16.149  -2.906
  584    HG   LEU  78           HG       LEU  78  80.566 -16.486  -5.275
  585    HB2  LEU  78           HB2      LEU  78  82.560 -14.844  -4.659
  586    HB3  LEU  78           HB1      LEU  78  83.060 -16.185  -3.628
  587   HD11  LEU  78          HD11      LEU  78  82.073 -15.711  -6.959
  588   HD12  LEU  78          HD12      LEU  78  82.070 -17.470  -7.081
  589   HD13  LEU  78          HD13      LEU  78  83.411 -16.643  -6.288
  590   HD21  LEU  78          HD21      LEU  78  81.479 -18.155  -3.525
  591   HD22  LEU  78          HD22      LEU  78  82.753 -18.492  -4.696
  592   HD23  LEU  78          HD23      LEU  78  81.068 -18.802  -5.113
  593    H    HIS  79           HN       HIS  79  83.579 -14.567  -2.700
  594    HA   HIS  79           HA       HIS  79  83.412 -13.237  -0.225
  595    HD1  HIS  79           HD1      HIS  79  85.224 -16.342  -1.603
  596    HD2  HIS  79           HD2      HIS  79  82.091 -17.812   0.727
  597    HE1  HIS  79           HE1      HIS  79  84.806 -18.719  -2.378
  598    HE2  HIS  79           HE2      HIS  79  82.902 -19.622  -0.967
  599    HB2  HIS  79           HB2      HIS  79  84.482 -15.206   1.168
  600    HB3  HIS  79           HB1      HIS  79  82.732 -15.111   0.992
  601    H    GLU  80           HN       GLU  80  84.917 -12.741  -2.420
  602    HA   GLU  80           HA       GLU  80  87.594 -13.874  -2.195
  603    HB2  GLU  80           HB2      GLU  80  86.213 -11.908  -3.926
  604    HB3  GLU  80           HB1      GLU  80  87.921 -11.566  -3.654
  605    HG2  GLU  80           HG2      GLU  80  86.974 -14.324  -4.441
  606    HG3  GLU  80           HG1      GLU  80  87.331 -13.091  -5.650
  607    H    LEU  81           HN       LEU  81  87.025 -10.385  -2.234
  608    HA   LEU  81           HA       LEU  81  89.104  -9.891  -0.320
  609    HG   LEU  81           HG       LEU  81  86.145  -7.763   0.141
  610    HB2  LEU  81           HB2      LEU  81  88.505  -7.594  -0.493
  611    HB3  LEU  81           HB1      LEU  81  88.152  -8.274  -2.079
  612   HD11  LEU  81          HD11      LEU  81  86.710  -5.707  -0.945
  613   HD12  LEU  81          HD12      LEU  81  85.186  -6.237  -1.657
  614   HD13  LEU  81          HD13      LEU  81  86.697  -6.468  -2.536
  615   HD21  LEU  81          HD21      LEU  81  85.924  -9.117  -2.556
  616   HD22  LEU  81          HD22      LEU  81  84.523  -8.407  -1.755
  617   HD23  LEU  81          HD23      LEU  81  85.402  -9.728  -0.986
  618    H    ALA  82           HN       ALA  82  86.347 -11.445   0.255
  619    HA   ALA  82           HA       ALA  82  85.230 -10.077   2.522
  620    HB1  ALA  82           HB1      ALA  82  83.819 -11.688   1.547
  621    HB2  ALA  82           HB2      ALA  82  84.355 -12.473   3.033
  622    HB3  ALA  82           HB3      ALA  82  85.094 -12.905   1.489
  623    H    GLN  83           HN       GLN  83  88.212 -10.468   2.555
  624    HA   GLN  83           HA       GLN  83  89.149 -12.398   4.325
  625    HB2  GLN  83           HB2      GLN  83  89.863  -9.447   4.296
  626    HB3  GLN  83           HB1      GLN  83  90.820 -10.709   5.069
  627    HG2  GLN  83           HG2      GLN  83  90.084 -10.994   2.166
  628    HG3  GLN  83           HG1      GLN  83  91.418  -9.934   2.621
  629   HE21  GLN  83          HE21      GLN  83  92.938 -11.108   4.391
  630   HE22  GLN  83          HE22      GLN  83  93.358 -12.706   4.002
  631    H    TYR  84           HN       TYR  84  87.158  -9.597   5.015
  632    HA   TYR  84           HA       TYR  84  86.121 -10.641   7.444
  633    HD1  TYR  84           HD1      TYR  84  87.933  -7.293   6.468
  634    HD2  TYR  84           HD2      TYR  84  90.287 -10.345   8.369
  635    HE1  TYR  84           HE1      TYR  84  89.971  -6.412   5.363
  636    HE2  TYR  84           HE2      TYR  84  92.323  -9.462   7.263
  637    HH   TYR  84           HH       TYR  84  92.506  -6.466   5.869
  638    HB2  TYR  84           HB2      TYR  84  87.329  -8.656   8.825
  639    HB3  TYR  84           HB1      TYR  84  87.990 -10.289   8.743
  640    H    GLY  85           HN       GLY  85  86.306  -8.452   4.974
  641    HA2  GLY  85           HA2      GLY  85  84.782  -6.271   6.201
  642    HA3  GLY  85           HA1      GLY  85  85.190  -6.417   4.494
  643    H    ILE  86           HN       ILE  86  83.378  -8.538   6.738
  644    HA   ILE  86           HA       ILE  86  81.285  -8.808   4.644
  645    HB   ILE  86           HB       ILE  86  82.158 -10.882   5.629
  646   HG12  ILE  86          HG12      ILE  86  79.368 -10.375   6.703
  647   HG13  ILE  86          HG11      ILE  86  79.707 -10.617   4.989
  648   HG21  ILE  86          HG21      ILE  86  81.096  -9.770   8.245
  649   HG22  ILE  86          HG22      ILE  86  82.803  -9.907   7.818
  650   HG23  ILE  86          HG23      ILE  86  81.821 -11.360   8.014
  651   HD11  ILE  86          HD11      ILE  86  80.593 -12.822   5.398
  652   HD12  ILE  86          HD12      ILE  86  79.032 -12.716   6.212
  653   HD13  ILE  86          HD13      ILE  86  80.522 -12.582   7.145
  654    H1U  RCY  87           H1U      RCY  87  76.679  -2.222  -1.088
  655    H1S  RCY  87           H1S      RCY  87  76.310  -6.049   2.521
  656    HB1  RCY  87           HB1      RCY  87  76.670  -5.757   6.000
  657    HB2  RCY  87           HB2      RCY  87  76.452  -7.468   5.639
  658    HA   RCY  87           HA       RCY  87  78.753  -6.097   7.000
  659    HN1  RCY  87           HN1      RCY  87  79.109  -8.247   5.074
  Start of MODEL   26
    1    HA   MET   1           HA       MET   1  52.859  -6.746  -5.761
    2    HB2  MET   1           HB2      MET   1  50.896  -7.554  -6.943
    3    HB3  MET   1           HB1      MET   1  52.125  -8.819  -6.976
    4    HG2  MET   1           HG2      MET   1  50.989  -9.731  -4.850
    5    HG3  MET   1           HG1      MET   1  49.642  -8.671  -5.264
    6    HE1  MET   1           HE1      MET   1  50.901 -12.301  -5.733
    7    HE2  MET   1           HE2      MET   1  52.115 -11.191  -6.364
    8    HE3  MET   1           HE3      MET   1  51.287 -12.296  -7.458
    9    H    ASN   2           HN       ASN   2  51.785  -8.126  -2.853
   10    HA   ASN   2           HA       ASN   2  50.507  -5.690  -2.009
   11    HB2  ASN   2           HB2      ASN   2  48.797  -6.973  -3.577
   12    HB3  ASN   2           HB1      ASN   2  48.535  -7.953  -2.135
   13   HD21  ASN   2          HD21      ASN   2  46.511  -6.183  -3.222
   14   HD22  ASN   2          HD22      ASN   2  46.232  -4.958  -2.081
   15    H    LEU   3           HN       LEU   3  48.880  -6.685   0.030
   16    HA   LEU   3           HA       LEU   3  50.805  -7.486   1.984
   17    HG   LEU   3           HG       LEU   3  49.966  -5.965   3.452
   18    HB2  LEU   3           HB2      LEU   3  47.790  -7.423   1.924
   19    HB3  LEU   3           HB1      LEU   3  48.640  -8.114   3.306
   20   HD11  LEU   3          HD11      LEU   3  48.813  -3.994   2.313
   21   HD12  LEU   3          HD12      LEU   3  47.947  -5.181   1.337
   22   HD13  LEU   3          HD13      LEU   3  49.705  -5.076   1.244
   23   HD21  LEU   3          HD21      LEU   3  46.946  -5.851   3.727
   24   HD22  LEU   3          HD22      LEU   3  48.046  -4.660   4.421
   25   HD23  LEU   3          HD23      LEU   3  48.102  -6.336   4.967
   26    H    GLU   4           HN       GLU   4  49.859  -9.280  -0.545
   27    HA   GLU   4           HA       GLU   4  48.970 -11.760   0.360
   28    HB2  GLU   4           HB2      GLU   4  49.520 -11.072  -2.033
   29    HB3  GLU   4           HB1      GLU   4  51.202 -11.445  -1.659
   30    HG2  GLU   4           HG2      GLU   4  48.971 -13.435  -1.206
   31    HG3  GLU   4           HG1      GLU   4  49.847 -13.333  -2.734
   32    HA   PRO   5           HA       PRO   5  51.918 -12.945   3.523
   33    HB2  PRO   5           HB2      PRO   5  51.416 -15.625   2.260
   34    HB3  PRO   5           HB1      PRO   5  51.467 -15.186   3.979
   35    HG2  PRO   5           HG2      PRO   5  49.156 -15.521   2.678
   36    HG3  PRO   5           HG1      PRO   5  49.346 -14.306   3.952
   37    HD2  PRO   5           HD2      PRO   5  49.049 -13.912   1.033
   38    HD3  PRO   5           HD1      PRO   5  48.747 -12.770   2.360
   39    HA   PRO   6           HA       PRO   6  55.730 -13.302   1.258
   40    HB2  PRO   6           HB2      PRO   6  57.394 -14.263   3.186
   41    HB3  PRO   6           HB1      PRO   6  56.753 -12.608   3.217
   42    HG2  PRO   6           HG2      PRO   6  55.845 -15.006   4.732
   43    HG3  PRO   6           HG1      PRO   6  56.016 -13.327   5.271
   44    HD2  PRO   6           HD2      PRO   6  53.605 -14.443   4.568
   45    HD3  PRO   6           HD1      PRO   6  53.955 -12.706   4.427
   46    H    LYS   7           HN       LYS   7  57.157 -14.856   0.269
   47    HA   LYS   7           HA       LYS   7  57.229 -17.633   0.971
   48    HB2  LYS   7           HB2      LYS   7  55.947 -18.471  -1.052
   49    HB3  LYS   7           HB1      LYS   7  54.947 -17.767   0.218
   50    HG2  LYS   7           HG2      LYS   7  54.670 -15.729  -0.986
   51    HG3  LYS   7           HG1      LYS   7  55.959 -16.138  -2.118
   52    HD2  LYS   7           HD2      LYS   7  54.585 -18.066  -2.918
   53    HD3  LYS   7           HD1      LYS   7  53.276 -17.528  -1.866
   54    HE2  LYS   7           HE2      LYS   7  52.998 -15.497  -3.077
   55    HE3  LYS   7           HE1      LYS   7  54.531 -15.704  -3.923
   56    HZ1  LYS   7           HZ1      LYS   7  53.557 -16.938  -5.467
   57    HZ2  LYS   7           HZ2      LYS   7  52.058 -16.494  -4.802
   58    HZ3  LYS   7           HZ3      LYS   7  52.812 -17.937  -4.316
   59    H    ALA   8           HN       ALA   8  58.121 -14.962  -0.852
   60    HA   ALA   8           HA       ALA   8  59.415 -16.249  -3.084
   61    HB1  ALA   8           HB1      ALA   8  60.048 -13.594  -1.757
   62    HB2  ALA   8           HB2      ALA   8  58.882 -13.831  -3.058
   63    HB3  ALA   8           HB3      ALA   8  60.598 -14.106  -3.352
   64    H    GLU   9           HN       GLU   9  61.313 -17.359  -3.105
   65    HA   GLU   9           HA       GLU   9  62.724 -17.948  -0.679
   66    HB2  GLU   9           HB2      GLU   9  64.327 -19.115  -2.110
   67    HB3  GLU   9           HB1      GLU   9  62.688 -19.458  -2.660
   68    HG2  GLU   9           HG2      GLU   9  64.464 -17.300  -3.838
   69    HG3  GLU   9           HG1      GLU   9  64.255 -18.906  -4.537
   70    H1U  RCY  10           H1U      RCY  10  62.941 -15.277   6.152
   71    H1S  RCY  10           H1S      RCY  10  64.127 -15.141   2.309
   72    HB1  RCY  10           HB1      RCY  10  65.550 -12.982  -0.290
   73    HB2  RCY  10           HB2      RCY  10  65.512 -14.724  -0.019
   74    HA   RCY  10           HA       RCY  10  64.009 -13.188  -2.159
   75    HN1  RCY  10           HN1      RCY  10  62.594 -15.062  -2.094
   76    H    ARG  11           HN       ARG  11  64.637 -14.315  -4.334
   77    HA   ARG  11           HA       ARG  11  67.293 -15.533  -4.405
   78    HE   ARG  11           HE       ARG  11  67.710 -17.738  -9.487
   79    HB2  ARG  11           HB2      ARG  11  65.396 -16.011  -6.045
   80    HB3  ARG  11           HB1      ARG  11  65.732 -14.431  -6.752
   81    HG2  ARG  11           HG2      ARG  11  68.164 -15.206  -6.958
   82    HG3  ARG  11           HG1      ARG  11  67.569 -16.827  -6.600
   83    HD2  ARG  11           HD2      ARG  11  65.932 -16.547  -8.509
   84    HD3  ARG  11           HD1      ARG  11  66.779 -15.058  -8.929
   85   HH11  ARG  11          HH21      ARG  11  68.649 -14.545  -8.587
   86   HH12  ARG  11          HH22      ARG  11  70.233 -14.673  -9.276
   87   HH21  ARG  11          HH11      ARG  11  69.772 -17.924 -10.393
   88   HH22  ARG  11          HH12      ARG  11  70.869 -16.586 -10.299
   89    H    SER  12           HN       SER  12  66.171 -12.729  -6.305
   90    HA   SER  12           HA       SER  12  68.192 -10.966  -5.164
   91    HG   SER  12           HG       SER  12  69.405  -9.887  -7.830
   92    HB2  SER  12           HB2      SER  12  69.540 -12.440  -6.691
   93    HB3  SER  12           HB1      SER  12  68.556 -11.869  -8.036
   94    H    ALA  13           HN       ALA  13  65.499 -11.640  -7.163
   95    HA   ALA  13           HA       ALA  13  65.266  -9.223  -8.645
   96    HB1  ALA  13           HB1      ALA  13  63.828 -11.312  -8.867
   97    HB2  ALA  13           HB2      ALA  13  62.948  -9.784  -8.911
   98    HB3  ALA  13           HB3      ALA  13  62.951 -10.758  -7.440
   99    H    THR  14           HN       THR  14  63.798  -7.385  -8.163
  100    HA   THR  14           HA       THR  14  64.298  -6.309  -5.528
  101    HB   THR  14           HB       THR  14  62.991  -4.391  -6.285
  102    HG1  THR  14           HG1      THR  14  62.208  -4.848  -8.628
  103   HG21  THR  14          HG21      THR  14  64.726  -5.636  -8.431
  104   HG22  THR  14          HG22      THR  14  65.227  -4.494  -7.184
  105   HG23  THR  14          HG23      THR  14  64.156  -3.968  -8.483
  106    H    ARG  15           HN       ARG  15  61.477  -5.095  -5.501
  107    HA   ARG  15           HA       ARG  15  59.764  -7.372  -4.833
  108    HE   ARG  15           HE       ARG  15  57.016  -8.407  -2.175
  109    HB2  ARG  15           HB2      ARG  15  61.395  -6.816  -2.829
  110    HB3  ARG  15           HB1      ARG  15  60.294  -5.467  -2.561
  111    HG2  ARG  15           HG2      ARG  15  59.098  -8.175  -2.989
  112    HG3  ARG  15           HG1      ARG  15  59.861  -7.849  -1.432
  113    HD2  ARG  15           HD2      ARG  15  58.354  -6.146  -0.899
  114    HD3  ARG  15           HD1      ARG  15  57.939  -5.848  -2.587
  115   HH11  ARG  15          HH21      ARG  15  56.711  -5.397  -0.523
  116   HH12  ARG  15          HH22      ARG  15  55.131  -5.745   0.096
  117   HH21  ARG  15          HH11      ARG  15  54.955  -8.879  -1.377
  118   HH22  ARG  15          HH12      ARG  15  54.137  -7.716  -0.387
  119    H    VAL  16           HN       VAL  16  60.003  -3.943  -3.809
  120    HA   VAL  16           HA       VAL  16  57.837  -3.155  -5.585
  121    HB   VAL  16           HB       VAL  16  56.524  -4.293  -3.844
  122   HG11  VAL  16          HG11      VAL  16  56.843  -3.990  -1.590
  123   HG12  VAL  16          HG12      VAL  16  57.320  -2.303  -1.778
  124   HG13  VAL  16          HG13      VAL  16  58.475  -3.590  -2.124
  125   HG21  VAL  16          HG21      VAL  16  56.249  -1.329  -3.346
  126   HG22  VAL  16          HG22      VAL  16  54.977  -2.545  -3.460
  127   HG23  VAL  16          HG23      VAL  16  55.838  -2.031  -4.911
  128    H    MET  17           HN       MET  17  59.690  -1.702  -6.050
  129    HA   MET  17           HA       MET  17  60.918   0.289  -5.762
  130    HB2  MET  17           HB2      MET  17  58.205   0.929  -4.588
  131    HB3  MET  17           HB1      MET  17  59.463   2.151  -4.774
  132    HG2  MET  17           HG2      MET  17  58.499   0.413  -7.057
  133    HG3  MET  17           HG1      MET  17  57.827   2.005  -6.707
  134    HE1  MET  17           HE1      MET  17  60.650   3.821  -5.889
  135    HE2  MET  17           HE2      MET  17  58.962   3.948  -6.378
  136    HE3  MET  17           HE3      MET  17  60.230   4.547  -7.446
  137    H    GLY  18           HN       GLY  18  59.133   1.007  -2.847
  138    HA2  GLY  18           HA2      GLY  18  60.554  -0.178  -0.808
  139    HA3  GLY  18           HA1      GLY  18  61.618   1.132  -1.320
  140    H    GLY  19           HN       GLY  19  58.088   0.778  -0.786
  141    HA2  GLY  19           HA2      GLY  19  57.487   3.412  -0.136
  142    HA3  GLY  19           HA1      GLY  19  56.665   2.039   0.606
  143    HA   PRO  20           HA       PRO  20  58.462   2.381   4.612
  144    HB2  PRO  20           HB2      PRO  20  60.542   0.315   3.988
  145    HB3  PRO  20           HB1      PRO  20  59.435   0.418   5.372
  146    HG2  PRO  20           HG2      PRO  20  59.002  -1.280   3.368
  147    HG3  PRO  20           HG1      PRO  20  57.667  -0.458   4.192
  148    HD2  PRO  20           HD2      PRO  20  58.774   0.026   1.470
  149    HD3  PRO  20           HD1      PRO  20  57.132   0.306   2.087
  150    H1U  RCY  21           H1U      RCY  21  57.436   2.904   4.048
  151    H1S  RCY  21           H1S      RCY  21  61.523   0.810   3.266
  152    HB1  RCY  21           HB1      RCY  21  64.171   3.781   2.095
  153    HB2  RCY  21           HB2      RCY  21  63.107   2.708   1.186
  154    HA   RCY  21           HA       RCY  21  62.280   4.538   3.460
  155    HN1  RCY  21           HN1      RCY  21  60.405   2.864   1.854
  156    H    THR  22           HN       THR  22  61.319   6.464   2.752
  157    HA   THR  22           HA       THR  22  60.362   7.070   0.185
  158    HB   THR  22           HB       THR  22  61.873   9.027   1.928
  159    HG1  THR  22           HG1      THR  22  60.304   8.905   3.308
  160   HG21  THR  22          HG21      THR  22  61.146   9.794  -0.322
  161   HG22  THR  22          HG22      THR  22  60.300  10.639   0.974
  162   HG23  THR  22          HG23      THR  22  59.488   9.351   0.084
  163    HA   PRO  23           HA       PRO  23  64.430   6.880  -1.827
  164    HB2  PRO  23           HB2      PRO  23  63.556   6.550  -4.363
  165    HB3  PRO  23           HB1      PRO  23  63.499   5.232  -3.174
  166    HG2  PRO  23           HG2      PRO  23  61.307   6.990  -4.142
  167    HG3  PRO  23           HG1      PRO  23  61.279   5.267  -3.738
  168    HD2  PRO  23           HD2      PRO  23  60.387   7.308  -2.058
  169    HD3  PRO  23           HD1      PRO  23  60.840   5.675  -1.522
  170    H    ARG  24           HN       ARG  24  65.603   8.297  -3.300
  171    HA   ARG  24           HA       ARG  24  66.145  10.391  -4.195
  172    HE   ARG  24           HE       ARG  24  63.134  12.224  -3.739
  173    HB2  ARG  24           HB2      ARG  24  64.335   9.693  -5.802
  174    HB3  ARG  24           HB1      ARG  24  63.181  10.573  -4.804
  175    HG2  ARG  24           HG2      ARG  24  65.434  12.278  -5.306
  176    HG3  ARG  24           HG1      ARG  24  64.872  11.620  -6.843
  177    HD2  ARG  24           HD2      ARG  24  63.728  13.766  -6.128
  178    HD3  ARG  24           HD1      ARG  24  62.636  12.422  -6.461
  179   HH11  ARG  24          HH21      ARG  24  62.049  14.657  -5.927
  180   HH12  ARG  24          HH22      ARG  24  61.055  15.456  -4.756
  181   HH21  ARG  24          HH11      ARG  24  61.842  13.253  -2.196
  182   HH22  ARG  24          HH12      ARG  24  60.938  14.661  -2.643
  183    H    LYS  25           HN       LYS  25  66.540  12.283  -3.158
  184    HA   LYS  25           HA       LYS  25  64.448  13.370  -1.318
  185    HB2  LYS  25           HB2      LYS  25  67.395  13.394  -0.641
  186    HB3  LYS  25           HB1      LYS  25  66.028  13.718   0.423
  187    HG2  LYS  25           HG2      LYS  25  66.396  11.542   1.055
  188    HG3  LYS  25           HG1      LYS  25  65.387  11.212  -0.354
  189    HD2  LYS  25           HD2      LYS  25  67.566  11.200  -1.712
  190    HD3  LYS  25           HD1      LYS  25  68.402  11.125  -0.161
  191    HE2  LYS  25           HE2      LYS  25  66.275   9.162  -1.065
  192    HE3  LYS  25           HE1      LYS  25  68.011   8.866  -1.146
  193    HZ1  LYS  25           HZ1      LYS  25  66.346   9.272   1.269
  194    HZ2  LYS  25           HZ2      LYS  25  68.043   9.352   1.303
  195    HZ3  LYS  25           HZ3      LYS  25  67.268   7.909   0.854
  196    H    GLY  26           HN       GLY  26  67.678  14.127  -2.672
  197    HA2  GLY  26           HA2      GLY  26  66.609  16.602  -3.846
  198    HA3  GLY  26           HA1      GLY  26  67.796  16.837  -2.562
  199    HA   PRO  27           HA       PRO  27  69.934  16.598  -6.764
  200    HB2  PRO  27           HB2      PRO  27  71.719  18.351  -5.117
  201    HB3  PRO  27           HB1      PRO  27  71.238  18.513  -6.818
  202    HG2  PRO  27           HG2      PRO  27  70.168  20.036  -4.911
  203    HG3  PRO  27           HG1      PRO  27  69.218  19.469  -6.295
  204    HD2  PRO  27           HD2      PRO  27  69.119  18.573  -3.455
  205    HD3  PRO  27           HD1      PRO  27  67.839  18.563  -4.688
  206    HA   PRO  28           HA       PRO  28  72.776  13.325  -5.861
  207    HB2  PRO  28           HB2      PRO  28  74.885  15.107  -7.038
  208    HB3  PRO  28           HB1      PRO  28  74.537  13.400  -7.377
  209    HG2  PRO  28           HG2      PRO  28  73.761  15.369  -9.021
  210    HG3  PRO  28           HG1      PRO  28  72.810  13.893  -8.794
  211    HD2  PRO  28           HD2      PRO  28  72.214  16.644  -7.894
  212    HD3  PRO  28           HD1      PRO  28  71.114  15.265  -8.104
  213    H    LYS  29           HN       LYS  29  74.136  12.779  -4.136
  214    HA   LYS  29           HA       LYS  29  75.692  14.910  -2.795
  215    HB2  LYS  29           HB2      LYS  29  73.276  13.559  -1.648
  216    HB3  LYS  29           HB1      LYS  29  74.629  13.891  -0.566
  217    HG2  LYS  29           HG2      LYS  29  74.593  16.271  -1.294
  218    HG3  LYS  29           HG1      LYS  29  73.183  15.921  -2.295
  219    HD2  LYS  29           HD2      LYS  29  71.808  15.501  -0.428
  220    HD3  LYS  29           HD1      LYS  29  73.187  15.265   0.647
  221    HE2  LYS  29           HE2      LYS  29  72.057  17.466   0.997
  222    HE3  LYS  29           HE1      LYS  29  73.746  17.635   0.518
  223    HZ1  LYS  29           HZ1      LYS  29  71.314  18.105  -1.075
  224    HZ2  LYS  29           HZ2      LYS  29  72.778  17.723  -1.847
  225    HZ3  LYS  29           HZ3      LYS  29  72.667  19.107  -0.868
  226    H1U  RCY  30           H1U      RCY  30  80.046  16.017  -6.950
  227    H1S  RCY  30           H1S      RCY  30  78.173  11.578  -6.494
  228    HB1  RCY  30           HB1      RCY  30  79.116  10.330  -3.246
  229    HB2  RCY  30           HB2      RCY  30  79.446  11.891  -3.999
  230    HA   RCY  30           HA       RCY  30  77.918  11.299  -1.472
  231    HN1  RCY  30           HN1      RCY  30  77.667  13.991  -2.674
  232    H    LYS  31           HN       LYS  31  79.408  14.277  -2.620
  233    HA   LYS  31           HA       LYS  31  81.434  15.317  -2.005
  234    HB2  LYS  31           HB2      LYS  31  80.877  14.145   0.723
  235    HB3  LYS  31           HB1      LYS  31  81.594  15.706   0.327
  236    HG2  LYS  31           HG2      LYS  31  78.730  14.910  -0.271
  237    HG3  LYS  31           HG1      LYS  31  79.235  15.938   1.070
  238    HD2  LYS  31           HD2      LYS  31  80.317  17.460  -0.659
  239    HD3  LYS  31           HD1      LYS  31  79.480  16.515  -1.891
  240    HE2  LYS  31           HE2      LYS  31  78.216  18.564  -1.202
  241    HE3  LYS  31           HE1      LYS  31  77.319  17.071  -0.923
  242    HZ1  LYS  31           HZ1      LYS  31  78.965  18.402   1.154
  243    HZ2  LYS  31           HZ2      LYS  31  77.864  17.125   1.367
  244    HZ3  LYS  31           HZ3      LYS  31  77.302  18.677   0.965
  245    H    GLN  32           HN       GLN  32  83.304  14.584  -0.007
  246    HA   GLN  32           HA       GLN  32  84.528  12.211  -1.322
  247    HB2  GLN  32           HB2      GLN  32  85.716  14.274   0.561
  248    HB3  GLN  32           HB1      GLN  32  86.611  12.969  -0.219
  249    HG2  GLN  32           HG2      GLN  32  86.266  13.888  -2.388
  250    HG3  GLN  32           HG1      GLN  32  85.018  14.989  -1.806
  251   HE21  GLN  32          HE21      GLN  32  86.113  16.957  -2.397
  252   HE22  GLN  32          HE22      GLN  32  87.562  17.449  -1.661
  253    H    ARG  33           HN       ARG  33  86.229  11.421   0.774
  254    HA   ARG  33           HA       ARG  33  84.826  10.995   3.249
  255    HE   ARG  33           HE       ARG  33  84.411   7.700  -1.641
  256    HB2  ARG  33           HB2      ARG  33  84.635   8.418   2.792
  257    HB3  ARG  33           HB1      ARG  33  83.359   9.490   2.214
  258    HG2  ARG  33           HG2      ARG  33  84.194   9.459  -0.013
  259    HG3  ARG  33           HG1      ARG  33  85.734   8.762   0.493
  260    HD2  ARG  33           HD2      ARG  33  84.756   6.644   0.934
  261    HD3  ARG  33           HD1      ARG  33  83.121   7.305   0.907
  262   HH11  ARG  33          HH21      ARG  33  82.937   5.371   0.431
  263   HH12  ARG  33          HH22      ARG  33  82.409   4.353  -0.868
  264   HH21  ARG  33          HH11      ARG  33  83.730   6.384  -3.349
  265   HH22  ARG  33          HH12      ARG  33  82.858   4.927  -3.008
  266    H    GLN  34           HN       GLN  34  86.813  11.383   4.240
  267    HA   GLN  34           HA       GLN  34  88.650   9.159   4.426
  268    HB2  GLN  34           HB2      GLN  34  89.296  10.224   2.212
  269    HB3  GLN  34           HB1      GLN  34  89.765  11.658   3.126
  270    HG2  GLN  34           HG2      GLN  34  91.403  10.391   4.388
  271    HG3  GLN  34           HG1      GLN  34  90.856   8.880   3.660
  272   HE21  GLN  34          HE21      GLN  34  91.260   8.609   1.288
  273   HE22  GLN  34          HE22      GLN  34  92.525   9.467   0.551
  274    H    THR  35           HN       THR  35  89.109   9.261   6.567
  275    HA   THR  35           HA       THR  35  90.300  11.633   7.737
  276    HB   THR  35           HB       THR  35  87.670  10.848   8.982
  277    HG1  THR  35           HG1      THR  35  86.640  12.296   7.721
  278   HG21  THR  35          HG21      THR  35  89.366  13.360   8.985
  279   HG22  THR  35          HG22      THR  35  89.208  12.205  10.309
  280   HG23  THR  35          HG23      THR  35  87.824  13.186   9.824
  281    H    ARG  36           HN       ARG  36  90.198   8.472   7.467
  282    HA   ARG  36           HA       ARG  36  90.982   6.686   8.766
  283    HE   ARG  36           HE       ARG  36  94.263   4.610  10.637
  284    HB2  ARG  36           HB2      ARG  36  92.724   8.572   9.246
  285    HB3  ARG  36           HB1      ARG  36  91.917   8.699  10.808
  286    HG2  ARG  36           HG2      ARG  36  93.532   7.109  11.310
  287    HG3  ARG  36           HG1      ARG  36  92.207   6.061  10.802
  288    HD2  ARG  36           HD2      ARG  36  93.141   5.936   8.538
  289    HD3  ARG  36           HD1      ARG  36  94.439   7.039   8.995
  290   HH11  ARG  36          HH21      ARG  36  95.558   6.224   7.880
  291   HH12  ARG  36          HH22      ARG  36  96.946   5.194   7.763
  292   HH21  ARG  36          HH11      ARG  36  96.068   3.256  10.501
  293   HH22  ARG  36          HH12      ARG  36  97.234   3.514   9.247
  294    H    GLN  37           HN       GLN  37  88.297   8.010   9.287
  295    HA   GLN  37           HA       GLN  37  87.409   6.333  11.393
  296    HB2  GLN  37           HB2      GLN  37  88.708   8.746  12.301
  297    HB3  GLN  37           HB1      GLN  37  86.997   8.831  12.713
  298    HG2  GLN  37           HG2      GLN  37  88.659   6.366  13.269
  299    HG3  GLN  37           HG1      GLN  37  88.527   7.689  14.429
  300   HE21  GLN  37          HE21      GLN  37  87.038   7.046  15.998
  301   HE22  GLN  37          HE22      GLN  37  85.537   6.322  15.673
  302    H1U  RCY  38           H1U      RCY  38  81.480   6.957   3.673
  303    H1S  RCY  38           H1S      RCY  38  80.973   7.924   7.599
  304    HB1  RCY  38           HB1      RCY  38  82.652   6.161  11.346
  305    HB2  RCY  38           HB2      RCY  38  83.177   5.380   9.854
  306    HA   RCY  38           HA       RCY  38  83.891   7.625   8.996
  307    HN1  RCY  38           HN1      RCY  38  85.286   6.089  10.890
  308    H    LYS  39           HN       LYS  39  83.146   7.706  12.499
  309    HA   LYS  39           HA       LYS  39  83.206  10.622  12.537
  310    HB2  LYS  39           HB2      LYS  39  80.775  10.817  13.186
  311    HB3  LYS  39           HB1      LYS  39  81.041  10.393  11.496
  312    HG2  LYS  39           HG2      LYS  39  80.118   8.325  11.739
  313    HG3  LYS  39           HG1      LYS  39  80.867   8.076  13.317
  314    HD2  LYS  39           HD2      LYS  39  79.188   9.586  14.339
  315    HD3  LYS  39           HD1      LYS  39  78.421   9.782  12.762
  316    HE2  LYS  39           HE2      LYS  39  77.701   7.540  12.697
  317    HE3  LYS  39           HE1      LYS  39  78.855   7.039  13.933
  318    HZ1  LYS  39           HZ1      LYS  39  76.642   8.939  14.459
  319    HZ2  LYS  39           HZ2      LYS  39  77.630   8.152  15.596
  320    HZ3  LYS  39           HZ3      LYS  39  76.497   7.265  14.692
  321    H    SER  40           HN       SER  40  82.649   7.537  14.059
  322    HA   SER  40           HA       SER  40  83.917   8.213  16.484
  323    HG   SER  40           HG       SER  40  80.529   7.958  15.790
  324    HB2  SER  40           HB2      SER  40  81.679   8.172  17.893
  325    HB3  SER  40           HB1      SER  40  82.261   9.685  17.206
  326    H    LYS  41           HN       LYS  41  82.230   6.158  14.460
  327    HA   LYS  41           HA       LYS  41  82.500   3.906  16.416
  328    HB2  LYS  41           HB2      LYS  41  80.380   4.023  14.261
  329    HB3  LYS  41           HB1      LYS  41  80.482   2.909  15.623
  330    HG2  LYS  41           HG2      LYS  41  80.246   5.884  16.063
  331    HG3  LYS  41           HG1      LYS  41  78.815   4.883  15.815
  332    HD2  LYS  41           HD2      LYS  41  80.706   3.749  17.754
  333    HD3  LYS  41           HD1      LYS  41  80.045   5.307  18.249
  334    HE2  LYS  41           HE2      LYS  41  78.580   3.526  19.046
  335    HE3  LYS  41           HE1      LYS  41  77.752   4.439  17.785
  336    HZ1  LYS  41           HZ1      LYS  41  78.040   1.764  17.809
  337    HZ2  LYS  41           HZ2      LYS  41  79.331   2.234  16.809
  338    HZ3  LYS  41           HZ3      LYS  41  77.742   2.689  16.419
  339    HA   PRO  42           HA       PRO  42  84.871   2.972  12.578
  340    HB2  PRO  42           HB2      PRO  42  87.195   2.233  13.769
  341    HB3  PRO  42           HB1      PRO  42  86.773   3.933  13.487
  342    HG2  PRO  42           HG2      PRO  42  86.669   2.352  15.994
  343    HG3  PRO  42           HG1      PRO  42  87.063   4.060  15.748
  344    HD2  PRO  42           HD2      PRO  42  84.590   3.082  16.630
  345    HD3  PRO  42           HD1      PRO  42  84.878   4.705  15.966
  346    HA   PRO  43           HA       PRO  43  84.229  -1.413  12.728
  347    HB2  PRO  43           HB2      PRO  43  86.068  -2.311  10.914
  348    HB3  PRO  43           HB1      PRO  43  84.598  -1.434  10.446
  349    HG2  PRO  43           HG2      PRO  43  87.388  -0.430  10.708
  350    HG3  PRO  43           HG1      PRO  43  86.163  -0.058   9.483
  351    HD2  PRO  43           HD2      PRO  43  86.733   1.618  11.576
  352    HD3  PRO  43           HD1      PRO  43  85.134   1.541  10.803
  353    H    LYS  44           HN       LYS  44  84.881  -2.991  14.147
  354    HA   LYS  44           HA       LYS  44  87.418  -2.721  15.545
  355    HB2  LYS  44           HB2      LYS  44  85.386  -3.558  16.683
  356    HB3  LYS  44           HB1      LYS  44  85.376  -4.965  15.618
  357    HG2  LYS  44           HG2      LYS  44  87.410  -5.799  16.527
  358    HG3  LYS  44           HG1      LYS  44  87.770  -4.268  17.326
  359    HD2  LYS  44           HD2      LYS  44  86.952  -5.851  18.987
  360    HD3  LYS  44           HD1      LYS  44  85.742  -4.589  18.754
  361    HE2  LYS  44           HE2      LYS  44  84.339  -6.001  17.485
  362    HE3  LYS  44           HE1      LYS  44  85.637  -7.153  17.170
  363    HZ1  LYS  44           HZ1      LYS  44  84.165  -8.024  18.837
  364    HZ2  LYS  44           HZ2      LYS  44  84.342  -6.628  19.789
  365    HZ3  LYS  44           HZ3      LYS  44  85.662  -7.671  19.553
  366    H    LYS  45           HN       LYS  45  86.464  -4.190  12.639
  367    HA   LYS  45           HA       LYS  45  87.952  -6.560  12.498
  368    HB2  LYS  45           HB2      LYS  45  87.713  -4.476  10.305
  369    HB3  LYS  45           HB1      LYS  45  88.066  -6.190  10.084
  370    HG2  LYS  45           HG2      LYS  45  85.857  -6.693  11.210
  371    HG3  LYS  45           HG1      LYS  45  85.502  -4.967  11.134
  372    HD2  LYS  45           HD2      LYS  45  85.850  -5.053   8.658
  373    HD3  LYS  45           HD1      LYS  45  86.051  -6.801   8.783
  374    HE2  LYS  45           HE2      LYS  45  83.582  -5.178   9.439
  375    HE3  LYS  45           HE1      LYS  45  83.754  -6.421   8.199
  376    HZ1  LYS  45           HZ1      LYS  45  83.900  -6.832  11.137
  377    HZ2  LYS  45           HZ2      LYS  45  84.170  -8.039   9.972
  378    HZ3  LYS  45           HZ3      LYS  45  82.637  -7.320  10.114
  379    H    GLY  46           HN       GLY  46  89.265  -3.735  10.798
  380    HA2  GLY  46           HA2      GLY  46  91.579  -3.292  12.341
  381    HA3  GLY  46           HA1      GLY  46  91.978  -4.594  11.219
  382    H    VAL  47           HN       VAL  47  91.178  -4.056   8.859
  383    HA   VAL  47           HA       VAL  47  92.678  -1.956   7.816
  384    HB   VAL  47           HB       VAL  47  91.870  -3.498   6.235
  385   HG11  VAL  47          HG11      VAL  47  89.161  -2.987   7.486
  386   HG12  VAL  47          HG12      VAL  47  90.071  -4.498   7.461
  387   HG13  VAL  47          HG13      VAL  47  89.360  -3.872   5.973
  388   HG21  VAL  47          HG21      VAL  47  90.768  -2.176   4.602
  389   HG22  VAL  47          HG22      VAL  47  91.628  -1.003   5.600
  390   HG23  VAL  47          HG23      VAL  47  89.895  -1.249   5.822
  391    H    GLN  48           HN       GLN  48  92.530   0.188   8.242
  392    HA   GLN  48           HA       GLN  48  89.830   1.441   8.301
  393    HB2  GLN  48           HB2      GLN  48  90.512   2.799  10.281
  394    HB3  GLN  48           HB1      GLN  48  90.390   1.079  10.648
  395    HG2  GLN  48           HG2      GLN  48  92.946   1.055  10.009
  396    HG3  GLN  48           HG1      GLN  48  92.849   2.782  10.359
  397   HE21  GLN  48          HE21      GLN  48  90.821   2.539  12.472
  398   HE22  GLN  48          HE22      GLN  48  91.583   1.811  13.802
  399    H    GLY  49           HN       GLY  49  89.997   2.773   6.566
  400    HA2  GLY  49           HA2      GLY  49  92.021   4.894   6.605
  401    HA3  GLY  49           HA1      GLY  49  92.165   3.783   5.240
  402    H1U  RCY  50           H1U      RCY  50  84.527   0.893   5.723
  403    H1S  RCY  50           H1S      RCY  50  87.208   2.313   6.818
  404    HB1  RCY  50           HB1      RCY  50  87.358   4.448   4.352
  405    HB2  RCY  50           HB2      RCY  50  86.227   5.746   4.734
  406    HA   RCY  50           HA       RCY  50  88.582   6.544   4.351
  407    HN1  RCY  50           HN1      RCY  50  89.378   5.273   6.919
  408    H    GLY  51           HN       GLY  51  86.033   7.405   5.338
  409    HA2  GLY  51           HA2      GLY  51  85.985   8.545   7.896
  410    HA3  GLY  51           HA1      GLY  51  86.858   9.698   6.885
  411    H    ASP  52           HN       ASP  52  84.272  10.147   8.109
  412    HA   ASP  52           HA       ASP  52  82.822  11.003   5.712
  413    HB2  ASP  52           HB2      ASP  52  82.111   8.583   6.182
  414    HB3  ASP  52           HB1      ASP  52  81.363   9.201   7.654
  415    H    ASP  53           HN       ASP  53  83.996  12.566   7.644
  416    HA   ASP  53           HA       ASP  53  82.198  13.243   9.806
  417    HB2  ASP  53           HB2      ASP  53  84.717  13.750   9.627
  418    HB3  ASP  53           HB1      ASP  53  84.251  15.101   8.593
  419    H    ILE  54           HN       ILE  54  81.325  13.296   6.817
  420    HA   ILE  54           HA       ILE  54  80.228  16.077   6.791
  421    HB   ILE  54           HB       ILE  54  80.363  14.096   4.500
  422   HG12  ILE  54          HG12      ILE  54  82.588  14.999   5.565
  423   HG13  ILE  54          HG11      ILE  54  82.385  15.060   3.814
  424   HG21  ILE  54          HG21      ILE  54  78.690  15.711   4.039
  425   HG22  ILE  54          HG22      ILE  54  80.127  16.325   3.222
  426   HG23  ILE  54          HG23      ILE  54  79.630  17.013   4.768
  427   HD11  ILE  54          HD11      ILE  54  83.216  17.210   4.965
  428   HD12  ILE  54          HD12      ILE  54  81.572  17.369   5.583
  429   HD13  ILE  54          HD13      ILE  54  81.865  17.375   3.844
  430    HA   PRO  55           HA       PRO  55  76.542  13.535   7.729
  431    HB2  PRO  55           HB2      PRO  55  75.198  15.416   9.154
  432    HB3  PRO  55           HB1      PRO  55  76.523  14.464   9.852
  433    HG2  PRO  55           HG2      PRO  55  76.530  17.265   8.863
  434    HG3  PRO  55           HG1      PRO  55  77.381  16.549  10.241
  435    HD2  PRO  55           HD2      PRO  55  78.543  17.086   7.766
  436    HD3  PRO  55           HD1      PRO  55  79.182  15.934   8.959
  437    H    GLY  56           HN       GLY  56  76.926  14.848   5.188
  438    HA2  GLY  56           HA2      GLY  56  74.906  16.724   4.518
  439    HA3  GLY  56           HA1      GLY  56  75.641  15.598   3.375
  440    H    MET  57           HN       MET  57  74.725  13.377   3.323
  441    HA   MET  57           HA       MET  57  72.302  12.668   4.649
  442    HB2  MET  57           HB2      MET  57  71.957  14.577   2.550
  443    HB3  MET  57           HB1      MET  57  71.310  13.047   1.966
  444    HG2  MET  57           HG2      MET  57  70.602  14.345   4.615
  445    HG3  MET  57           HG1      MET  57  69.587  14.354   3.172
  446    HE1  MET  57           HE1      MET  57  68.165  11.004   2.732
  447    HE2  MET  57           HE2      MET  57  68.927  12.362   1.908
  448    HE3  MET  57           HE3      MET  57  67.612  12.655   3.044
  449    H    GLU  58           HN       GLU  58  74.700  11.364   3.964
  450    HA   GLU  58           HA       GLU  58  75.459   9.339   3.060
  451    HB2  GLU  58           HB2      GLU  58  72.557   8.771   2.417
  452    HB3  GLU  58           HB1      GLU  58  73.841   7.610   2.752
  453    HG2  GLU  58           HG2      GLU  58  72.716   9.613   4.732
  454    HG3  GLU  58           HG1      GLU  58  72.377   7.882   4.717
  455    H    GLY  59           HN       GLY  59  72.630   9.771   0.934
  456    HA2  GLY  59           HA2      GLY  59  73.392  11.083  -1.250
  457    HA3  GLY  59           HA1      GLY  59  74.477   9.698  -1.389
  458    H1U  RCY  60           H1U      RCY  60  73.993   4.632   3.960
  459    H1S  RCY  60           H1S      RCY  60  70.973   6.134   1.664
  460    HB1  RCY  60           HB1      RCY  60  71.771   5.465  -1.855
  461    HB2  RCY  60           HB2      RCY  60  70.149   5.995  -2.296
  462    HA   RCY  60           HA       RCY  60  72.180   6.734  -3.777
  463    HN1  RCY  60           HN1      RCY  60  73.698   7.909  -2.389
  464    H    GLY  61           HN       GLY  61  71.601   8.425  -5.262
  465    HA2  GLY  61           HA2      GLY  61  69.504  10.321  -4.721
  466    HA3  GLY  61           HA1      GLY  61  70.114   9.901  -6.323
  467    H    THR  62           HN       THR  62  69.202   8.000  -7.380
  468    HA   THR  62           HA       THR  62  66.746   6.874  -6.156
  469    HB   THR  62           HB       THR  62  65.366   8.149  -7.414
  470    HG1  THR  62           HG1      THR  62  66.679   7.371  -9.770
  471   HG21  THR  62          HG21      THR  62  67.071   9.887  -7.461
  472   HG22  THR  62          HG22      THR  62  66.281   9.812  -9.037
  473   HG23  THR  62          HG23      THR  62  67.879   9.099  -8.816
  474    H    ASP  63           HN       ASP  63  68.629   6.926  -9.207
  475    HA   ASP  63           HA       ASP  63  67.982   4.325 -10.075
  476    HB2  ASP  63           HB2      ASP  63  69.284   6.045 -11.376
  477    HB3  ASP  63           HB1      ASP  63  70.688   5.656 -10.381
  478    H    ILE  64           HN       ILE  64  70.574   5.371  -7.870
  479    HA   ILE  64           HA       ILE  64  71.619   2.702  -7.512
  480    HB   ILE  64           HB       ILE  64  73.285   4.108  -6.832
  481   HG12  ILE  64          HG12      ILE  64  71.643   4.417  -4.305
  482   HG13  ILE  64          HG11      ILE  64  72.469   2.917  -4.727
  483   HG21  ILE  64          HG21      ILE  64  72.813   6.404  -5.937
  484   HG22  ILE  64          HG22      ILE  64  71.089   6.054  -6.067
  485   HG23  ILE  64          HG23      ILE  64  72.090   6.109  -7.518
  486   HD11  ILE  64          HD11      ILE  64  73.729   4.599  -3.210
  487   HD12  ILE  64          HD12      ILE  64  73.950   5.543  -4.683
  488   HD13  ILE  64          HD13      ILE  64  74.605   3.909  -4.576
  489    H    THR  65           HN       THR  65  69.639   4.799  -5.440
  490    HA   THR  65           HA       THR  65  69.148   3.317  -3.222
  491    HB   THR  65           HB       THR  65  66.820   4.386  -4.829
  492    HG1  THR  65           HG1      THR  65  68.461   5.931  -4.816
  493   HG21  THR  65          HG21      THR  65  66.292   3.209  -2.730
  494   HG22  THR  65          HG22      THR  65  65.956   4.934  -2.583
  495   HG23  THR  65          HG23      THR  65  67.414   4.254  -1.859
  496    H    VAL  66           HN       VAL  66  68.129   2.396  -6.463
  497    HA   VAL  66           HA       VAL  66  67.057  -0.157  -5.309
  498    HB   VAL  66           HB       VAL  66  65.617  -0.189  -7.443
  499   HG11  VAL  66          HG11      VAL  66  63.885   1.198  -6.390
  500   HG12  VAL  66          HG12      VAL  66  65.103   1.969  -5.373
  501   HG13  VAL  66          HG13      VAL  66  64.736   0.257  -5.165
  502   HG21  VAL  66          HG21      VAL  66  65.200   1.933  -8.517
  503   HG22  VAL  66          HG22      VAL  66  66.946   1.684  -8.510
  504   HG23  VAL  66          HG23      VAL  66  66.207   2.783  -7.345
  505    H    ILE  67           HN       ILE  67  68.793   1.409  -7.958
  506    HA   ILE  67           HA       ILE  67  70.043  -1.231  -8.590
  507    HB   ILE  67           HB       ILE  67  69.169   0.829 -10.641
  508   HG12  ILE  67          HG12      ILE  67  68.066  -1.948 -10.116
  509   HG13  ILE  67          HG11      ILE  67  67.294  -0.462  -9.562
  510   HG21  ILE  67          HG21      ILE  67  70.425  -1.922 -10.887
  511   HG22  ILE  67          HG22      ILE  67  71.177  -0.384 -11.316
  512   HG23  ILE  67          HG23      ILE  67  69.801  -0.982 -12.243
  513   HD11  ILE  67          HD11      ILE  67  66.255  -1.086 -11.651
  514   HD12  ILE  67          HD12      ILE  67  67.825  -1.286 -12.429
  515   HD13  ILE  67          HD13      ILE  67  67.271   0.322 -11.961
  516    H1U  RCY  68           H1U      RCY  68  74.214   0.628  -0.156
  517    H1S  RCY  68           H1S      RCY  68  73.523   1.933  -4.237
  518    HB1  RCY  68           HB1      RCY  68  73.971   2.023  -6.224
  519    HB2  RCY  68           HB2      RCY  68  74.662   0.401  -6.267
  520    HA   RCY  68           HA       RCY  68  73.295   1.857  -8.371
  521    HN1  RCY  68           HN1      RCY  68  71.939  -0.650  -7.507
  522    HA   PRO  69           HA       PRO  69  76.452   0.220 -10.922
  523    HB2  PRO  69           HB2      PRO  69  78.330   0.848  -8.661
  524    HB3  PRO  69           HB1      PRO  69  78.504   1.193 -10.394
  525    HG2  PRO  69           HG2      PRO  69  77.729   3.064  -8.638
  526    HG3  PRO  69           HG1      PRO  69  77.131   3.023 -10.304
  527    HD2  PRO  69           HD2      PRO  69  75.679   2.454  -7.803
  528    HD3  PRO  69           HD1      PRO  69  75.035   2.819  -9.418
  529    H    TRP  70           HN       TRP  70  76.505  -0.831  -7.533
  530    HA   TRP  70           HA       TRP  70  78.199  -3.094  -7.846
  531    HD1  TRP  70           HD1      TRP  70  78.228  -5.437  -6.592
  532    HE1  TRP  70           HE1      TRP  70  76.998  -7.492  -5.641
  533    HE3  TRP  70           HE3      TRP  70  74.113  -3.159  -4.603
  534    HZ2  TRP  70           HZ2      TRP  70  74.583  -8.093  -4.222
  535    HZ3  TRP  70           HZ3      TRP  70  72.368  -4.492  -3.461
  536    HH2  TRP  70           HH2      TRP  70  72.595  -6.952  -3.267
  537    HB2  TRP  70           HB2      TRP  70  77.742  -2.641  -5.610
  538    HB3  TRP  70           HB1      TRP  70  76.039  -2.309  -5.919
  539    H    GLU  71           HN       GLU  71  74.621  -2.981  -7.868
  540    HA   GLU  71           HA       GLU  71  74.138  -5.651  -8.569
  541    HB2  GLU  71           HB2      GLU  71  72.641  -3.145  -9.384
  542    HB3  GLU  71           HB1      GLU  71  72.016  -4.782  -9.598
  543    HG2  GLU  71           HG2      GLU  71  72.982  -3.854  -6.900
  544    HG3  GLU  71           HG1      GLU  71  71.346  -3.481  -7.445
  545    H    ALA  72           HN       ALA  72  74.668  -2.890 -10.781
  546    HA   ALA  72           HA       ALA  72  74.524  -4.584 -13.143
  547    HB1  ALA  72           HB1      ALA  72  73.992  -2.091 -13.028
  548    HB2  ALA  72           HB2      ALA  72  75.003  -2.602 -14.380
  549    HB3  ALA  72           HB3      ALA  72  75.734  -1.819 -12.979
  550    H1U  RCY  73           H1U      RCY  73  76.245  -0.172  -6.836
  551    H1S  RCY  73           H1S      RCY  73  78.730  -0.014 -10.399
  552    HB1  RCY  73           HB1      RCY  73  80.726  -3.728 -10.976
  553    HB2  RCY  73           HB2      RCY  73  79.278  -3.405 -10.022
  554    HA   RCY  73           HA       RCY  73  79.229  -4.096 -12.972
  555    HN1  RCY  73           HN1      RCY  73  77.132  -3.337 -11.108
  556    H    ASN  74           HN       ASN  74  78.090  -5.493  -9.869
  557    HA   ASN  74           HA       ASN  74  78.436  -8.191 -10.841
  558    HB2  ASN  74           HB2      ASN  74  80.837  -7.248 -10.386
  559    HB3  ASN  74           HB1      ASN  74  80.417  -7.474  -8.688
  560   HD21  ASN  74          HD21      ASN  74  82.310  -9.014 -10.616
  561   HD22  ASN  74          HD22      ASN  74  81.857 -10.635 -10.404
  562    H    HIS  75           HN       HIS  75  78.249  -9.776  -8.902
  563    HA   HIS  75           HA       HIS  75  76.127  -8.730  -7.139
  564    HD1  HIS  75           HD1      HIS  75  79.154 -11.137  -6.791
  565    HD2  HIS  75           HD2      HIS  75  76.581 -12.919  -9.548
  566    HE1  HIS  75           HE1      HIS  75  80.551 -12.788  -8.110
  567    HE2  HIS  75           HE2      HIS  75  78.996 -13.880  -9.792
  568    HB2  HIS  75           HB2      HIS  75  76.136 -11.229  -6.401
  569    HB3  HIS  75           HB1      HIS  75  75.559 -10.837  -8.021
  570    H1U  RCY  76           H1U      RCY  76  80.652  -1.981   0.448
  571    H1S  RCY  76           H1S      RCY  76  80.205  -5.680  -1.906
  572    HB1  RCY  76           HB1      RCY  76  77.343  -7.066  -3.328
  573    HB2  RCY  76           HB2      RCY  76  78.990  -7.247  -3.926
  574    HA   RCY  76           HA       RCY  76  78.918  -9.629  -3.658
  575    HN1  RCY  76           HN1      RCY  76  76.222  -9.174  -4.788
  576    H    GLU  77           HN       GLU  77  75.501  -9.696  -3.472
  577    HA   GLU  77           HA       GLU  77  75.215 -10.007  -0.621
  578    HB2  GLU  77           HB2      GLU  77  72.974 -10.683  -1.081
  579    HB3  GLU  77           HB1      GLU  77  73.366  -9.491  -2.317
  580    HG2  GLU  77           HG2      GLU  77  73.361 -12.506  -2.616
  581    HG3  GLU  77           HG1      GLU  77  72.311 -11.350  -3.435
  582    H    LEU  78           HN       LEU  78  76.362 -12.075  -3.129
  583    HA   LEU  78           HA       LEU  78  75.723 -14.636  -2.130
  584    HG   LEU  78           HG       LEU  78  78.072 -16.169  -4.400
  585    HB2  LEU  78           HB2      LEU  78  77.076 -13.859  -4.271
  586    HB3  LEU  78           HB1      LEU  78  78.471 -14.088  -3.222
  587   HD11  LEU  78          HD11      LEU  78  77.931 -17.657  -2.545
  588   HD12  LEU  78          HD12      LEU  78  76.899 -16.549  -1.639
  589   HD13  LEU  78          HD13      LEU  78  78.602 -16.164  -1.888
  590   HD21  LEU  78          HD21      LEU  78  75.998 -17.089  -4.755
  591   HD22  LEU  78          HD22      LEU  78  75.478 -15.420  -4.520
  592   HD23  LEU  78          HD23      LEU  78  75.385 -16.569  -3.185
  593    H    HIS  79           HN       HIS  79  78.821 -12.924  -1.578
  594    HA   HIS  79           HA       HIS  79  79.246 -14.560   0.848
  595    HD1  HIS  79           HD1      HIS  79  81.792 -15.770  -1.224
  596    HD2  HIS  79           HD2      HIS  79  80.433 -12.102  -2.672
  597    HE1  HIS  79           HE1      HIS  79  81.914 -15.909  -3.750
  598    HE2  HIS  79           HE2      HIS  79  81.089 -13.682  -4.644
  599    HB2  HIS  79           HB2      HIS  79  81.158 -12.390   0.144
  600    HB3  HIS  79           HB1      HIS  79  81.476 -14.058   0.621
  601    H    GLU  80           HN       GLU  80  80.390 -13.046   2.675
  602    HA   GLU  80           HA       GLU  80  78.296 -11.055   3.376
  603    HB2  GLU  80           HB2      GLU  80  80.477 -12.393   5.003
  604    HB3  GLU  80           HB1      GLU  80  79.404 -11.149   5.644
  605    HG2  GLU  80           HG2      GLU  80  77.457 -12.609   4.898
  606    HG3  GLU  80           HG1      GLU  80  78.639 -13.884   4.598
  607    H    LEU  81           HN       LEU  81  81.148 -10.504   5.063
  608    HA   LEU  81           HA       LEU  81  81.505  -7.914   3.784
  609    HG   LEU  81           HG       LEU  81  84.501  -9.464   5.182
  610    HB2  LEU  81           HB2      LEU  81  83.101  -7.466   5.494
  611    HB3  LEU  81           HB1      LEU  81  81.856  -8.443   6.266
  612   HD11  LEU  81          HD11      LEU  81  83.425  -8.991   7.970
  613   HD12  LEU  81          HD12      LEU  81  84.893  -8.330   7.250
  614   HD13  LEU  81          HD13      LEU  81  84.804 -10.044   7.653
  615   HD21  LEU  81          HD21      LEU  81  83.688 -11.575   6.424
  616   HD22  LEU  81          HD22      LEU  81  82.924 -11.214   4.875
  617   HD23  LEU  81          HD23      LEU  81  82.088 -10.833   6.381
  618    H    ALA  82           HN       ALA  82  82.525 -10.989   2.979
  619    HA   ALA  82           HA       ALA  82  85.230 -10.469   2.138
  620    HB1  ALA  82           HB1      ALA  82  85.131 -12.577   1.056
  621    HB2  ALA  82           HB2      ALA  82  83.384 -12.477   0.842
  622    HB3  ALA  82           HB3      ALA  82  84.062 -12.748   2.448
  623    H    GLN  83           HN       GLN  83  82.425 -11.061  -0.013
  624    HA   GLN  83           HA       GLN  83  82.053 -10.246  -2.194
  625    HB2  GLN  83           HB2      GLN  83  81.398  -8.312  -0.712
  626    HB3  GLN  83           HB1      GLN  83  83.021  -7.659  -0.942
  627    HG2  GLN  83           HG2      GLN  83  82.633  -7.671  -3.409
  628    HG3  GLN  83           HG1      GLN  83  80.977  -8.203  -3.116
  629   HE21  GLN  83          HE21      GLN  83  80.398  -6.062  -4.203
  630   HE22  GLN  83          HE22      GLN  83  80.379  -4.659  -3.248
  631    H    TYR  84           HN       TYR  84  83.871 -11.442  -3.116
  632    HA   TYR  84           HA       TYR  84  85.899 -11.614  -4.287
  633    HD1  TYR  84           HD2      TYR  84  86.518 -11.147  -7.107
  634    HD2  TYR  84           HD1      TYR  84  82.893  -9.517  -5.479
  635    HE1  TYR  84           HE2      TYR  84  85.223 -12.188  -8.949
  636    HE2  TYR  84           HE1      TYR  84  81.598 -10.557  -7.320
  637    HH   TYR  84           HH       TYR  84  82.927 -11.656 -10.107
  638    HB2  TYR  84           HB2      TYR  84  85.067  -8.743  -4.711
  639    HB3  TYR  84           HB1      TYR  84  86.561  -9.366  -5.412
  640    H    GLY  85           HN       GLY  85  85.759 -10.482  -1.349
  641    HA2  GLY  85           HA2      GLY  85  87.600 -10.364   0.182
  642    HA3  GLY  85           HA1      GLY  85  88.681 -10.057  -1.178
  643    H    ILE  86           HN       ILE  86  87.775  -7.900  -2.408
  644    HA   ILE  86           HA       ILE  86  87.117  -5.822  -0.391
  645    HB   ILE  86           HB       ILE  86  88.991  -4.407  -1.489
  646   HG12  ILE  86          HG12      ILE  86  90.047  -7.184  -2.096
  647   HG13  ILE  86          HG11      ILE  86  89.366  -6.109  -3.318
  648   HG21  ILE  86          HG21      ILE  86  90.642  -5.265   0.110
  649   HG22  ILE  86          HG22      ILE  86  89.742  -6.775   0.253
  650   HG23  ILE  86          HG23      ILE  86  89.037  -5.269   0.841
  651   HD11  ILE  86          HD11      ILE  86  91.679  -5.348  -1.515
  652   HD12  ILE  86          HD12      ILE  86  91.072  -4.447  -2.905
  653   HD13  ILE  86          HD13      ILE  86  91.879  -5.998  -3.143
  654    H1U  RCY  87           H1U      RCY  87  80.024   0.035  -1.818
  655    H1S  RCY  87           H1S      RCY  87  83.561  -1.612  -2.849
  656    HB1  RCY  87           HB1      RCY  87  85.267  -1.544  -4.103
  657    HB2  RCY  87           HB2      RCY  87  86.965  -1.512  -3.629
  658    HA   RCY  87           HA       RCY  87  85.120  -3.903  -3.782
  659    HN1  RCY  87           HN1      RCY  87  87.365  -3.590  -1.967
  Start of MODEL   27
    1    HA   MET   1           HA       MET   1  47.943  12.723  -2.357
    2    HB2  MET   1           HB2      MET   1  46.932  10.588  -3.445
    3    HB3  MET   1           HB1      MET   1  48.603  10.158  -3.806
    4    HG2  MET   1           HG2      MET   1  47.619  10.883  -1.033
    5    HG3  MET   1           HG1      MET   1  47.753   9.225  -1.621
    6    HE1  MET   1           HE1      MET   1  50.689   9.452   0.834
    7    HE2  MET   1           HE2      MET   1  49.021   8.963   0.540
    8    HE3  MET   1           HE3      MET   1  49.377  10.625   1.005
    9    H    ASN   2           HN       ASN   2  49.938  11.516  -5.079
   10    HA   ASN   2           HA       ASN   2  52.394  11.777  -3.533
   11    HB2  ASN   2           HB2      ASN   2  51.930  10.163  -5.497
   12    HB3  ASN   2           HB1      ASN   2  52.232  11.552  -6.541
   13   HD21  ASN   2          HD21      ASN   2  54.320  11.157  -7.355
   14   HD22  ASN   2          HD22      ASN   2  55.678  10.841  -6.388
   15    H    LEU   3           HN       LEU   3  54.028  12.942  -5.629
   16    HA   LEU   3           HA       LEU   3  53.004  15.734  -5.788
   17    HG   LEU   3           HG       LEU   3  55.449  17.463  -3.877
   18    HB2  LEU   3           HB2      LEU   3  54.858  14.963  -3.883
   19    HB3  LEU   3           HB1      LEU   3  55.892  15.522  -5.193
   20   HD11  LEU   3          HD11      LEU   3  54.820  17.394  -6.493
   21   HD12  LEU   3          HD12      LEU   3  54.656  18.858  -5.524
   22   HD13  LEU   3          HD13      LEU   3  53.245  17.850  -5.844
   23   HD21  LEU   3          HD21      LEU   3  52.897  18.044  -3.548
   24   HD22  LEU   3          HD22      LEU   3  53.686  16.914  -2.448
   25   HD23  LEU   3          HD23      LEU   3  52.678  16.307  -3.762
   26    H    GLU   4           HN       GLU   4  56.058  14.027  -6.560
   27    HA   GLU   4           HA       GLU   4  56.130  15.327  -9.182
   28    HB2  GLU   4           HB2      GLU   4  58.172  14.812  -7.757
   29    HB3  GLU   4           HB1      GLU   4  57.929  13.115  -8.168
   30    HG2  GLU   4           HG2      GLU   4  59.505  13.980  -9.757
   31    HG3  GLU   4           HG1      GLU   4  57.970  13.816 -10.611
   32    HA   PRO   5           HA       PRO   5  53.556  12.345 -11.309
   33    HB2  PRO   5           HB2      PRO   5  55.664  12.750 -13.409
   34    HB3  PRO   5           HB1      PRO   5  53.897  12.731 -13.580
   35    HG2  PRO   5           HG2      PRO   5  55.284  15.015 -13.520
   36    HG3  PRO   5           HG1      PRO   5  53.666  14.882 -12.813
   37    HD2  PRO   5           HD2      PRO   5  56.279  15.164 -11.448
   38    HD3  PRO   5           HD1      PRO   5  54.647  15.524 -10.843
   39    HA   PRO   6           HA       PRO   6  56.136   8.729 -10.477
   40    HB2  PRO   6           HB2      PRO   6  54.215   6.827 -10.737
   41    HB3  PRO   6           HB1      PRO   6  54.304   7.899  -9.326
   42    HG2  PRO   6           HG2      PRO   6  52.515   8.053 -11.698
   43    HG3  PRO   6           HG1      PRO   6  52.161   8.376  -9.993
   44    HD2  PRO   6           HD2      PRO   6  52.651  10.351 -11.867
   45    HD3  PRO   6           HD1      PRO   6  52.906  10.553 -10.120
   46    H    LYS   7           HN       LYS   7  56.942   6.863 -11.679
   47    HA   LYS   7           HA       LYS   7  56.127   6.732 -14.548
   48    HB2  LYS   7           HB2      LYS   7  59.018   6.714 -13.647
   49    HB3  LYS   7           HB1      LYS   7  58.408   6.779 -15.299
   50    HG2  LYS   7           HG2      LYS   7  58.793   9.028 -15.017
   51    HG3  LYS   7           HG1      LYS   7  57.180   8.966 -14.305
   52    HD2  LYS   7           HD2      LYS   7  58.439  10.092 -12.667
   53    HD3  LYS   7           HD1      LYS   7  58.428   8.426 -12.086
   54    HE2  LYS   7           HE2      LYS   7  60.703   9.582 -12.078
   55    HE3  LYS   7           HE1      LYS   7  60.639   8.027 -12.906
   56    HZ1  LYS   7           HZ1      LYS   7  60.605   9.060 -14.988
   57    HZ2  LYS   7           HZ2      LYS   7  61.778   9.920 -14.109
   58    HZ3  LYS   7           HZ3      LYS   7  60.230  10.582 -14.339
   59    H    ALA   8           HN       ALA   8  56.591   4.658 -15.524
   60    HA   ALA   8           HA       ALA   8  56.182   2.409 -13.856
   61    HB1  ALA   8           HB1      ALA   8  55.725   2.255 -16.228
   62    HB2  ALA   8           HB2      ALA   8  56.982   1.077 -15.847
   63    HB3  ALA   8           HB3      ALA   8  57.409   2.603 -16.622
   64    H    GLU   9           HN       GLU   9  57.661   0.765 -13.131
   65    HA   GLU   9           HA       GLU   9  60.549   1.225 -13.434
   66    HB2  GLU   9           HB2      GLU   9  60.796   1.171 -10.864
   67    HB3  GLU   9           HB1      GLU   9  60.281   2.689 -11.595
   68    HG2  GLU   9           HG2      GLU   9  58.030   0.914 -11.000
   69    HG3  GLU   9           HG1      GLU   9  58.949   1.347  -9.559
   70    H1U  RCY  10           H1U      RCY  10  63.835  -4.218  -6.087
   71    H1S  RCY  10           H1S      RCY  10  63.668  -4.015 -10.882
   72    HB1  RCY  10           HB1      RCY  10  60.768  -3.898 -10.144
   73    HB2  RCY  10           HB2      RCY  10  60.851  -2.275  -9.461
   74    HA   RCY  10           HA       RCY  10  59.358  -3.032 -11.992
   75    HN1  RCY  10           HN1      RCY  10  59.112  -0.391 -10.665
   76    H    ARG  11           HN       ARG  11  59.311  -2.393  -8.522
   77    HA   ARG  11           HA       ARG  11  56.620  -3.671  -8.401
   78    HE   ARG  11           HE       ARG  11  60.361  -4.098  -4.739
   79    HB2  ARG  11           HB2      ARG  11  58.573  -3.106  -6.150
   80    HB3  ARG  11           HB1      ARG  11  57.124  -4.109  -6.064
   81    HG2  ARG  11           HG2      ARG  11  58.066  -5.715  -7.611
   82    HG3  ARG  11           HG1      ARG  11  59.454  -4.670  -7.918
   83    HD2  ARG  11           HD2      ARG  11  58.767  -5.794  -5.189
   84    HD3  ARG  11           HD1      ARG  11  59.922  -6.540  -6.295
   85   HH11  ARG  11          HH21      ARG  11  61.188  -6.016  -7.482
   86   HH12  ARG  11          HH22      ARG  11  62.779  -5.349  -7.636
   87   HH21  ARG  11          HH11      ARG  11  62.434  -3.216  -4.924
   88   HH22  ARG  11          HH12      ARG  11  63.484  -3.763  -6.187
   89    H    SER  12           HN       SER  12  55.631  -2.700  -6.052
   90    HA   SER  12           HA       SER  12  55.001   0.091  -6.783
   91    HG   SER  12           HG       SER  12  52.057  -1.610  -6.077
   92    HB2  SER  12           HB2      SER  12  53.868  -1.834  -4.743
   93    HB3  SER  12           HB1      SER  12  53.371  -0.147  -4.830
   94    H    ALA  13           HN       ALA  13  56.967  -1.640  -4.522
   95    HA   ALA  13           HA       ALA  13  58.345  -0.895  -2.775
   96    HB1  ALA  13           HB1      ALA  13  59.037   0.642  -4.709
   97    HB2  ALA  13           HB2      ALA  13  59.388   1.227  -3.082
   98    HB3  ALA  13           HB3      ALA  13  58.002   1.863  -3.967
   99    H    THR  14           HN       THR  14  57.277  -1.006  -0.841
  100    HA   THR  14           HA       THR  14  54.873   0.160  -0.088
  101    HB   THR  14           HB       THR  14  56.159  -1.450   1.310
  102    HG1  THR  14           HG1      THR  14  55.219  -0.697   3.054
  103   HG21  THR  14          HG21      THR  14  58.019  -0.702   2.650
  104   HG22  THR  14          HG22      THR  14  57.802   0.964   2.113
  105   HG23  THR  14          HG23      THR  14  58.361  -0.263   0.976
  106    H    ARG  15           HN       ARG  15  57.877   1.768  -0.645
  107    HA   ARG  15           HA       ARG  15  58.501   4.021  -0.418
  108    HE   ARG  15           HE       ARG  15  57.389   8.440  -1.857
  109    HB2  ARG  15           HB2      ARG  15  56.348   4.161  -1.801
  110    HB3  ARG  15           HB1      ARG  15  55.531   4.580  -0.295
  111    HG2  ARG  15           HG2      ARG  15  56.954   6.522   0.004
  112    HG3  ARG  15           HG1      ARG  15  57.936   6.065  -1.388
  113    HD2  ARG  15           HD2      ARG  15  55.746   6.186  -2.745
  114    HD3  ARG  15           HD1      ARG  15  55.082   7.047  -1.357
  115   HH11  ARG  15          HH21      ARG  15  54.773   7.308  -3.796
  116   HH12  ARG  15          HH22      ARG  15  54.881   8.607  -4.937
  117   HH21  ARG  15          HH11      ARG  15  57.546  10.143  -3.335
  118   HH22  ARG  15          HH12      ARG  15  56.451  10.212  -4.676
  119    H    VAL  16           HN       VAL  16  59.403   3.978   1.669
  120    HA   VAL  16           HA       VAL  16  58.031   5.499   3.699
  121    HB   VAL  16           HB       VAL  16  56.951   3.165   3.840
  122   HG11  VAL  16          HG11      VAL  16  59.467   2.402   5.300
  123   HG12  VAL  16          HG12      VAL  16  59.346   2.132   3.562
  124   HG13  VAL  16          HG13      VAL  16  58.198   1.361   4.656
  125   HG21  VAL  16          HG21      VAL  16  56.838   4.820   5.666
  126   HG22  VAL  16          HG22      VAL  16  58.411   4.283   6.257
  127   HG23  VAL  16          HG23      VAL  16  57.027   3.191   6.317
  128    H    MET  17           HN       MET  17  60.714   3.983   2.344
  129    HA   MET  17           HA       MET  17  62.542   3.856   4.516
  130    HB2  MET  17           HB2      MET  17  63.061   4.511   1.600
  131    HB3  MET  17           HB1      MET  17  64.302   4.070   2.772
  132    HG2  MET  17           HG2      MET  17  63.808   2.025   1.707
  133    HG3  MET  17           HG1      MET  17  62.856   1.956   3.190
  134    HE1  MET  17           HE1      MET  17  62.884   3.169  -0.461
  135    HE2  MET  17           HE2      MET  17  61.493   2.320  -1.132
  136    HE3  MET  17           HE3      MET  17  62.846   1.401  -0.477
  137    H    GLY  18           HN       GLY  18  61.558   6.573   2.453
  138    HA2  GLY  18           HA2      GLY  18  62.075   8.550   4.404
  139    HA3  GLY  18           HA1      GLY  18  63.525   8.427   3.407
  140    H    GLY  19           HN       GLY  19  60.084   8.130   2.488
  141    HA2  GLY  19           HA2      GLY  19  58.877   9.264   0.823
  142    HA3  GLY  19           HA1      GLY  19  59.768  10.695   1.342
  143    HA   PRO  20           HA       PRO  20  60.776   9.975  -3.159
  144    HB2  PRO  20           HB2      PRO  20  61.600  12.810  -2.639
  145    HB3  PRO  20           HB1      PRO  20  60.747  12.122  -4.036
  146    HG2  PRO  20           HG2      PRO  20  59.456  13.514  -2.175
  147    HG3  PRO  20           HG1      PRO  20  58.716  12.104  -2.952
  148    HD2  PRO  20           HD2      PRO  20  59.806  12.370  -0.188
  149    HD3  PRO  20           HD1      PRO  20  58.504  11.321  -0.794
  150    H1U  RCY  21           H1U      RCY  21  64.688   4.917   1.307
  151    H1S  RCY  21           H1S      RCY  21  67.391   7.142  -1.583
  152    HB1  RCY  21           HB1      RCY  21  65.271   8.955  -5.155
  153    HB2  RCY  21           HB2      RCY  21  64.465   7.840  -4.052
  154    HA   RCY  21           HA       RCY  21  65.084   9.579  -2.212
  155    HN1  RCY  21           HN1      RCY  21  62.849   9.742  -4.130
  156    H    THR  22           HN       THR  22  65.751  11.720  -1.839
  157    HA   THR  22           HA       THR  22  66.174  13.550  -4.081
  158    HB   THR  22           HB       THR  22  65.588  14.743  -2.171
  159    HG1  THR  22           HG1      THR  22  68.390  14.615  -1.815
  160   HG21  THR  22          HG21      THR  22  65.540  13.014  -0.546
  161   HG22  THR  22          HG22      THR  22  66.696  14.190   0.080
  162   HG23  THR  22          HG23      THR  22  67.271  12.716  -0.698
  163    HA   PRO  23           HA       PRO  23  70.287  12.666  -5.424
  164    HB2  PRO  23           HB2      PRO  23  70.905  15.434  -4.420
  165    HB3  PRO  23           HB1      PRO  23  71.362  14.669  -5.956
  166    HG2  PRO  23           HG2      PRO  23  69.329  16.380  -5.809
  167    HG3  PRO  23           HG1      PRO  23  69.273  14.967  -6.875
  168    HD2  PRO  23           HD2      PRO  23  67.772  15.475  -4.370
  169    HD3  PRO  23           HD1      PRO  23  67.385  14.378  -5.712
  170    H    ARG  24           HN       ARG  24  72.209  14.648  -3.690
  171    HA   ARG  24           HA       ARG  24  73.274  12.512  -2.059
  172    HE   ARG  24           HE       ARG  24  73.686  16.821  -0.188
  173    HB2  ARG  24           HB2      ARG  24  74.592  14.572  -1.065
  174    HB3  ARG  24           HB1      ARG  24  74.918  14.034  -2.713
  175    HG2  ARG  24           HG2      ARG  24  73.778  15.821  -3.671
  176    HG3  ARG  24           HG1      ARG  24  72.758  16.063  -2.252
  177    HD2  ARG  24           HD2      ARG  24  75.712  16.473  -1.977
  178    HD3  ARG  24           HD1      ARG  24  74.756  17.726  -2.769
  179   HH11  ARG  24          HH21      ARG  24  75.701  18.993  -1.952
  180   HH12  ARG  24          HH22      ARG  24  75.668  20.224  -0.734
  181   HH21  ARG  24          HH11      ARG  24  73.631  18.417   1.413
  182   HH22  ARG  24          HH12      ARG  24  74.496  19.898   1.171
  183    H    LYS  25           HN       LYS  25  72.947  15.600  -0.506
  184    HA   LYS  25           HA       LYS  25  71.973  16.211   1.528
  185    HB2  LYS  25           HB2      LYS  25  69.885  14.203   0.626
  186    HB3  LYS  25           HB1      LYS  25  69.687  15.322   1.972
  187    HG2  LYS  25           HG2      LYS  25  70.434  16.325  -0.770
  188    HG3  LYS  25           HG1      LYS  25  68.748  16.030  -0.342
  189    HD2  LYS  25           HD2      LYS  25  69.088  17.502   1.678
  190    HD3  LYS  25           HD1      LYS  25  70.679  17.915   1.037
  191    HE2  LYS  25           HE2      LYS  25  67.977  18.486  -0.193
  192    HE3  LYS  25           HE1      LYS  25  69.221  19.644   0.279
  193    HZ1  LYS  25           HZ1      LYS  25  69.736  19.525  -1.892
  194    HZ2  LYS  25           HZ2      LYS  25  69.024  17.996  -2.103
  195    HZ3  LYS  25           HZ3      LYS  25  70.578  18.127  -1.429
  196    H    GLY  26           HN       GLY  26  72.763  15.642   3.461
  197    HA2  GLY  26           HA2      GLY  26  73.332  14.321   5.317
  198    HA3  GLY  26           HA1      GLY  26  72.339  13.032   4.635
  199    HA   PRO  27           HA       PRO  27  76.583  12.587   2.390
  200    HB2  PRO  27           HB2      PRO  27  78.373  14.539   3.681
  201    HB3  PRO  27           HB1      PRO  27  78.023  14.312   1.958
  202    HG2  PRO  27           HG2      PRO  27  77.185  16.454   3.361
  203    HG3  PRO  27           HG1      PRO  27  76.289  15.789   1.984
  204    HD2  PRO  27           HD2      PRO  27  75.739  15.472   4.920
  205    HD3  PRO  27           HD1      PRO  27  74.593  15.667   3.573
  206    HA   PRO  28           HA       PRO  28  78.800  10.005   5.211
  207    HB2  PRO  28           HB2      PRO  28  81.385  11.439   4.765
  208    HB3  PRO  28           HB1      PRO  28  81.011   9.712   4.602
  209    HG2  PRO  28           HG2      PRO  28  81.317  11.278   2.471
  210    HG3  PRO  28           HG1      PRO  28  80.124   9.969   2.496
  211    HD2  PRO  28           HD2      PRO  28  79.685  12.919   2.706
  212    HD3  PRO  28           HD1      PRO  28  78.640  11.669   1.995
  213    H    LYS  29           HN       LYS  29  78.774  10.088   7.416
  214    HA   LYS  29           HA       LYS  29  79.687  12.615   8.748
  215    HB2  LYS  29           HB2      LYS  29  77.358  10.786   9.359
  216    HB3  LYS  29           HB1      LYS  29  78.006  11.899  10.563
  217    HG2  LYS  29           HG2      LYS  29  77.380  12.977   7.842
  218    HG3  LYS  29           HG1      LYS  29  76.035  12.643   8.934
  219    HD2  LYS  29           HD2      LYS  29  77.015  14.075  10.647
  220    HD3  LYS  29           HD1      LYS  29  78.445  14.340   9.649
  221    HE2  LYS  29           HE2      LYS  29  77.188  15.551   8.010
  222    HE3  LYS  29           HE1      LYS  29  75.654  15.059   8.727
  223    HZ1  LYS  29           HZ1      LYS  29  77.482  16.431  10.508
  224    HZ2  LYS  29           HZ2      LYS  29  75.802  16.606  10.325
  225    HZ3  LYS  29           HZ3      LYS  29  76.862  17.379   9.245
  226    H1U  RCY  30           H1U      RCY  30  79.167   7.825   5.048
  227    H1S  RCY  30           H1S      RCY  30  83.334   7.361   7.007
  228    HB1  RCY  30           HB1      RCY  30  83.293   9.280  11.039
  229    HB2  RCY  30           HB2      RCY  30  82.857  10.364   9.719
  230    HA   RCY  30           HA       RCY  30  81.513   7.758   9.552
  231    HN1  RCY  30           HN1      RCY  30  80.296   9.352   8.317
  232    H    LYS  31           HN       LYS  31  79.565   7.298  10.877
  233    HA   LYS  31           HA       LYS  31  79.456   8.568  13.539
  234    HB2  LYS  31           HB2      LYS  31  77.775   6.468  12.152
  235    HB3  LYS  31           HB1      LYS  31  77.532   6.911  13.843
  236    HG2  LYS  31           HG2      LYS  31  77.158   9.249  13.199
  237    HG3  LYS  31           HG1      LYS  31  77.453   8.845  11.507
  238    HD2  LYS  31           HD2      LYS  31  75.482   7.532  11.362
  239    HD3  LYS  31           HD1      LYS  31  75.306   7.459  13.116
  240    HE2  LYS  31           HE2      LYS  31  75.155  10.046  11.552
  241    HE3  LYS  31           HE1      LYS  31  73.735   9.077  11.947
  242    HZ1  LYS  31           HZ1      LYS  31  73.893   9.563  14.143
  243    HZ2  LYS  31           HZ2      LYS  31  74.594  10.981  13.524
  244    HZ3  LYS  31           HZ3      LYS  31  75.581   9.731  14.116
  245    H    GLN  32           HN       GLN  32  81.854   7.133  12.963
  246    HA   GLN  32           HA       GLN  32  83.073   5.171  13.580
  247    HB2  GLN  32           HB2      GLN  32  82.932   5.188  16.266
  248    HB3  GLN  32           HB1      GLN  32  83.795   6.427  15.363
  249    HG2  GLN  32           HG2      GLN  32  82.377   7.583  16.921
  250    HG3  GLN  32           HG1      GLN  32  81.629   7.760  15.333
  251   HE21  GLN  32          HE21      GLN  32  79.557   8.078  16.620
  252   HE22  GLN  32          HE22      GLN  32  78.718   6.701  17.153
  253    H    ARG  33           HN       ARG  33  80.530   4.302  12.730
  254    HA   ARG  33           HA       ARG  33  79.421   2.534  14.789
  255    HE   ARG  33           HE       ARG  33  77.560   3.252  15.928
  256    HB2  ARG  33           HB2      ARG  33  78.119   3.635  12.855
  257    HB3  ARG  33           HB1      ARG  33  78.854   2.412  11.822
  258    HG2  ARG  33           HG2      ARG  33  76.923   1.288  12.426
  259    HG3  ARG  33           HG1      ARG  33  77.981   0.778  13.742
  260    HD2  ARG  33           HD2      ARG  33  76.277   3.263  13.950
  261    HD3  ARG  33           HD1      ARG  33  75.658   1.674  14.400
  262   HH11  ARG  33          HH21      ARG  33  76.510   0.089  15.045
  263   HH12  ARG  33          HH22      ARG  33  77.099  -0.656  16.494
  264   HH21  ARG  33          HH11      ARG  33  78.336   2.298  17.825
  265   HH22  ARG  33          HH12      ARG  33  78.133   0.595  18.068
  266    H    GLN  34           HN       GLN  34  79.197   0.629  12.211
  267    HA   GLN  34           HA       GLN  34  80.190  -1.455  11.746
  268    HB2  GLN  34           HB2      GLN  34  81.610   0.142  10.458
  269    HB3  GLN  34           HB1      GLN  34  82.690   0.262  11.845
  270    HG2  GLN  34           HG2      GLN  34  82.130  -2.513  11.095
  271    HG3  GLN  34           HG1      GLN  34  82.903  -1.602   9.798
  272   HE21  GLN  34          HE21      GLN  34  84.754  -0.026  10.875
  273   HE22  GLN  34          HE22      GLN  34  85.820  -0.856  11.903
  274    H    THR  35           HN       THR  35  79.581  -1.632  14.291
  275    HA   THR  35           HA       THR  35  81.542  -1.683  16.290
  276    HB   THR  35           HB       THR  35  79.420  -3.820  15.961
  277    HG1  THR  35           HG1      THR  35  79.020  -1.426  17.355
  278   HG21  THR  35          HG21      THR  35  79.443  -3.797  18.413
  279   HG22  THR  35          HG22      THR  35  80.653  -2.514  18.404
  280   HG23  THR  35          HG23      THR  35  81.062  -4.117  17.794
  281    H    ARG  36           HN       ARG  36  80.707  -4.290  13.996
  282    HA   ARG  36           HA       ARG  36  83.467  -5.185  13.899
  283    HE   ARG  36           HE       ARG  36  85.679  -7.738  17.950
  284    HB2  ARG  36           HB2      ARG  36  81.708  -6.329  15.894
  285    HB3  ARG  36           HB1      ARG  36  82.152  -7.570  14.724
  286    HG2  ARG  36           HG2      ARG  36  84.505  -7.158  15.072
  287    HG3  ARG  36           HG1      ARG  36  84.162  -5.737  16.060
  288    HD2  ARG  36           HD2      ARG  36  83.414  -7.009  17.869
  289    HD3  ARG  36           HD1      ARG  36  83.030  -8.403  16.859
  290   HH11  ARG  36          HH21      ARG  36  83.760  -9.482  15.678
  291   HH12  ARG  36          HH22      ARG  36  84.952 -10.710  15.412
  292   HH21  ARG  36          HH11      ARG  36  87.247  -9.332  17.616
  293   HH22  ARG  36          HH12      ARG  36  86.926 -10.625  16.510
  294    H    GLN  37           HN       GLN  37  82.661  -4.599  11.671
  295    HA   GLN  37           HA       GLN  37  81.772  -5.179   9.568
  296    HB2  GLN  37           HB2      GLN  37  82.659  -7.854  10.683
  297    HB3  GLN  37           HB1      GLN  37  82.151  -7.620   9.009
  298    HG2  GLN  37           HG2      GLN  37  84.570  -7.441   9.108
  299    HG3  GLN  37           HG1      GLN  37  83.904  -5.839   8.787
  300   HE21  GLN  37          HE21      GLN  37  84.095  -4.217  10.454
  301   HE22  GLN  37          HE22      GLN  37  85.021  -4.462  11.855
  302    H1U  RCY  38           H1U      RCY  38  77.482  -2.935   5.196
  303    H1S  RCY  38           H1S      RCY  38  78.952  -7.553   5.488
  304    HB1  RCY  38           HB1      RCY  38  77.562  -6.941   8.888
  305    HB2  RCY  38           HB2      RCY  38  76.993  -8.610   8.927
  306    HA   RCY  38           HA       RCY  38  78.082  -7.661  11.078
  307    HN1  RCY  38           HN1      RCY  38  80.718  -8.293   9.921
  308    H    LYS  39           HN       LYS  39  77.779  -9.383  12.389
  309    HA   LYS  39           HA       LYS  39  79.004 -11.981  11.747
  310    HB2  LYS  39           HB2      LYS  39  77.145 -11.572  14.071
  311    HB3  LYS  39           HB1      LYS  39  78.601 -12.560  13.965
  312    HG2  LYS  39           HG2      LYS  39  79.462 -10.808  15.188
  313    HG3  LYS  39           HG1      LYS  39  79.727 -10.158  13.570
  314    HD2  LYS  39           HD2      LYS  39  78.587  -8.366  14.430
  315    HD3  LYS  39           HD1      LYS  39  77.186  -9.333  13.968
  316    HE2  LYS  39           HE2      LYS  39  76.715  -8.797  16.203
  317    HE3  LYS  39           HE1      LYS  39  77.445 -10.397  16.338
  318    HZ1  LYS  39           HZ1      LYS  39  78.974  -9.509  17.646
  319    HZ2  LYS  39           HZ2      LYS  39  78.344  -7.949  17.411
  320    HZ3  LYS  39           HZ3      LYS  39  79.522  -8.561  16.351
  321    H    SER  40           HN       SER  40  77.228 -11.486   9.774
  322    HA   SER  40           HA       SER  40  75.140 -13.522  10.285
  323    HG   SER  40           HG       SER  40  73.141 -13.114   9.159
  324    HB2  SER  40           HB2      SER  40  73.945 -11.481  10.804
  325    HB3  SER  40           HB1      SER  40  74.561 -10.696   9.353
  326    H    LYS  41           HN       LYS  41  76.650 -14.659   8.815
  327    HA   LYS  41           HA       LYS  41  76.224 -13.856   5.959
  328    HB2  LYS  41           HB2      LYS  41  78.481 -15.296   5.764
  329    HB3  LYS  41           HB1      LYS  41  78.508 -13.563   6.088
  330    HG2  LYS  41           HG2      LYS  41  78.782 -13.915   8.442
  331    HG3  LYS  41           HG1      LYS  41  78.433 -15.638   8.290
  332    HD2  LYS  41           HD2      LYS  41  80.495 -16.079   7.216
  333    HD3  LYS  41           HD1      LYS  41  80.761 -14.376   6.841
  334    HE2  LYS  41           HE2      LYS  41  81.012 -13.885   9.250
  335    HE3  LYS  41           HE1      LYS  41  80.760 -15.591   9.621
  336    HZ1  LYS  41           HZ1      LYS  41  82.984 -14.417   8.045
  337    HZ2  LYS  41           HZ2      LYS  41  82.702 -16.086   8.196
  338    HZ3  LYS  41           HZ3      LYS  41  83.091 -15.160   9.566
  339    HA   PRO  42           HA       PRO  42  74.571 -18.117   6.556
  340    HB2  PRO  42           HB2      PRO  42  72.129 -17.711   5.457
  341    HB3  PRO  42           HB1      PRO  42  72.497 -17.243   7.129
  342    HG2  PRO  42           HG2      PRO  42  72.274 -15.555   4.701
  343    HG3  PRO  42           HG1      PRO  42  71.829 -15.194   6.376
  344    HD2  PRO  42           HD2      PRO  42  74.181 -14.347   5.101
  345    HD3  PRO  42           HD1      PRO  42  73.903 -14.359   6.856
  346    HA   PRO  43           HA       PRO  43  75.488 -19.643   2.506
  347    HB2  PRO  43           HB2      PRO  43  73.471 -21.551   2.176
  348    HB3  PRO  43           HB1      PRO  43  74.993 -21.812   3.048
  349    HG2  PRO  43           HG2      PRO  43  72.291 -21.194   4.108
  350    HG3  PRO  43           HG1      PRO  43  73.561 -22.236   4.775
  351    HD2  PRO  43           HD2      PRO  43  73.063 -19.765   5.781
  352    HD3  PRO  43           HD1      PRO  43  74.703 -20.454   5.748
  353    H    LYS  44           HN       LYS  44  75.086 -18.574   0.621
  354    HA   LYS  44           HA       LYS  44  72.321 -18.376  -0.388
  355    HB2  LYS  44           HB2      LYS  44  73.453 -16.233   1.050
  356    HB3  LYS  44           HB1      LYS  44  73.612 -15.773  -0.641
  357    HG2  LYS  44           HG2      LYS  44  71.461 -14.986   0.009
  358    HG3  LYS  44           HG1      LYS  44  71.150 -16.467  -0.897
  359    HD2  LYS  44           HD2      LYS  44  70.657 -17.700   1.032
  360    HD3  LYS  44           HD1      LYS  44  71.525 -16.582   2.085
  361    HE2  LYS  44           HE2      LYS  44  69.112 -15.646   0.550
  362    HE3  LYS  44           HE1      LYS  44  68.913 -16.518   2.070
  363    HZ1  LYS  44           HZ1      LYS  44  70.832 -14.719   2.664
  364    HZ2  LYS  44           HZ2      LYS  44  69.178 -14.523   2.999
  365    HZ3  LYS  44           HZ3      LYS  44  69.851 -13.837   1.598
  366    H    LYS  45           HN       LYS  45  75.755 -17.574  -0.860
  367    HA   LYS  45           HA       LYS  45  75.458 -18.398  -3.710
  368    HB2  LYS  45           HB2      LYS  45  75.403 -15.858  -3.444
  369    HB3  LYS  45           HB1      LYS  45  77.070 -15.974  -2.882
  370    HG2  LYS  45           HG2      LYS  45  77.768 -16.984  -4.973
  371    HG3  LYS  45           HG1      LYS  45  76.097 -17.080  -5.531
  372    HD2  LYS  45           HD2      LYS  45  77.176 -14.406  -4.724
  373    HD3  LYS  45           HD1      LYS  45  77.660 -15.071  -6.284
  374    HE2  LYS  45           HE2      LYS  45  75.471 -15.075  -7.110
  375    HE3  LYS  45           HE1      LYS  45  74.758 -15.070  -5.497
  376    HZ1  LYS  45           HZ1      LYS  45  76.349 -12.781  -5.783
  377    HZ2  LYS  45           HZ2      LYS  45  74.666 -12.877  -5.571
  378    HZ3  LYS  45           HZ3      LYS  45  75.329 -12.882  -7.135
  379    H    GLY  46           HN       GLY  46  78.190 -16.971  -1.921
  380    HA2  GLY  46           HA2      GLY  46  79.720 -18.832  -0.880
  381    HA3  GLY  46           HA1      GLY  46  79.746 -19.438  -2.537
  382    H    VAL  47           HN       VAL  47  81.393 -18.709  -3.778
  383    HA   VAL  47           HA       VAL  47  82.737 -16.150  -2.977
  384    HB   VAL  47           HB       VAL  47  84.788 -17.108  -3.980
  385   HG11  VAL  47          HG11      VAL  47  84.590 -17.453  -1.630
  386   HG12  VAL  47          HG12      VAL  47  85.039 -19.024  -2.294
  387   HG13  VAL  47          HG13      VAL  47  83.364 -18.703  -1.843
  388   HG21  VAL  47          HG21      VAL  47  83.002 -19.527  -4.381
  389   HG22  VAL  47          HG22      VAL  47  84.758 -19.556  -4.543
  390   HG23  VAL  47          HG23      VAL  47  83.787 -18.576  -5.642
  391    H    GLN  48           HN       GLN  48  81.470 -18.092  -5.626
  392    HA   GLN  48           HA       GLN  48  80.906 -17.491  -7.819
  393    HB2  GLN  48           HB2      GLN  48  79.955 -15.488  -6.427
  394    HB3  GLN  48           HB1      GLN  48  81.327 -14.598  -7.087
  395    HG2  GLN  48           HG2      GLN  48  80.616 -15.208  -9.376
  396    HG3  GLN  48           HG1      GLN  48  79.231 -16.074  -8.709
  397   HE21  GLN  48          HE21      GLN  48  79.917 -13.349  -6.796
  398   HE22  GLN  48          HE22      GLN  48  78.779 -12.285  -7.469
  399    H    GLY  49           HN       GLY  49  83.182 -14.856  -6.977
  400    HA2  GLY  49           HA2      GLY  49  85.411 -16.043  -8.359
  401    HA3  GLY  49           HA1      GLY  49  84.593 -14.886  -9.409
  402    H1U  RCY  50           H1U      RCY  50  83.299  -5.600  -6.266
  403    H1S  RCY  50           H1S      RCY  50  81.474  -9.386  -5.675
  404    HB1  RCY  50           HB1      RCY  50  84.386 -10.313  -7.578
  405    HB2  RCY  50           HB2      RCY  50  84.902  -9.878  -5.949
  406    HA   RCY  50           HA       RCY  50  86.349 -11.624  -7.046
  407    HN1  RCY  50           HN1      RCY  50  83.807 -13.040  -7.342
  408    H    GLY  51           HN       GLY  51  87.643 -12.603  -5.511
  409    HA2  GLY  51           HA2      GLY  51  86.446 -13.214  -2.851
  410    HA3  GLY  51           HA1      GLY  51  87.990 -13.837  -3.433
  411    H    ASP  52           HN       ASP  52  89.835 -12.443  -3.386
  412    HA   ASP  52           HA       ASP  52  91.190 -10.801  -2.399
  413    HB2  ASP  52           HB2      ASP  52  89.662  -9.421  -3.942
  414    HB3  ASP  52           HB1      ASP  52  88.748  -9.021  -2.487
  415    H    ASP  53           HN       ASP  53  91.614 -11.395  -0.302
  416    HA   ASP  53           HA       ASP  53  91.390 -11.527   2.030
  417    HB2  ASP  53           HB2      ASP  53  91.228  -9.023   1.660
  418    HB3  ASP  53           HB1      ASP  53  89.473  -9.206   1.696
  419    H    ILE  54           HN       ILE  54  89.789 -12.024   3.775
  420    HA   ILE  54           HA       ILE  54  87.185 -13.016   2.673
  421    HB   ILE  54           HB       ILE  54  89.000 -14.401   4.675
  422   HG12  ILE  54          HG12      ILE  54  89.762 -14.577   2.328
  423   HG13  ILE  54          HG11      ILE  54  89.171 -16.131   2.919
  424   HG21  ILE  54          HG21      ILE  54  86.192 -14.909   3.718
  425   HG22  ILE  54          HG22      ILE  54  86.828 -14.962   5.362
  426   HG23  ILE  54          HG23      ILE  54  87.212 -16.255   4.226
  427   HD11  ILE  54          HD11      ILE  54  87.980 -14.294   0.894
  428   HD12  ILE  54          HD12      ILE  54  86.865 -15.175   1.939
  429   HD13  ILE  54          HD13      ILE  54  88.012 -16.057   0.931
  430    HA   PRO  55           HA       PRO  55  86.414 -10.452   6.431
  431    HB2  PRO  55           HB2      PRO  55  84.763  -8.626   5.322
  432    HB3  PRO  55           HB1      PRO  55  86.526  -8.508   5.159
  433    HG2  PRO  55           HG2      PRO  55  84.505  -9.401   3.183
  434    HG3  PRO  55           HG1      PRO  55  86.019  -8.519   2.934
  435    HD2  PRO  55           HD2      PRO  55  85.645 -11.281   2.541
  436    HD3  PRO  55           HD1      PRO  55  87.210 -10.450   2.658
  437    H    GLY  56           HN       GLY  56  84.417 -12.122   4.158
  438    HA2  GLY  56           HA2      GLY  56  82.666 -13.252   6.034
  439    HA3  GLY  56           HA1      GLY  56  81.871 -11.783   5.464
  440    H    MET  57           HN       MET  57  83.677 -14.535   4.057
  441    HA   MET  57           HA       MET  57  83.430 -15.443   1.870
  442    HB2  MET  57           HB2      MET  57  81.031 -16.513   1.795
  443    HB3  MET  57           HB1      MET  57  82.188 -17.055   3.008
  444    HG2  MET  57           HG2      MET  57  81.201 -15.524   4.662
  445    HG3  MET  57           HG1      MET  57  80.061 -14.937   3.451
  446    HE1  MET  57           HE1      MET  57  78.514 -16.158   2.238
  447    HE2  MET  57           HE2      MET  57  77.531 -15.906   3.678
  448    HE3  MET  57           HE3      MET  57  77.524 -17.476   2.878
  449    H    GLU  58           HN       GLU  58  80.075 -15.002   1.554
  450    HA   GLU  58           HA       GLU  58  80.049 -12.393   0.339
  451    HB2  GLU  58           HB2      GLU  58  81.404 -14.030  -1.268
  452    HB3  GLU  58           HB1      GLU  58  79.784 -14.526  -1.752
  453    HG2  GLU  58           HG2      GLU  58  80.933 -11.723  -1.833
  454    HG3  GLU  58           HG1      GLU  58  80.465 -12.721  -3.210
  455    H    GLY  59           HN       GLY  59  78.340 -13.489   2.144
  456    HA2  GLY  59           HA2      GLY  59  75.933 -14.307   0.572
  457    HA3  GLY  59           HA1      GLY  59  76.159 -14.628   2.293
  458    H1U  RCY  60           H1U      RCY  60  78.490  -7.516   4.669
  459    H1S  RCY  60           H1S      RCY  60  73.656  -7.465   4.172
  460    HB1  RCY  60           HB1      RCY  60  73.352 -11.573   4.426
  461    HB2  RCY  60           HB2      RCY  60  73.290 -11.639   2.665
  462    HA   RCY  60           HA       RCY  60  75.367 -10.098   2.727
  463    HN1  RCY  60           HN1      RCY  60  76.320 -12.639   3.702
  464    H    GLY  61           HN       GLY  61  74.090  -9.251   5.151
  465    HA2  GLY  61           HA2      GLY  61  75.754 -10.001   7.417
  466    HA3  GLY  61           HA1      GLY  61  76.202  -8.434   6.742
  467    H    THR  62           HN       THR  62  72.983  -8.778   6.111
  468    HA   THR  62           HA       THR  62  71.122  -7.640   6.995
  469    HB   THR  62           HB       THR  62  70.773  -8.125   9.482
  470    HG1  THR  62           HG1      THR  62  72.462 -10.048   9.782
  471   HG21  THR  62          HG21      THR  62  70.476 -10.579   9.071
  472   HG22  THR  62          HG22      THR  62  71.352 -10.388   7.552
  473   HG23  THR  62          HG23      THR  62  69.808  -9.570   7.787
  474    H    ASP  63           HN       ASP  63  74.104  -6.487   7.346
  475    HA   ASP  63           HA       ASP  63  73.819  -4.588   9.504
  476    HB2  ASP  63           HB2      ASP  63  75.706  -3.393   8.269
  477    HB3  ASP  63           HB1      ASP  63  76.047  -5.058   8.741
  478    H    ILE  64           HN       ILE  64  72.286  -4.889   6.546
  479    HA   ILE  64           HA       ILE  64  71.587  -1.976   6.526
  480    HB   ILE  64           HB       ILE  64  72.920  -2.617   4.529
  481   HG12  ILE  64          HG12      ILE  64  70.006  -1.898   4.245
  482   HG13  ILE  64          HG11      ILE  64  71.420  -0.857   4.077
  483   HG21  ILE  64          HG21      ILE  64  72.363  -4.385   3.143
  484   HG22  ILE  64          HG22      ILE  64  70.653  -4.315   3.566
  485   HG23  ILE  64          HG23      ILE  64  71.810  -5.032   4.687
  486   HD11  ILE  64          HD11      ILE  64  70.869  -1.188   1.844
  487   HD12  ILE  64          HD12      ILE  64  70.273  -2.824   2.127
  488   HD13  ILE  64          HD13      ILE  64  72.008  -2.510   2.097
  489    H    THR  65           HN       THR  65  69.971  -3.195   8.160
  490    HA   THR  65           HA       THR  65  67.905  -4.865   7.288
  491    HB   THR  65           HB       THR  65  66.404  -3.595   8.853
  492    HG1  THR  65           HG1      THR  65  68.677  -1.929   9.157
  493   HG21  THR  65          HG21      THR  65  67.827  -3.926  10.885
  494   HG22  THR  65          HG22      THR  65  69.217  -4.167   9.826
  495   HG23  THR  65          HG23      THR  65  67.866  -5.301   9.781
  496    H    VAL  66           HN       VAL  66  68.505  -1.479   6.681
  497    HA   VAL  66           HA       VAL  66  67.004  -1.522   4.194
  498    HB   VAL  66           HB       VAL  66  66.084   0.458   6.302
  499   HG11  VAL  66          HG11      VAL  66  65.911   0.867   3.742
  500   HG12  VAL  66          HG12      VAL  66  64.461   1.103   4.719
  501   HG13  VAL  66          HG13      VAL  66  64.660  -0.375   3.779
  502   HG21  VAL  66          HG21      VAL  66  63.990  -0.924   6.375
  503   HG22  VAL  66          HG22      VAL  66  65.394  -1.758   7.042
  504   HG23  VAL  66          HG23      VAL  66  64.819  -2.157   5.423
  505    H    ILE  67           HN       ILE  67  68.336   0.637   6.695
  506    HA   ILE  67           HA       ILE  67  70.115   1.850   4.642
  507    HB   ILE  67           HB       ILE  67  68.475   3.434   6.647
  508   HG12  ILE  67          HG12      ILE  67  68.264   3.264   3.623
  509   HG13  ILE  67          HG11      ILE  67  67.130   2.532   4.760
  510   HG21  ILE  67          HG21      ILE  67  70.705   4.390   6.149
  511   HG22  ILE  67          HG22      ILE  67  69.414   5.386   5.477
  512   HG23  ILE  67          HG23      ILE  67  70.343   4.318   4.425
  513   HD11  ILE  67          HD11      ILE  67  66.895   4.918   5.744
  514   HD12  ILE  67          HD12      ILE  67  66.108   4.585   4.201
  515   HD13  ILE  67          HD13      ILE  67  67.639   5.458   4.238
  516    H1U  RCY  68           H1U      RCY  68  70.611   2.680   1.090
  517    H1S  RCY  68           H1S      RCY  68  71.560   0.525   5.152
  518    HB1  RCY  68           HB1      RCY  68  74.208  -0.295   7.862
  519    HB2  RCY  68           HB2      RCY  68  74.941   0.987   6.901
  520    HA   RCY  68           HA       RCY  68  72.461   1.026   8.408
  521    HN1  RCY  68           HN1      RCY  68  72.070   1.114   5.520
  522    HA   PRO  69           HA       PRO  69  73.432   5.279   9.258
  523    HB2  PRO  69           HB2      PRO  69  75.785   4.050  10.660
  524    HB3  PRO  69           HB1      PRO  69  74.658   5.294  11.235
  525    HG2  PRO  69           HG2      PRO  69  74.472   2.728  11.997
  526    HG3  PRO  69           HG1      PRO  69  73.053   3.768  11.803
  527    HD2  PRO  69           HD2      PRO  69  73.916   1.481  10.149
  528    HD3  PRO  69           HD1      PRO  69  72.320   2.254  10.254
  529    H    TRP  70           HN       TRP  70  76.466   3.402   8.805
  530    HA   TRP  70           HA       TRP  70  77.763   5.624   7.484
  531    HD1  TRP  70           HD1      TRP  70  77.398   2.536   9.871
  532    HE1  TRP  70           HE1      TRP  70  77.033  -0.003   9.631
  533    HE3  TRP  70           HE3      TRP  70  79.588   1.757   5.324
  534    HZ2  TRP  70           HZ2      TRP  70  77.596  -2.094   7.755
  535    HZ3  TRP  70           HZ3      TRP  70  79.660  -0.511   4.336
  536    HH2  TRP  70           HH2      TRP  70  78.669  -2.436   5.542
  537    HB2  TRP  70           HB2      TRP  70  79.441   3.755   6.820
  538    HB3  TRP  70           HB1      TRP  70  79.263   4.140   8.530
  539    H    GLU  71           HN       GLU  71  75.561   5.594   6.086
  540    HA   GLU  71           HA       GLU  71  76.404   4.641   3.425
  541    HB2  GLU  71           HB2      GLU  71  74.622   3.205   3.028
  542    HB3  GLU  71           HB1      GLU  71  74.878   2.912   4.745
  543    HG2  GLU  71           HG2      GLU  71  72.581   3.312   4.703
  544    HG3  GLU  71           HG1      GLU  71  73.202   4.930   5.036
  545    H    ALA  72           HN       ALA  72  75.002   6.878   5.463
  546    HA   ALA  72           HA       ALA  72  72.988   8.105   3.913
  547    HB1  ALA  72           HB1      ALA  72  73.315  10.033   5.280
  548    HB2  ALA  72           HB2      ALA  72  75.007   9.630   5.569
  549    HB3  ALA  72           HB3      ALA  72  73.732   8.660   6.303
  550    H1U  RCY  73           H1U      RCY  73  72.279   4.297  -0.688
  551    H1S  RCY  73           H1S      RCY  73  75.847   6.355   1.748
  552    HB1  RCY  73           HB1      RCY  73  78.444   8.293   2.381
  553    HB2  RCY  73           HB2      RCY  73  78.635   8.980   0.768
  554    HA   RCY  73           HA       RCY  73  76.759  10.110   1.701
  555    HN1  RCY  73           HN1      RCY  73  76.217   7.646   3.100
  556    H    ASN  74           HN       ASN  74  74.118   9.283   1.099
  557    HA   ASN  74           HA       ASN  74  73.676   7.788  -1.207
  558    HB2  ASN  74           HB2      ASN  74  72.396  10.394  -0.340
  559    HB3  ASN  74           HB1      ASN  74  71.790   9.412  -1.675
  560   HD21  ASN  74          HD21      ASN  74  71.823   6.852  -0.838
  561   HD22  ASN  74          HD22      ASN  74  70.979   6.641   0.619
  562    H    HIS  75           HN       HIS  75  75.608  10.574  -0.920
  563    HA   HIS  75           HA       HIS  75  75.315  11.861  -3.407
  564    HD1  HIS  75           HD1      HIS  75  79.851  12.850  -2.536
  565    HD2  HIS  75           HD2      HIS  75  76.624  12.877  -5.179
  566    HE1  HIS  75           HE1      HIS  75  80.693  13.898  -4.683
  567    HE2  HIS  75           HE2      HIS  75  78.738  13.921  -6.300
  568    HB2  HIS  75           HB2      HIS  75  76.794  12.756  -1.696
  569    HB3  HIS  75           HB1      HIS  75  77.830  11.333  -1.798
  570    H1U  RCY  76           H1U      RCY  76  78.994   0.654  -5.532
  571    H1S  RCY  76           H1S      RCY  76  77.321   4.712  -5.537
  572    HB1  RCY  76           HB1      RCY  76  77.042   6.924  -5.984
  573    HB2  RCY  76           HB2      RCY  76  75.860   7.888  -5.098
  574    HA   RCY  76           HA       RCY  76  78.680   7.697  -4.075
  575    HN1  RCY  76           HN1      RCY  76  77.582   9.192  -2.627
  576    H    GLU  77           HN       GLU  77  80.146   9.461  -4.764
  577    HA   GLU  77           HA       GLU  77  79.743  11.209  -6.921
  578    HB2  GLU  77           HB2      GLU  77  82.216  11.115  -7.233
  579    HB3  GLU  77           HB1      GLU  77  81.759  11.299  -5.539
  580    HG2  GLU  77           HG2      GLU  77  81.922   8.776  -5.329
  581    HG3  GLU  77           HG1      GLU  77  82.643   8.765  -6.939
  582    H    LEU  78           HN       LEU  78  80.972  10.915  -9.123
  583    HA   LEU  78           HA       LEU  78  79.663   8.866 -10.604
  584    HG   LEU  78           HG       LEU  78  79.206  10.459 -12.287
  585    HB2  LEU  78           HB2      LEU  78  82.033  10.643 -11.196
  586    HB3  LEU  78           HB1      LEU  78  81.467   9.448 -12.364
  587   HD11  LEU  78          HD11      LEU  78  79.163  12.810 -11.191
  588   HD12  LEU  78          HD12      LEU  78  80.577  12.260 -10.292
  589   HD13  LEU  78          HD13      LEU  78  79.042  11.406 -10.130
  590   HD21  LEU  78          HD21      LEU  78  81.288  12.601 -12.785
  591   HD22  LEU  78          HD22      LEU  78  79.736  12.397 -13.598
  592   HD23  LEU  78          HD23      LEU  78  81.039  11.242 -13.881
  593    H    HIS  79           HN       HIS  79  80.565   6.949 -11.590
  594    HA   HIS  79           HA       HIS  79  82.626   5.665  -9.886
  595    HD1  HIS  79           HD1      HIS  79  78.854   5.835 -10.981
  596    HD2  HIS  79           HD2      HIS  79  80.953   3.907 -14.027
  597    HE1  HIS  79           HE1      HIS  79  77.447   6.063 -13.075
  598    HE2  HIS  79           HE2      HIS  79  78.714   4.893 -14.936
  599    HB2  HIS  79           HB2      HIS  79  81.927   3.648 -11.417
  600    HB3  HIS  79           HB1      HIS  79  80.816   4.204 -10.165
  601    H    GLU  80           HN       GLU  80  83.091   7.734 -12.130
  602    HA   GLU  80           HA       GLU  80  84.463   6.315 -14.248
  603    HB2  GLU  80           HB2      GLU  80  85.287   8.512 -14.909
  604    HB3  GLU  80           HB1      GLU  80  83.586   8.651 -14.462
  605    HG2  GLU  80           HG2      GLU  80  84.383   9.292 -12.127
  606    HG3  GLU  80           HG1      GLU  80  86.000   9.438 -12.817
  607    H    LEU  81           HN       LEU  81  85.196   6.471 -11.061
  608    HA   LEU  81           HA       LEU  81  88.127   6.804 -11.428
  609    HG   LEU  81           HG       LEU  81  85.867   8.396 -10.050
  610    HB2  LEU  81           HB2      LEU  81  86.568   6.298  -8.877
  611    HB3  LEU  81           HB1      LEU  81  88.245   6.830  -9.006
  612   HD11  LEU  81          HD11      LEU  81  87.526   8.735  -7.533
  613   HD12  LEU  81          HD12      LEU  81  85.815   8.316  -7.609
  614   HD13  LEU  81          HD13      LEU  81  86.356   9.912  -8.128
  615   HD21  LEU  81          HD21      LEU  81  87.721  10.220  -9.979
  616   HD22  LEU  81          HD22      LEU  81  87.759   9.052 -11.299
  617   HD23  LEU  81          HD23      LEU  81  88.845   8.862  -9.922
  618    H    ALA  82           HN       ALA  82  86.167   4.396 -12.096
  619    HA   ALA  82           HA       ALA  82  87.083   2.197 -10.493
  620    HB1  ALA  82           HB1      ALA  82  86.156   0.779 -12.267
  621    HB2  ALA  82           HB2      ALA  82  86.067   2.167 -13.351
  622    HB3  ALA  82           HB3      ALA  82  85.048   2.104 -11.913
  623    H    GLN  83           HN       GLN  83  88.785   0.749 -10.840
  624    HA   GLN  83           HA       GLN  83  90.476   0.943 -13.219
  625    HB2  GLN  83           HB2      GLN  83  91.144   2.873 -11.634
  626    HB3  GLN  83           HB1      GLN  83  91.780   1.614 -10.577
  627    HG2  GLN  83           HG2      GLN  83  93.123   0.759 -12.534
  628    HG3  GLN  83           HG1      GLN  83  92.607   2.184 -13.436
  629   HE21  GLN  83          HE21      GLN  83  95.384   1.526 -12.583
  630   HE22  GLN  83          HE22      GLN  83  95.885   2.809 -11.591
  631    H    TYR  84           HN       TYR  84  89.042  -1.213 -12.148
  632    HA   TYR  84           HA       TYR  84  89.296  -3.408 -11.337
  633    HD1  TYR  84           HD2      TYR  84  89.773  -5.844 -12.487
  634    HD2  TYR  84           HD1      TYR  84  90.753  -2.401 -14.862
  635    HE1  TYR  84           HE2      TYR  84  88.442  -6.762 -14.367
  636    HE2  TYR  84           HE1      TYR  84  89.422  -3.320 -16.742
  637    HH   TYR  84           HH       TYR  84  87.343  -6.063 -16.353
  638    HB2  TYR  84           HB2      TYR  84  91.852  -2.766 -12.784
  639    HB3  TYR  84           HB1      TYR  84  91.709  -4.304 -11.933
  640    H    GLY  85           HN       GLY  85  89.773  -1.299  -9.416
  641    HA2  GLY  85           HA2      GLY  85  91.473  -2.834  -7.526
  642    HA3  GLY  85           HA1      GLY  85  91.870  -1.134  -7.786
  643    H    ILE  86           HN       ILE  86  88.588  -1.440  -8.175
  644    HA   ILE  86           HA       ILE  86  88.107  -0.568  -5.354
  645    HB   ILE  86           HB       ILE  86  85.918   0.313  -6.412
  646   HG12  ILE  86          HG12      ILE  86  87.503   0.271  -8.967
  647   HG13  ILE  86          HG11      ILE  86  86.499  -1.116  -8.542
  648   HG21  ILE  86          HG21      ILE  86  88.586   1.478  -7.267
  649   HG22  ILE  86          HG22      ILE  86  87.789   1.765  -5.720
  650   HG23  ILE  86          HG23      ILE  86  87.057   2.355  -7.212
  651   HD11  ILE  86          HD11      ILE  86  85.559   1.757  -8.787
  652   HD12  ILE  86          HD12      ILE  86  84.548   0.401  -8.287
  653   HD13  ILE  86          HD13      ILE  86  85.213   0.451  -9.920
  654    H1U  RCY  87           H1U      RCY  87  77.189  -5.686  -3.998
  655    H1S  RCY  87           H1S      RCY  87  80.257  -2.854  -5.970
  656    HB1  RCY  87           HB1      RCY  87  82.741  -3.592  -7.294
  657    HB2  RCY  87           HB2      RCY  87  83.269  -1.910  -7.334
  658    HA   RCY  87           HA       RCY  87  84.732  -3.584  -5.395
  659    HN1  RCY  87           HN1      RCY  87  85.343  -1.353  -7.193
  Start of MODEL   28
    1    HA   MET   1           HA       MET   1  57.182  15.434  14.040
    2    HB2  MET   1           HB2      MET   1  55.581  17.483  14.319
    3    HB3  MET   1           HB1      MET   1  54.697  16.764  12.973
    4    HG2  MET   1           HG2      MET   1  54.564  14.624  14.243
    5    HG3  MET   1           HG1      MET   1  55.360  15.413  15.605
    6    HE1  MET   1           HE1      MET   1  53.643  16.030  17.637
    7    HE2  MET   1           HE2      MET   1  53.574  14.449  16.862
    8    HE3  MET   1           HE3      MET   1  52.080  15.295  17.258
    9    H    ASN   2           HN       ASN   2  58.080  15.464  11.182
   10    HA   ASN   2           HA       ASN   2  55.962  13.958   9.782
   11    HB2  ASN   2           HB2      ASN   2  57.532  15.625   8.649
   12    HB3  ASN   2           HB1      ASN   2  58.805  14.420   8.854
   13   HD21  ASN   2          HD21      ASN   2  59.057  13.192   6.990
   14   HD22  ASN   2          HD22      ASN   2  57.801  12.720   5.951
   15    H    LEU   3           HN       LEU   3  58.454  13.280  11.960
   16    HA   LEU   3           HA       LEU   3  59.255  10.694  10.893
   17    HG   LEU   3           HG       LEU   3  60.493  13.174  11.853
   18    HB2  LEU   3           HB2      LEU   3  59.483  11.731  13.735
   19    HB3  LEU   3           HB1      LEU   3  60.390  10.394  13.031
   20   HD11  LEU   3          HD11      LEU   3  62.306  11.966  13.966
   21   HD12  LEU   3          HD12      LEU   3  61.214  13.331  14.200
   22   HD13  LEU   3          HD13      LEU   3  62.600  13.486  13.121
   23   HD21  LEU   3          HD21      LEU   3  62.752  12.229  11.105
   24   HD22  LEU   3          HD22      LEU   3  61.327  11.496  10.367
   25   HD23  LEU   3          HD23      LEU   3  62.173  10.662  11.672
   26    H    GLU   4           HN       GLU   4  57.352   9.472  10.562
   27    HA   GLU   4           HA       GLU   4  55.529   9.078  12.858
   28    HB2  GLU   4           HB2      GLU   4  55.348   7.788  10.128
   29    HB3  GLU   4           HB1      GLU   4  54.054   8.009  11.308
   30    HG2  GLU   4           HG2      GLU   4  54.293  10.478  11.058
   31    HG3  GLU   4           HG1      GLU   4  55.503  10.208   9.803
   32    HA   PRO   5           HA       PRO   5  57.545   5.459  14.489
   33    HB2  PRO   5           HB2      PRO   5  54.754   4.359  14.396
   34    HB3  PRO   5           HB1      PRO   5  55.940   4.307  15.716
   35    HG2  PRO   5           HG2      PRO   5  53.908   6.048  15.703
   36    HG3  PRO   5           HG1      PRO   5  55.491   6.452  16.383
   37    HD2  PRO   5           HD2      PRO   5  54.216   7.460  13.913
   38    HD3  PRO   5           HD1      PRO   5  55.538   8.167  14.866
   39    HA   PRO   6           HA       PRO   6  57.565   3.232  10.503
   40    HB2  PRO   6           HB2      PRO   6  60.118   2.343  10.615
   41    HB3  PRO   6           HB1      PRO   6  59.725   4.029  10.225
   42    HG2  PRO   6           HG2      PRO   6  60.698   2.865  12.780
   43    HG3  PRO   6           HG1      PRO   6  61.093   4.415  12.021
   44    HD2  PRO   6           HD2      PRO   6  59.268   4.089  14.102
   45    HD3  PRO   6           HD1      PRO   6  59.312   5.481  12.999
   46    H    LYS   7           HN       LYS   7  57.304   1.028   9.996
   47    HA   LYS   7           HA       LYS   7  57.092  -0.796  12.318
   48    HB2  LYS   7           HB2      LYS   7  56.409  -1.472   9.453
   49    HB3  LYS   7           HB1      LYS   7  55.761  -2.181  10.930
   50    HG2  LYS   7           HG2      LYS   7  54.048  -0.724  10.177
   51    HG3  LYS   7           HG1      LYS   7  54.860   0.177  11.458
   52    HD2  LYS   7           HD2      LYS   7  55.659   1.741  10.017
   53    HD3  LYS   7           HD1      LYS   7  56.051   0.541   8.786
   54    HE2  LYS   7           HE2      LYS   7  54.263   2.048   8.002
   55    HE3  LYS   7           HE1      LYS   7  53.667   0.396   8.164
   56    HZ1  LYS   7           HZ1      LYS   7  52.053   1.400   9.335
   57    HZ2  LYS   7           HZ2      LYS   7  52.995   2.768   9.691
   58    HZ3  LYS   7           HZ3      LYS   7  53.181   1.345  10.601
   59    H    ALA   8           HN       ALA   8  59.610  -0.623  12.335
   60    HA   ALA   8           HA       ALA   8  61.055  -2.054  10.265
   61    HB1  ALA   8           HB1      ALA   8  62.915  -2.019  12.013
   62    HB2  ALA   8           HB2      ALA   8  61.789  -1.152  13.059
   63    HB3  ALA   8           HB3      ALA   8  62.294  -0.441  11.526
   64    H    GLU   9           HN       GLU   9  60.517  -4.186   9.993
   65    HA   GLU   9           HA       GLU   9  61.102  -6.034  12.193
   66    HB2  GLU   9           HB2      GLU   9  58.456  -5.174  11.890
   67    HB3  GLU   9           HB1      GLU   9  58.489  -6.729  11.061
   68    HG2  GLU   9           HG2      GLU   9  59.428  -6.200  13.898
   69    HG3  GLU   9           HG1      GLU   9  57.960  -7.060  13.433
   70    H1U  RCY  10           H1U      RCY  10  61.575 -15.248  13.099
   71    H1S  RCY  10           H1S      RCY  10  62.966 -12.263  10.764
   72    HB1  RCY  10           HB1      RCY  10  62.144 -10.933   9.124
   73    HB2  RCY  10           HB2      RCY  10  60.927 -10.770  10.390
   74    HA   RCY  10           HA       RCY  10  62.162  -8.529   8.762
   75    HN1  RCY  10           HN1      RCY  10  60.874  -8.363  11.349
   76    H    ARG  11           HN       ARG  11  59.802  -7.200   8.292
   77    HA   ARG  11           HA       ARG  11  57.527  -8.739   7.639
   78    HE   ARG  11           HE       ARG  11  54.813  -4.543   7.958
   79    HB2  ARG  11           HB2      ARG  11  58.638  -6.301   6.213
   80    HB3  ARG  11           HB1      ARG  11  57.003  -6.933   6.011
   81    HG2  ARG  11           HG2      ARG  11  56.555  -6.581   8.404
   82    HG3  ARG  11           HG1      ARG  11  58.197  -5.977   8.630
   83    HD2  ARG  11           HD2      ARG  11  57.119  -3.963   8.322
   84    HD3  ARG  11           HD1      ARG  11  57.457  -4.351   6.636
   85   HH11  ARG  11          HH21      ARG  11  56.875  -5.036   5.239
   86   HH12  ARG  11          HH22      ARG  11  55.570  -5.197   4.111
   87   HH21  ARG  11          HH11      ARG  11  53.098  -4.750   6.501
   88   HH22  ARG  11          HH12      ARG  11  53.432  -5.035   4.825
   89    H    SER  12           HN       SER  12  56.991  -8.610   4.965
   90    HA   SER  12           HA       SER  12  57.287  -9.948   3.051
   91    HG   SER  12           HG       SER  12  60.056  -9.274   1.098
   92    HB2  SER  12           HB2      SER  12  58.861  -8.135   2.545
   93    HB3  SER  12           HB1      SER  12  60.118  -8.941   3.479
   94    H    ALA  13           HN       ALA  13  60.591 -10.616   3.952
   95    HA   ALA  13           HA       ALA  13  61.648 -12.655   4.434
   96    HB1  ALA  13           HB1      ALA  13  59.121 -13.332   5.951
   97    HB2  ALA  13           HB2      ALA  13  60.310 -12.185   6.568
   98    HB3  ALA  13           HB3      ALA  13  60.767 -13.866   6.291
   99    H    THR  14           HN       THR  14  61.744 -13.802   2.520
  100    HA   THR  14           HA       THR  14  59.884 -16.014   2.176
  101    HB   THR  14           HB       THR  14  59.895 -13.755   0.151
  102    HG1  THR  14           HG1      THR  14  57.506 -14.278   0.701
  103   HG21  THR  14          HG21      THR  14  58.209 -15.281  -1.008
  104   HG22  THR  14          HG22      THR  14  58.795 -16.569   0.044
  105   HG23  THR  14          HG23      THR  14  59.895 -15.792  -1.095
  106    H    ARG  15           HN       ARG  15  62.057 -14.037   0.114
  107    HA   ARG  15           HA       ARG  15  64.010 -16.223   0.024
  108    HE   ARG  15           HE       ARG  15  65.415 -19.163  -3.216
  109    HB2  ARG  15           HB2      ARG  15  62.131 -16.687  -1.721
  110    HB3  ARG  15           HB1      ARG  15  62.847 -15.350  -2.618
  111    HG2  ARG  15           HG2      ARG  15  64.062 -17.123  -3.492
  112    HG3  ARG  15           HG1      ARG  15  65.099 -16.671  -2.139
  113    HD2  ARG  15           HD2      ARG  15  64.060 -18.393  -0.736
  114    HD3  ARG  15           HD1      ARG  15  62.963 -18.822  -2.049
  115   HH11  ARG  15          HH21      ARG  15  64.018 -20.125  -0.215
  116   HH12  ARG  15          HH22      ARG  15  64.951 -21.580  -0.095
  117   HH21  ARG  15          HH11      ARG  15  66.641 -21.057  -3.077
  118   HH22  ARG  15          HH12      ARG  15  66.436 -22.108  -1.715
  119    H    VAL  16           HN       VAL  16  66.000 -15.550  -0.996
  120    HA   VAL  16           HA       VAL  16  67.673 -13.857  -0.980
  121    HB   VAL  16           HB       VAL  16  67.047 -12.279  -3.052
  122   HG11  VAL  16          HG11      VAL  16  68.814 -13.994  -3.028
  123   HG12  VAL  16          HG12      VAL  16  67.896 -14.073  -4.532
  124   HG13  VAL  16          HG13      VAL  16  67.602 -15.255  -3.257
  125   HG21  VAL  16          HG21      VAL  16  65.174 -14.655  -3.311
  126   HG22  VAL  16          HG22      VAL  16  65.483 -13.451  -4.562
  127   HG23  VAL  16          HG23      VAL  16  64.674 -12.981  -3.067
  128    H    MET  17           HN       MET  17  65.403 -11.546  -2.265
  129    HA   MET  17           HA       MET  17  64.882 -10.271   0.313
  130    HB2  MET  17           HB2      MET  17  67.233  -9.588  -0.155
  131    HB3  MET  17           HB1      MET  17  66.701  -8.884  -1.680
  132    HG2  MET  17           HG2      MET  17  65.073  -7.981   0.573
  133    HG3  MET  17           HG1      MET  17  66.777  -7.573   0.777
  134    HE1  MET  17           HE1      MET  17  67.697  -5.172  -1.874
  135    HE2  MET  17           HE2      MET  17  68.139  -6.867  -1.679
  136    HE3  MET  17           HE3      MET  17  67.965  -5.840  -0.258
  137    H    GLY  18           HN       GLY  18  63.852 -11.106  -2.596
  138    HA2  GLY  18           HA2      GLY  18  61.470  -9.817  -2.743
  139    HA3  GLY  18           HA1      GLY  18  62.551  -8.591  -3.406
  140    H    GLY  19           HN       GLY  19  61.685 -12.035  -3.815
  141    HA2  GLY  19           HA2      GLY  19  62.919 -12.502  -6.292
  142    HA3  GLY  19           HA1      GLY  19  61.417 -13.280  -5.791
  143    HA   PRO  20           HA       PRO  20  58.711 -11.101  -8.492
  144    HB2  PRO  20           HB2      PRO  20  57.889  -9.243  -6.287
  145    HB3  PRO  20           HB1      PRO  20  56.878 -10.185  -7.402
  146    HG2  PRO  20           HG2      PRO  20  57.254 -10.943  -4.874
  147    HG3  PRO  20           HG1      PRO  20  57.112 -12.120  -6.190
  148    HD2  PRO  20           HD2      PRO  20  59.523 -11.321  -4.642
  149    HD3  PRO  20           HD1      PRO  20  59.178 -12.845  -5.489
  150    H1U  RCY  21           H1U      RCY  21  56.882  -5.420  -5.060
  151    H1S  RCY  21           H1S      RCY  21  61.173  -3.567  -6.371
  152    HB1  RCY  21           HB1      RCY  21  63.035  -7.533  -6.420
  153    HB2  RCY  21           HB2      RCY  21  61.501  -6.998  -5.733
  154    HA   RCY  21           HA       RCY  21  60.677  -6.810  -8.166
  155    HN1  RCY  21           HN1      RCY  21  60.999  -9.290  -6.632
  156    H    THR  22           HN       THR  22  61.274  -6.939 -10.290
  157    HA   THR  22           HA       THR  22  63.581  -8.611 -11.071
  158    HB   THR  22           HB       THR  22  62.891  -7.632 -13.403
  159    HG1  THR  22           HG1      THR  22  60.467  -7.243 -12.024
  160   HG21  THR  22          HG21      THR  22  62.478  -9.935 -12.866
  161   HG22  THR  22          HG22      THR  22  60.963  -9.277 -13.484
  162   HG23  THR  22          HG23      THR  22  61.183  -9.503 -11.749
  163    HA   PRO  23           HA       PRO  23  66.811  -5.603 -11.172
  164    HB2  PRO  23           HB2      PRO  23  66.814  -6.050 -14.143
  165    HB3  PRO  23           HB1      PRO  23  68.181  -6.010 -13.011
  166    HG2  PRO  23           HG2      PRO  23  67.164  -8.310 -13.928
  167    HG3  PRO  23           HG1      PRO  23  67.821  -8.155 -12.291
  168    HD2  PRO  23           HD2      PRO  23  65.009  -8.482 -13.143
  169    HD3  PRO  23           HD1      PRO  23  65.748  -8.788 -11.556
  170    H    ARG  24           HN       ARG  24  67.349  -3.433 -12.156
  171    HA   ARG  24           HA       ARG  24  64.903  -1.900 -12.586
  172    HE   ARG  24           HE       ARG  24  67.804   1.460 -12.433
  173    HB2  ARG  24           HB2      ARG  24  66.372   0.046 -12.593
  174    HB3  ARG  24           HB1      ARG  24  66.845  -1.027 -11.275
  175    HG2  ARG  24           HG2      ARG  24  68.527  -2.052 -12.919
  176    HG3  ARG  24           HG1      ARG  24  68.200  -0.659 -13.951
  177    HD2  ARG  24           HD2      ARG  24  69.289  -0.620 -11.124
  178    HD3  ARG  24           HD1      ARG  24  70.127  -0.125 -12.594
  179   HH11  ARG  24          HH21      ARG  24  70.670   0.800 -10.634
  180   HH12  ARG  24          HH22      ARG  24  70.760   2.385  -9.941
  181   HH21  ARG  24          HH11      ARG  24  67.904   3.534 -11.539
  182   HH22  ARG  24          HH12      ARG  24  69.194   3.933 -10.454
  183    H    LYS  25           HN       LYS  25  65.544  -0.001 -14.438
  184    HA   LYS  25           HA       LYS  25  64.779  -0.956 -16.891
  185    HB2  LYS  25           HB2      LYS  25  65.450   1.473 -16.086
  186    HB3  LYS  25           HB1      LYS  25  66.984   1.085 -16.861
  187    HG2  LYS  25           HG2      LYS  25  65.786   2.034 -18.632
  188    HG3  LYS  25           HG1      LYS  25  65.467   0.315 -18.863
  189    HD2  LYS  25           HD2      LYS  25  63.303   0.475 -17.897
  190    HD3  LYS  25           HD1      LYS  25  63.644   2.061 -17.203
  191    HE2  LYS  25           HE2      LYS  25  62.222   1.865 -19.421
  192    HE3  LYS  25           HE1      LYS  25  63.412   3.155 -19.242
  193    HZ1  LYS  25           HZ1      LYS  25  63.382   1.579 -21.333
  194    HZ2  LYS  25           HZ2      LYS  25  64.330   0.599 -20.319
  195    HZ3  LYS  25           HZ3      LYS  25  64.834   2.178 -20.693
  196    H    GLY  26           HN       GLY  26  68.217  -0.634 -15.908
  197    HA2  GLY  26           HA2      GLY  26  68.922  -3.099 -17.258
  198    HA3  GLY  26           HA1      GLY  26  69.434  -1.688 -18.183
  199    HA   PRO  27           HA       PRO  27  72.806  -3.042 -15.157
  200    HB2  PRO  27           HB2      PRO  27  74.301  -1.900 -17.486
  201    HB3  PRO  27           HB1      PRO  27  74.665  -3.336 -16.509
  202    HG2  PRO  27           HG2      PRO  27  73.620  -3.544 -18.947
  203    HG3  PRO  27           HG1      PRO  27  73.161  -4.653 -17.643
  204    HD2  PRO  27           HD2      PRO  27  71.595  -2.420 -18.850
  205    HD3  PRO  27           HD1      PRO  27  71.021  -3.926 -18.100
  206    HA   PRO  28           HA       PRO  28  72.918   1.042 -13.306
  207    HB2  PRO  28           HB2      PRO  28  75.726   0.185 -12.675
  208    HB3  PRO  28           HB1      PRO  28  74.509   0.923 -11.613
  209    HG2  PRO  28           HG2      PRO  28  75.039  -1.696 -11.546
  210    HG3  PRO  28           HG1      PRO  28  73.408  -1.062 -11.275
  211    HD2  PRO  28           HD2      PRO  28  74.464  -2.561 -13.603
  212    HD3  PRO  28           HD1      PRO  28  72.785  -2.370 -13.052
  213    H    LYS  29           HN       LYS  29  73.940   3.103 -13.707
  214    HA   LYS  29           HA       LYS  29  76.278   3.409 -15.346
  215    HB2  LYS  29           HB2      LYS  29  75.139   4.289 -17.391
  216    HB3  LYS  29           HB1      LYS  29  74.853   2.569 -17.138
  217    HG2  LYS  29           HG2      LYS  29  72.720   3.299 -15.877
  218    HG3  LYS  29           HG1      LYS  29  72.967   4.871 -16.638
  219    HD2  LYS  29           HD2      LYS  29  72.952   3.805 -18.861
  220    HD3  LYS  29           HD1      LYS  29  72.711   2.229 -18.106
  221    HE2  LYS  29           HE2      LYS  29  70.617   3.214 -17.028
  222    HE3  LYS  29           HE1      LYS  29  70.814   4.585 -18.119
  223    HZ1  LYS  29           HZ1      LYS  29  70.931   1.919 -19.295
  224    HZ2  LYS  29           HZ2      LYS  29  70.277   3.356 -19.921
  225    HZ3  LYS  29           HZ3      LYS  29  69.411   2.457 -18.768
  226    H1U  RCY  30           H1U      RCY  30  67.790  10.367 -11.810
  227    H1S  RCY  30           H1S      RCY  30  71.052  10.287 -14.240
  228    HB1  RCY  30           HB1      RCY  30  73.678   7.080 -13.389
  229    HB2  RCY  30           HB2      RCY  30  72.590   7.093 -14.774
  230    HA   RCY  30           HA       RCY  30  74.480   8.078 -16.136
  231    HN1  RCY  30           HN1      RCY  30  74.714   5.803 -16.651
  232    H    LYS  31           HN       LYS  31  76.824   6.179 -14.869
  233    HA   LYS  31           HA       LYS  31  77.951   7.751 -12.767
  234    HB2  LYS  31           HB2      LYS  31  79.197   5.867 -14.783
  235    HB3  LYS  31           HB1      LYS  31  80.120   6.623 -13.483
  236    HG2  LYS  31           HG2      LYS  31  78.866   5.524 -11.800
  237    HG3  LYS  31           HG1      LYS  31  77.581   5.087 -12.927
  238    HD2  LYS  31           HD2      LYS  31  79.196   3.622 -14.140
  239    HD3  LYS  31           HD1      LYS  31  80.410   3.996 -12.916
  240    HE2  LYS  31           HE2      LYS  31  79.146   2.935 -11.194
  241    HE3  LYS  31           HE1      LYS  31  77.704   2.852 -12.205
  242    HZ1  LYS  31           HZ1      LYS  31  78.482   1.077 -13.338
  243    HZ2  LYS  31           HZ2      LYS  31  79.349   0.816 -11.900
  244    HZ3  LYS  31           HZ3      LYS  31  80.105   1.559 -13.228
  245    H    GLN  32           HN       GLN  32  80.200   8.868 -13.128
  246    HA   GLN  32           HA       GLN  32  80.381  10.288 -15.715
  247    HB2  GLN  32           HB2      GLN  32  80.478  12.506 -14.464
  248    HB3  GLN  32           HB1      GLN  32  78.880  11.765 -14.567
  249    HG2  GLN  32           HG2      GLN  32  78.977  10.990 -12.322
  250    HG3  GLN  32           HG1      GLN  32  80.713  11.284 -12.213
  251   HE21  GLN  32          HE21      GLN  32  80.086  12.642 -10.252
  252   HE22  GLN  32          HE22      GLN  32  79.574  14.240 -10.511
  253    H    ARG  33           HN       ARG  33  81.831   8.726 -13.205
  254    HA   ARG  33           HA       ARG  33  84.050   8.544 -12.481
  255    HE   ARG  33           HE       ARG  33  87.749   6.564 -12.478
  256    HB2  ARG  33           HB2      ARG  33  84.292   8.309 -15.005
  257    HB3  ARG  33           HB1      ARG  33  84.724  10.018 -15.036
  258    HG2  ARG  33           HG2      ARG  33  86.836   9.126 -14.801
  259    HG3  ARG  33           HG1      ARG  33  86.395   9.233 -13.096
  260    HD2  ARG  33           HD2      ARG  33  85.542   6.880 -13.225
  261    HD3  ARG  33           HD1      ARG  33  86.154   6.791 -14.876
  262   HH11  ARG  33          HH21      ARG  33  87.652   7.784 -15.702
  263   HH12  ARG  33          HH22      ARG  33  89.366   7.694 -15.930
  264   HH21  ARG  33          HH11      ARG  33  89.989   6.440 -12.757
  265   HH22  ARG  33          HH12      ARG  33  90.690   6.933 -14.263
  266    H    GLN  34           HN       GLN  34  84.380   9.846 -10.724
  267    HA   GLN  34           HA       GLN  34  85.459  12.556 -11.224
  268    HB2  GLN  34           HB2      GLN  34  82.900  12.640 -10.832
  269    HB3  GLN  34           HB1      GLN  34  83.277  12.203  -9.166
  270    HG2  GLN  34           HG2      GLN  34  83.251  14.562  -9.124
  271    HG3  GLN  34           HG1      GLN  34  84.966  14.170  -9.252
  272   HE21  GLN  34          HE21      GLN  34  85.962  14.352 -11.450
  273   HE22  GLN  34          HE22      GLN  34  85.265  15.384 -12.603
  274    H    THR  35           HN       THR  35  84.674  12.665  -8.105
  275    HA   THR  35           HA       THR  35  86.681  10.783  -7.050
  276    HB   THR  35           HB       THR  35  87.962  12.646  -5.946
  277    HG1  THR  35           HG1      THR  35  85.980  14.051  -7.132
  278   HG21  THR  35          HG21      THR  35  87.969  12.949  -8.952
  279   HG22  THR  35          HG22      THR  35  88.602  11.511  -8.151
  280   HG23  THR  35          HG23      THR  35  89.332  13.086  -7.842
  281    H    ARG  36           HN       ARG  36  85.526   9.942  -5.379
  282    HA   ARG  36           HA       ARG  36  83.285  11.024  -4.126
  283    HE   ARG  36           HE       ARG  36  82.765   9.529  -5.358
  284    HB2  ARG  36           HB2      ARG  36  84.616   8.709  -3.820
  285    HB3  ARG  36           HB1      ARG  36  85.215   9.537  -2.387
  286    HG2  ARG  36           HG2      ARG  36  83.186   8.280  -1.828
  287    HG3  ARG  36           HG1      ARG  36  82.868  10.011  -1.707
  288    HD2  ARG  36           HD2      ARG  36  81.313   8.259  -3.125
  289    HD3  ARG  36           HD1      ARG  36  81.404   9.990  -3.447
  290   HH11  ARG  36          HH21      ARG  36  82.090   6.760  -3.418
  291   HH12  ARG  36          HH22      ARG  36  82.649   5.628  -4.604
  292   HH21  ARG  36          HH11      ARG  36  83.499   8.066  -6.918
  293   HH22  ARG  36          HH12      ARG  36  83.447   6.367  -6.585
  294    H    GLN  37           HN       GLN  37  83.081  12.952  -3.105
  295    HA   GLN  37           HA       GLN  37  85.411  14.360  -2.061
  296    HB2  GLN  37           HB2      GLN  37  83.263  15.367  -3.130
  297    HB3  GLN  37           HB1      GLN  37  82.550  15.153  -1.531
  298    HG2  GLN  37           HG2      GLN  37  83.427  17.348  -1.471
  299    HG3  GLN  37           HG1      GLN  37  84.649  16.380  -0.646
  300   HE21  GLN  37          HE21      GLN  37  86.747  16.655  -1.415
  301   HE22  GLN  37          HE22      GLN  37  87.150  17.239  -2.957
  302    H1U  RCY  38           H1U      RCY  38  75.416  11.667   3.856
  303    H1S  RCY  38           H1S      RCY  38  79.831  10.682   2.073
  304    HB1  RCY  38           HB1      RCY  38  81.174  11.842   1.004
  305    HB2  RCY  38           HB2      RCY  38  80.951  13.379   1.839
  306    HA   RCY  38           HA       RCY  38  83.302  13.656   2.159
  307    HN1  RCY  38           HN1      RCY  38  82.375  13.229  -0.510
  308    H    LYS  39           HN       LYS  39  85.035  12.650   3.047
  309    HA   LYS  39           HA       LYS  39  85.200   9.780   3.217
  310    HB2  LYS  39           HB2      LYS  39  87.193   9.400   1.869
  311    HB3  LYS  39           HB1      LYS  39  85.947  10.115   0.846
  312    HG2  LYS  39           HG2      LYS  39  86.990  12.378   1.355
  313    HG3  LYS  39           HG1      LYS  39  88.338  11.500   2.080
  314    HD2  LYS  39           HD2      LYS  39  87.367  11.184  -0.776
  315    HD3  LYS  39           HD1      LYS  39  88.814  12.060  -0.278
  316    HE2  LYS  39           HE2      LYS  39  89.705   9.974  -0.827
  317    HE3  LYS  39           HE1      LYS  39  89.432   9.794   0.906
  318    HZ1  LYS  39           HZ1      LYS  39  88.267   8.001   0.320
  319    HZ2  LYS  39           HZ2      LYS  39  88.138   8.482  -1.305
  320    HZ3  LYS  39           HZ3      LYS  39  87.052   9.088  -0.148
  321    H    SER  40           HN       SER  40  86.277  12.947   3.891
  322    HA   SER  40           HA       SER  40  88.680  12.256   5.362
  323    HG   SER  40           HG       SER  40  85.947  14.178   5.215
  324    HB2  SER  40           HB2      SER  40  88.423  14.582   6.293
  325    HB3  SER  40           HB1      SER  40  88.427  14.517   4.533
  326    H    LYS  41           HN       LYS  41  86.775  10.467   6.212
  327    HA   LYS  41           HA       LYS  41  85.696  11.492   8.776
  328    HB2  LYS  41           HB2      LYS  41  84.759   9.079   8.864
  329    HB3  LYS  41           HB1      LYS  41  84.095  10.170   7.648
  330    HG2  LYS  41           HG2      LYS  41  85.510   9.222   5.930
  331    HG3  LYS  41           HG1      LYS  41  86.376   8.248   7.119
  332    HD2  LYS  41           HD2      LYS  41  84.235   7.080   7.659
  333    HD3  LYS  41           HD1      LYS  41  83.450   7.988   6.366
  334    HE2  LYS  41           HE2      LYS  41  85.563   5.856   6.162
  335    HE3  LYS  41           HE1      LYS  41  84.041   5.997   5.282
  336    HZ1  LYS  41           HZ1      LYS  41  85.011   8.056   4.257
  337    HZ2  LYS  41           HZ2      LYS  41  85.734   6.593   3.784
  338    HZ3  LYS  41           HZ3      LYS  41  86.506   7.597   4.916
  339    HA   PRO  42           HA       PRO  42  89.200   9.726  10.908
  340    HB2  PRO  42           HB2      PRO  42  88.264   9.853  13.461
  341    HB3  PRO  42           HB1      PRO  42  88.754  11.297  12.554
  342    HG2  PRO  42           HG2      PRO  42  86.021  10.231  13.061
  343    HG3  PRO  42           HG1      PRO  42  86.600  11.906  13.071
  344    HD2  PRO  42           HD2      PRO  42  85.247  10.789  10.952
  345    HD3  PRO  42           HD1      PRO  42  86.402  12.128  10.780
  346    HA   PRO  43           HA       PRO  43  88.296   5.434  11.577
  347    HB2  PRO  43           HB2      PRO  43  90.176   4.747  13.448
  348    HB3  PRO  43           HB1      PRO  43  90.571   5.072  11.748
  349    HG2  PRO  43           HG2      PRO  43  90.864   6.840  14.123
  350    HG3  PRO  43           HG1      PRO  43  91.946   6.620  12.737
  351    HD2  PRO  43           HD2      PRO  43  90.245   8.756  12.973
  352    HD3  PRO  43           HD1      PRO  43  90.759   8.095  11.405
  353    H    LYS  44           HN       LYS  44  87.134   4.047  12.985
  354    HA   LYS  44           HA       LYS  44  86.721   4.876  15.792
  355    HB2  LYS  44           HB2      LYS  44  85.011   6.070  14.303
  356    HB3  LYS  44           HB1      LYS  44  84.327   4.476  13.986
  357    HG2  LYS  44           HG2      LYS  44  84.230   4.186  16.535
  358    HG3  LYS  44           HG1      LYS  44  84.534   5.921  16.633
  359    HD2  LYS  44           HD2      LYS  44  82.531   6.418  15.387
  360    HD3  LYS  44           HD1      LYS  44  82.279   4.713  15.010
  361    HE2  LYS  44           HE2      LYS  44  80.857   5.636  16.913
  362    HE3  LYS  44           HE1      LYS  44  81.786   4.186  17.292
  363    HZ1  LYS  44           HZ1      LYS  44  83.146   5.305  18.675
  364    HZ2  LYS  44           HZ2      LYS  44  81.824   6.366  18.794
  365    HZ3  LYS  44           HZ3      LYS  44  83.118   6.729  17.753
  366    H    LYS  45           HN       LYS  45  84.137   3.014  14.918
  367    HA   LYS  45           HA       LYS  45  84.863   0.719  16.316
  368    HB2  LYS  45           HB2      LYS  45  82.656   1.497  14.862
  369    HB3  LYS  45           HB1      LYS  45  83.252   0.143  13.905
  370    HG2  LYS  45           HG2      LYS  45  83.298  -1.266  15.943
  371    HG3  LYS  45           HG1      LYS  45  82.660   0.086  16.880
  372    HD2  LYS  45           HD2      LYS  45  80.684  -1.007  16.381
  373    HD3  LYS  45           HD1      LYS  45  80.794   0.062  14.983
  374    HE2  LYS  45           HE2      LYS  45  80.364  -2.066  14.042
  375    HE3  LYS  45           HE1      LYS  45  82.106  -1.859  13.858
  376    HZ1  LYS  45           HZ1      LYS  45  81.975  -2.957  16.281
  377    HZ2  LYS  45           HZ2      LYS  45  82.164  -3.855  14.851
  378    HZ3  LYS  45           HZ3      LYS  45  80.626  -3.686  15.554
  379    H    GLY  46           HN       GLY  46  84.770   0.727  12.729
  380    HA2  GLY  46           HA2      GLY  46  86.960  -1.287  12.770
  381    HA3  GLY  46           HA1      GLY  46  85.909  -0.947  11.393
  382    H    VAL  47           HN       VAL  47  88.884  -0.938  11.509
  383    HA   VAL  47           HA       VAL  47  89.940   1.687  11.562
  384    HB   VAL  47           HB       VAL  47  91.356  -0.326  11.446
  385   HG11  VAL  47          HG11      VAL  47  89.672  -1.338   9.676
  386   HG12  VAL  47          HG12      VAL  47  91.377  -1.789   9.636
  387   HG13  VAL  47          HG13      VAL  47  90.760  -0.575   8.516
  388   HG21  VAL  47          HG21      VAL  47  91.805   1.310   8.940
  389   HG22  VAL  47          HG22      VAL  47  93.018   0.565   9.981
  390   HG23  VAL  47          HG23      VAL  47  92.103   1.960  10.552
  391    H    GLN  48           HN       GLN  48  89.089   3.358  10.428
  392    HA   GLN  48           HA       GLN  48  88.090   4.551   8.668
  393    HB2  GLN  48           HB2      GLN  48  89.972   2.711   7.167
  394    HB3  GLN  48           HB1      GLN  48  89.115   4.055   6.413
  395    HG2  GLN  48           HG2      GLN  48  90.941   4.351   8.815
  396    HG3  GLN  48           HG1      GLN  48  91.450   4.637   7.150
  397   HE21  GLN  48          HE21      GLN  48  90.982   6.680   6.261
  398   HE22  GLN  48          HE22      GLN  48  90.005   7.846   7.013
  399    H    GLY  49           HN       GLY  49  85.977   3.634   9.067
  400    HA2  GLY  49           HA2      GLY  49  84.839   2.358   6.741
  401    HA3  GLY  49           HA1      GLY  49  84.946   1.223   8.089
  402    H1U  RCY  50           H1U      RCY  50  82.073   4.523   2.767
  403    H1S  RCY  50           H1S      RCY  50  82.497   3.646   7.241
  404    HB1  RCY  50           HB1      RCY  50  82.453   5.561   8.172
  405    HB2  RCY  50           HB2      RCY  50  81.320   6.062   9.425
  406    HA   RCY  50           HA       RCY  50  82.957   5.126  10.757
  407    HN1  RCY  50           HN1      RCY  50  84.689   4.065   9.599
  408    H    GLY  51           HN       GLY  51  81.395   4.527  12.236
  409    HA2  GLY  51           HA2      GLY  51  80.456   1.698  12.063
  410    HA3  GLY  51           HA1      GLY  51  80.653   2.600  13.566
  411    H    ASP  52           HN       ASP  52  78.723   3.133  14.440
  412    HA   ASP  52           HA       ASP  52  76.254   3.046  12.972
  413    HB2  ASP  52           HB2      ASP  52  77.011   4.129  15.690
  414    HB3  ASP  52           HB1      ASP  52  75.365   4.244  15.068
  415    H    ASP  53           HN       ASP  53  78.641   5.174  12.524
  416    HA   ASP  53           HA       ASP  53  77.663   7.771  12.783
  417    HB2  ASP  53           HB2      ASP  53  79.219   6.516  10.507
  418    HB3  ASP  53           HB1      ASP  53  78.919   8.251  10.626
  419    H    ILE  54           HN       ILE  54  75.416   7.956  12.493
  420    HA   ILE  54           HA       ILE  54  73.805   6.853  10.527
  421    HB   ILE  54           HB       ILE  54  72.449   9.038  10.707
  422   HG12  ILE  54          HG12      ILE  54  73.300  10.320  12.832
  423   HG13  ILE  54          HG11      ILE  54  74.866   9.634  12.398
  424   HG21  ILE  54          HG21      ILE  54  71.930   7.113  12.093
  425   HG22  ILE  54          HG22      ILE  54  71.882   8.556  13.107
  426   HG23  ILE  54          HG23      ILE  54  73.277   7.478  13.172
  427   HD11  ILE  54          HD11      ILE  54  73.625  11.925  11.286
  428   HD12  ILE  54          HD12      ILE  54  73.594  10.682  10.036
  429   HD13  ILE  54          HD13      ILE  54  75.127  11.160  10.766
  430    HA   PRO  55           HA       PRO  55  75.469   8.668   6.796
  431    HB2  PRO  55           HB2      PRO  55  73.611   7.786   5.030
  432    HB3  PRO  55           HB1      PRO  55  74.779   6.690   5.794
  433    HG2  PRO  55           HG2      PRO  55  71.919   7.158   6.475
  434    HG3  PRO  55           HG1      PRO  55  72.834   5.642   6.424
  435    HD2  PRO  55           HD2      PRO  55  72.280   7.015   8.754
  436    HD3  PRO  55           HD1      PRO  55  73.667   5.921   8.557
  437    H    GLY  56           HN       GLY  56  75.287  10.885   6.625
  438    HA2  GLY  56           HA2      GLY  56  74.274  13.010   6.453
  439    HA3  GLY  56           HA1      GLY  56  73.355  12.222   5.170
  440    H    MET  57           HN       MET  57  73.305  11.782   8.721
  441    HA   MET  57           HA       MET  57  71.496  11.829  10.213
  442    HB2  MET  57           HB2      MET  57  70.143  13.737   8.305
  443    HB3  MET  57           HB1      MET  57  70.067  13.703  10.067
  444    HG2  MET  57           HG2      MET  57  72.633  14.145   9.955
  445    HG3  MET  57           HG1      MET  57  72.311  14.656   8.298
  446    HE1  MET  57           HE1      MET  57  72.761  17.699  10.970
  447    HE2  MET  57           HE2      MET  57  73.545  16.926   9.594
  448    HE3  MET  57           HE3      MET  57  73.363  16.042  11.107
  449    H    GLU  58           HN       GLU  58  70.873   9.641   9.698
  450    HA   GLU  58           HA       GLU  58  69.392   7.982   8.946
  451    HB2  GLU  58           HB2      GLU  58  67.488  10.327   8.669
  452    HB3  GLU  58           HB1      GLU  58  67.048   8.628   8.847
  453    HG2  GLU  58           HG2      GLU  58  67.949   8.551  11.082
  454    HG3  GLU  58           HG1      GLU  58  68.658  10.157  10.907
  455    H    GLY  59           HN       GLY  59  70.095   7.230   6.973
  456    HA2  GLY  59           HA2      GLY  59  68.793   8.310   4.573
  457    HA3  GLY  59           HA1      GLY  59  70.549   8.473   4.590
  458    H1U  RCY  60           H1U      RCY  60  63.413   7.646   3.428
  459    H1S  RCY  60           H1S      RCY  60  66.846   5.304   2.891
  460    HB1  RCY  60           HB1      RCY  60  68.940   3.318   2.245
  461    HB2  RCY  60           HB2      RCY  60  70.439   4.128   2.701
  462    HA   RCY  60           HA       RCY  60  67.909   3.797   4.260
  463    HN1  RCY  60           HN1      RCY  60  67.979   6.026   4.992
  464    H    GLY  61           HN       GLY  61  69.532   4.681   6.622
  465    HA2  GLY  61           HA2      GLY  61  70.858   2.129   7.087
  466    HA3  GLY  61           HA1      GLY  61  71.996   3.468   6.941
  467    H    THR  62           HN       THR  62  70.848   5.516   8.221
  468    HA   THR  62           HA       THR  62  70.501   6.392  10.351
  469    HB   THR  62           HB       THR  62  68.714   5.485  11.580
  470    HG1  THR  62           HG1      THR  62  68.352   3.347  11.756
  471   HG21  THR  62          HG21      THR  62  68.189   4.164   8.924
  472   HG22  THR  62          HG22      THR  62  68.265   5.921   9.063
  473   HG23  THR  62          HG23      THR  62  67.056   5.015   9.974
  474    H    ASP  63           HN       ASP  63  70.127   4.069  12.485
  475    HA   ASP  63           HA       ASP  63  72.837   4.246  13.481
  476    HB2  ASP  63           HB2      ASP  63  72.052   2.775  15.277
  477    HB3  ASP  63           HB1      ASP  63  70.861   4.040  14.971
  478    H    ILE  64           HN       ILE  64  70.907   1.535  12.187
  479    HA   ILE  64           HA       ILE  64  72.980  -0.414  12.307
  480    HB   ILE  64           HB       ILE  64  70.655  -0.242  10.387
  481   HG12  ILE  64          HG12      ILE  64  70.802  -1.880  12.914
  482   HG13  ILE  64          HG11      ILE  64  70.267  -0.200  12.964
  483   HG21  ILE  64          HG21      ILE  64  70.969  -2.782  10.456
  484   HG22  ILE  64          HG22      ILE  64  72.543  -2.466  11.185
  485   HG23  ILE  64          HG23      ILE  64  72.189  -1.874   9.562
  486   HD11  ILE  64          HD11      ILE  64  68.379  -0.627  11.638
  487   HD12  ILE  64          HD12      ILE  64  68.477  -2.073  12.644
  488   HD13  ILE  64          HD13      ILE  64  69.061  -2.115  10.980
  489    H    THR  65           HN       THR  65  72.983   2.366  10.496
  490    HA   THR  65           HA       THR  65  73.684   2.317   8.010
  491    HB   THR  65           HB       THR  65  76.073   2.736   9.800
  492    HG1  THR  65           HG1      THR  65  73.666   3.765  10.139
  493   HG21  THR  65          HG21      THR  65  75.000   4.158   7.347
  494   HG22  THR  65          HG22      THR  65  76.383   3.064   7.390
  495   HG23  THR  65          HG23      THR  65  76.458   4.614   8.229
  496    H    VAL  66           HN       VAL  66  76.064   0.738  10.156
  497    HA   VAL  66           HA       VAL  66  77.787  -0.483   8.490
  498    HB   VAL  66           HB       VAL  66  76.317  -2.191  10.505
  499   HG11  VAL  66          HG11      VAL  66  79.273  -2.003   9.887
  500   HG12  VAL  66          HG12      VAL  66  78.194  -3.094   9.017
  501   HG13  VAL  66          HG13      VAL  66  78.426  -3.284  10.755
  502   HG21  VAL  66          HG21      VAL  66  76.679  -0.117  11.655
  503   HG22  VAL  66          HG22      VAL  66  78.285   0.068  10.950
  504   HG23  VAL  66          HG23      VAL  66  77.988  -1.189  12.152
  505    H    ILE  67           HN       ILE  67  74.930  -2.452   9.345
  506    HA   ILE  67           HA       ILE  67  74.618  -3.084   6.442
  507    HB   ILE  67           HB       ILE  67  74.851  -5.114   8.681
  508   HG12  ILE  67          HG12      ILE  67  76.875  -4.071   7.335
  509   HG13  ILE  67          HG11      ILE  67  76.814  -5.809   7.633
  510   HG21  ILE  67          HG21      ILE  67  73.715  -5.301   5.901
  511   HG22  ILE  67          HG22      ILE  67  73.090  -5.984   7.402
  512   HG23  ILE  67          HG23      ILE  67  74.503  -6.701   6.628
  513   HD11  ILE  67          HD11      ILE  67  75.542  -4.657   5.161
  514   HD12  ILE  67          HD12      ILE  67  76.140  -6.293   5.440
  515   HD13  ILE  67          HD13      ILE  67  77.278  -4.967   5.203
  516    H1U  RCY  68           H1U      RCY  68  67.084   1.125   1.348
  517    H1S  RCY  68           H1S      RCY  68  69.715  -1.636   3.050
  518    HB1  RCY  68           HB1      RCY  68  70.685  -0.131   7.111
  519    HB2  RCY  68           HB2      RCY  68  69.217  -0.960   6.599
  520    HA   RCY  68           HA       RCY  68  70.546  -2.235   8.311
  521    HN1  RCY  68           HN1      RCY  68  72.728  -1.793   6.479
  522    HA   PRO  69           HA       PRO  69  68.857  -5.986   6.753
  523    HB2  PRO  69           HB2      PRO  69  66.125  -5.362   6.925
  524    HB3  PRO  69           HB1      PRO  69  67.124  -6.029   8.227
  525    HG2  PRO  69           HG2      PRO  69  66.254  -3.242   7.751
  526    HG3  PRO  69           HG1      PRO  69  66.549  -4.093   9.275
  527    HD2  PRO  69           HD2      PRO  69  68.293  -2.257   8.265
  528    HD3  PRO  69           HD1      PRO  69  68.826  -3.642   9.245
  529    H    TRP  70           HN       TRP  70  67.572  -2.975   5.351
  530    HA   TRP  70           HA       TRP  70  66.553  -4.382   2.997
  531    HD1  TRP  70           HD1      TRP  70  68.468  -0.314   3.255
  532    HE1  TRP  70           HE1      TRP  70  68.552   1.034   5.449
  533    HE3  TRP  70           HE3      TRP  70  64.513  -2.399   5.721
  534    HZ2  TRP  70           HZ2      TRP  70  67.128   1.206   7.929
  535    HZ3  TRP  70           HZ3      TRP  70  63.900  -1.628   7.992
  536    HH2  TRP  70           HH2      TRP  70  65.198   0.169   9.099
  537    HB2  TRP  70           HB2      TRP  70  66.545  -1.824   2.174
  538    HB3  TRP  70           HB1      TRP  70  65.308  -2.465   3.249
  539    H    GLU  71           HN       GLU  71  69.334  -4.890   3.535
  540    HA   GLU  71           HA       GLU  71  70.409  -4.247   0.895
  541    HB2  GLU  71           HB2      GLU  71  71.564  -3.008   3.396
  542    HB3  GLU  71           HB1      GLU  71  72.545  -3.268   1.957
  543    HG2  GLU  71           HG2      GLU  71  70.576  -2.058   0.717
  544    HG3  GLU  71           HG1      GLU  71  70.179  -1.449   2.324
  545    H    ALA  72           HN       ALA  72  69.779  -6.660   2.412
  546    HA   ALA  72           HA       ALA  72  72.278  -7.815   3.350
  547    HB1  ALA  72           HB1      ALA  72  70.990  -9.944   3.371
  548    HB2  ALA  72           HB2      ALA  72  69.653  -9.123   2.565
  549    HB3  ALA  72           HB3      ALA  72  70.128  -8.644   4.194
  550    H1U  RCY  73           H1U      RCY  73  70.971  -4.496  -7.540
  551    H1S  RCY  73           H1S      RCY  73  73.199  -4.885  -3.648
  552    HB1  RCY  73           HB1      RCY  73  74.278  -7.311  -2.393
  553    HB2  RCY  73           HB2      RCY  73  74.655  -6.452  -0.903
  554    HA   RCY  73           HA       RCY  73  72.659  -8.721  -1.190
  555    HN1  RCY  73           HN1      RCY  73  73.065  -6.839   1.015
  556    H    ASN  74           HN       ASN  74  73.645 -10.674  -1.124
  557    HA   ASN  74           HA       ASN  74  76.057 -11.093   0.490
  558    HB2  ASN  74           HB2      ASN  74  74.415 -12.928  -1.275
  559    HB3  ASN  74           HB1      ASN  74  75.831 -13.458  -0.366
  560   HD21  ASN  74          HD21      ASN  74  72.567 -13.546  -0.144
  561   HD22  ASN  74          HD22      ASN  74  72.370 -13.437   1.539
  562    H    HIS  75           HN       HIS  75  75.654  -9.751  -2.469
  563    HA   HIS  75           HA       HIS  75  78.375  -9.930  -3.228
  564    HD1  HIS  75           HD1      HIS  75  79.241 -11.517  -2.108
  565    HD2  HIS  75           HD2      HIS  75  79.539 -13.175  -5.924
  566    HE1  HIS  75           HE1      HIS  75  81.501 -12.656  -2.219
  567    HE2  HIS  75           HE2      HIS  75  81.695 -13.669  -4.537
  568    HB2  HIS  75           HB2      HIS  75  76.791 -12.256  -3.952
  569    HB3  HIS  75           HB1      HIS  75  77.379 -11.445  -5.401
  570    H1U  RCY  76           H1U      RCY  76  71.137  -1.440  -6.938
  571    H1S  RCY  76           H1S      RCY  76  75.137  -4.063  -6.695
  572    HB1  RCY  76           HB1      RCY  76  76.542  -6.203  -6.488
  573    HB2  RCY  76           HB2      RCY  76  77.294  -6.675  -4.966
  574    HA   RCY  76           HA       RCY  76  74.413  -7.029  -4.835
  575    HN1  RCY  76           HN1      RCY  76  75.348  -8.712  -3.494
  576    H    GLU  77           HN       GLU  77  73.206  -7.234  -6.684
  577    HA   GLU  77           HA       GLU  77  73.357  -9.492  -8.353
  578    HB2  GLU  77           HB2      GLU  77  72.114  -6.774  -8.651
  579    HB3  GLU  77           HB1      GLU  77  72.133  -7.858 -10.042
  580    HG2  GLU  77           HG2      GLU  77  71.170  -8.794  -7.338
  581    HG3  GLU  77           HG1      GLU  77  70.085  -7.985  -8.470
  582    H    LEU  78           HN       LEU  78  75.180  -6.526  -8.464
  583    HA   LEU  78           HA       LEU  78  76.259  -7.195 -11.151
  584    HG   LEU  78           HG       LEU  78  78.618  -5.281 -10.919
  585    HB2  LEU  78           HB2      LEU  78  75.621  -4.846 -10.698
  586    HB3  LEU  78           HB1      LEU  78  76.761  -4.799  -9.355
  587   HD11  LEU  78          HD11      LEU  78  77.866  -4.878 -13.429
  588   HD12  LEU  78          HD12      LEU  78  76.320  -5.480 -12.831
  589   HD13  LEU  78          HD13      LEU  78  77.764  -6.485 -12.711
  590   HD21  LEU  78          HD21      LEU  78  77.751  -2.915 -10.423
  591   HD22  LEU  78          HD22      LEU  78  76.982  -2.982 -12.009
  592   HD23  LEU  78          HD23      LEU  78  78.737  -3.099 -11.873
  593    H    HIS  79           HN       HIS  79  78.554  -7.477 -11.443
  594    HA   HIS  79           HA       HIS  79  80.283  -7.667  -9.082
  595    HD1  HIS  79           HD1      HIS  79  81.496 -11.761  -8.848
  596    HD2  HIS  79           HD2      HIS  79  79.640  -8.518  -6.995
  597    HE1  HIS  79           HE1      HIS  79  82.096 -11.901  -6.391
  598    HE2  HIS  79           HE2      HIS  79  80.972  -9.933  -5.252
  599    HB2  HIS  79           HB2      HIS  79  78.823  -9.944  -9.841
  600    HB3  HIS  79           HB1      HIS  79  80.428 -10.210 -10.516
  601    H    GLU  80           HN       GLU  80  81.723  -6.275 -10.100
  602    HA   GLU  80           HA       GLU  80  82.892  -7.223 -12.693
  603    HB2  GLU  80           HB2      GLU  80  81.705  -5.019 -12.809
  604    HB3  GLU  80           HB1      GLU  80  82.829  -4.392 -11.603
  605    HG2  GLU  80           HG2      GLU  80  83.853  -5.684 -14.125
  606    HG3  GLU  80           HG1      GLU  80  83.373  -3.987 -14.116
  607    H    LEU  81           HN       LEU  81  84.025  -4.842 -10.299
  608    HA   LEU  81           HA       LEU  81  86.683  -6.080 -10.367
  609    HG   LEU  81           HG       LEU  81  85.898  -4.255  -7.322
  610    HB2  LEU  81           HB2      LEU  81  87.450  -4.164  -9.218
  611    HB3  LEU  81           HB1      LEU  81  86.171  -3.550 -10.261
  612   HD11  LEU  81          HD11      LEU  81  87.076  -2.126  -7.768
  613   HD12  LEU  81          HD12      LEU  81  85.487  -1.839  -7.058
  614   HD13  LEU  81          HD13      LEU  81  85.735  -1.603  -8.788
  615   HD21  LEU  81          HD21      LEU  81  83.900  -3.384  -9.421
  616   HD22  LEU  81          HD22      LEU  81  83.600  -3.175  -7.696
  617   HD23  LEU  81          HD23      LEU  81  83.818  -4.793  -8.363
  618    H    ALA  82           HN       ALA  82  84.048  -7.133  -8.922
  619    HA   ALA  82           HA       ALA  82  84.449  -7.306  -6.160
  620    HB1  ALA  82           HB1      ALA  82  83.633  -9.676  -7.854
  621    HB2  ALA  82           HB2      ALA  82  82.551  -8.322  -7.531
  622    HB3  ALA  82           HB3      ALA  82  83.146  -9.313  -6.199
  623    H    GLN  83           HN       GLN  83  86.327  -7.804  -5.128
  624    HA   GLN  83           HA       GLN  83  87.914 -10.119  -6.174
  625    HB2  GLN  83           HB2      GLN  83  89.907  -8.806  -5.121
  626    HB3  GLN  83           HB1      GLN  83  89.300  -8.300  -6.697
  627    HG2  GLN  83           HG2      GLN  83  87.914  -6.570  -5.624
  628    HG3  GLN  83           HG1      GLN  83  88.493  -7.082  -4.038
  629   HE21  GLN  83          HE21      GLN  83  91.196  -7.590  -5.688
  630   HE22  GLN  83          HE22      GLN  83  91.913  -6.051  -5.651
  631    H    TYR  84           HN       TYR  84  87.293  -8.108  -3.261
  632    HA   TYR  84           HA       TYR  84  86.570 -10.131  -1.511
  633    HD1  TYR  84           HD1      TYR  84  87.330 -11.374   0.761
  634    HD2  TYR  84           HD2      TYR  84  90.920  -9.284  -0.332
  635    HE1  TYR  84           HE1      TYR  84  87.966 -11.216   3.153
  636    HE2  TYR  84           HE2      TYR  84  91.556  -9.126   2.060
  637    HH   TYR  84           HH       TYR  84  90.930 -10.622   4.230
  638    HB2  TYR  84           HB2      TYR  84  88.461 -11.462  -1.641
  639    HB3  TYR  84           HB1      TYR  84  89.520 -10.102  -2.011
  640    H    GLY  85           HN       GLY  85  85.502  -8.439  -0.493
  641    HA2  GLY  85           HA2      GLY  85  85.823  -7.144   1.662
  642    HA3  GLY  85           HA1      GLY  85  87.228  -6.407   0.882
  643    H    ILE  86           HN       ILE  86  85.761  -6.458  -1.711
  644    HA   ILE  86           HA       ILE  86  84.486  -3.840  -1.453
  645    HB   ILE  86           HB       ILE  86  84.036  -4.497  -4.025
  646   HG12  ILE  86          HG12      ILE  86  85.787  -5.995  -4.850
  647   HG13  ILE  86          HG11      ILE  86  86.401  -6.218  -3.211
  648   HG21  ILE  86          HG21      ILE  86  86.339  -3.605  -4.509
  649   HG22  ILE  86          HG22      ILE  86  86.697  -3.737  -2.788
  650   HG23  ILE  86          HG23      ILE  86  85.435  -2.638  -3.344
  651   HD11  ILE  86          HD11      ILE  86  83.573  -6.920  -4.040
  652   HD12  ILE  86          HD12      ILE  86  84.375  -7.328  -2.522
  653   HD13  ILE  86          HD13      ILE  86  84.899  -8.083  -4.027
  654    H1U  RCY  87           H1U      RCY  87  76.071   1.553  -2.271
  655    H1S  RCY  87           H1S      RCY  87  78.665  -1.464  -4.136
  656    HB1  RCY  87           HB1      RCY  87  78.843  -4.457  -3.407
  657    HB2  RCY  87           HB2      RCY  87  80.049  -4.536  -4.691
  658    HA   RCY  87           HA       RCY  87  80.349  -5.316  -1.788
  659    HN1  RCY  87           HN1      RCY  87  82.476  -4.284  -3.513
  Start of MODEL   29
    1    HA   MET   1           HA       MET   1  57.973 -12.647  -9.820
    2    HB2  MET   1           HB2      MET   1  60.156 -11.560  -9.249
    3    HB3  MET   1           HB1      MET   1  59.278 -10.714 -10.523
    4    HG2  MET   1           HG2      MET   1  58.445  -9.075  -8.921
    5    HG3  MET   1           HG1      MET   1  59.192  -9.955  -7.588
    6    HE1  MET   1           HE1      MET   1  59.558  -8.431 -10.905
    7    HE2  MET   1           HE2      MET   1  61.034  -9.335 -11.234
    8    HE3  MET   1           HE3      MET   1  61.115  -7.597 -10.959
    9    H    ASN   2           HN       ASN   2  60.056 -12.418  -7.746
   10    HA   ASN   2           HA       ASN   2  58.485 -13.567  -5.521
   11    HB2  ASN   2           HB2      ASN   2  61.494 -13.311  -5.670
   12    HB3  ASN   2           HB1      ASN   2  60.543 -14.474  -4.746
   13   HD21  ASN   2          HD21      ASN   2  60.701 -16.505  -5.695
   14   HD22  ASN   2          HD22      ASN   2  60.714 -16.805  -7.366
   15    H    LEU   3           HN       LEU   3  57.855 -12.254  -3.882
   16    HA   LEU   3           HA       LEU   3  59.724 -10.383  -2.667
   17    HG   LEU   3           HG       LEU   3  56.270  -9.198  -3.049
   18    HB2  LEU   3           HB2      LEU   3  58.568  -8.330  -3.123
   19    HB3  LEU   3           HB1      LEU   3  58.829  -9.116  -4.678
   20   HD11  LEU   3          HD11      LEU   3  56.761  -7.045  -4.233
   21   HD12  LEU   3          HD12      LEU   3  55.333  -7.867  -4.860
   22   HD13  LEU   3          HD13      LEU   3  56.855  -7.943  -5.748
   23   HD21  LEU   3          HD21      LEU   3  56.329 -11.267  -4.161
   24   HD22  LEU   3          HD22      LEU   3  57.185 -10.602  -5.552
   25   HD23  LEU   3          HD23      LEU   3  55.476 -10.240  -5.313
   26    H    GLU   4           HN       GLU   4  58.806  -9.421  -0.696
   27    HA   GLU   4           HA       GLU   4  56.322 -10.801   0.245
   28    HB2  GLU   4           HB2      GLU   4  57.659 -10.640   2.555
   29    HB3  GLU   4           HB1      GLU   4  57.886 -12.007   1.464
   30    HG2  GLU   4           HG2      GLU   4  59.881 -11.039   0.533
   31    HG3  GLU   4           HG1      GLU   4  59.592  -9.508   1.360
   32    HA   PRO   5           HA       PRO   5  54.501  -7.019   1.569
   33    HB2  PRO   5           HB2      PRO   5  54.915  -8.053   4.359
   34    HB3  PRO   5           HB1      PRO   5  53.473  -7.310   3.640
   35    HG2  PRO   5           HG2      PRO   5  53.721  -9.966   3.947
   36    HG3  PRO   5           HG1      PRO   5  52.831  -9.242   2.599
   37    HD2  PRO   5           HD2      PRO   5  55.385 -10.702   2.550
   38    HD3  PRO   5           HD1      PRO   5  54.300 -10.295   1.204
   39    HA   PRO   6           HA       PRO   6  58.493  -5.088   2.718
   40    HB2  PRO   6           HB2      PRO   6  58.256  -2.880   1.164
   41    HB3  PRO   6           HB1      PRO   6  58.727  -4.457   0.501
   42    HG2  PRO   6           HG2      PRO   6  56.109  -3.065   0.381
   43    HG3  PRO   6           HG1      PRO   6  56.902  -4.091  -0.824
   44    HD2  PRO   6           HD2      PRO   6  54.860  -4.922   0.895
   45    HD3  PRO   6           HD1      PRO   6  55.972  -6.003   0.029
   46    H    LYS   7           HN       LYS   7  58.752  -3.813   4.508
   47    HA   LYS   7           HA       LYS   7  56.436  -2.230   5.460
   48    HB2  LYS   7           HB2      LYS   7  59.090  -2.867   6.789
   49    HB3  LYS   7           HB1      LYS   7  57.737  -2.037   7.555
   50    HG2  LYS   7           HG2      LYS   7  57.233  -4.174   8.239
   51    HG3  LYS   7           HG1      LYS   7  56.436  -4.220   6.666
   52    HD2  LYS   7           HD2      LYS   7  57.738  -6.148   6.562
   53    HD3  LYS   7           HD1      LYS   7  58.818  -4.969   5.817
   54    HE2  LYS   7           HE2      LYS   7  60.201  -6.035   7.396
   55    HE3  LYS   7           HE1      LYS   7  59.689  -4.570   8.234
   56    HZ1  LYS   7           HZ1      LYS   7  59.495  -6.876   9.388
   57    HZ2  LYS   7           HZ2      LYS   7  58.062  -7.001   8.483
   58    HZ3  LYS   7           HZ3      LYS   7  58.267  -5.722   9.582
   59    H    ALA   8           HN       ALA   8  56.447  -0.329   4.247
   60    HA   ALA   8           HA       ALA   8  58.554   1.601   4.904
   61    HB1  ALA   8           HB1      ALA   8  59.196   2.082   2.610
   62    HB2  ALA   8           HB2      ALA   8  58.046   0.892   1.999
   63    HB3  ALA   8           HB3      ALA   8  59.459   0.365   2.914
   64    H    GLU   9           HN       GLU   9  57.548   2.955   2.252
   65    HA   GLU   9           HA       GLU   9  54.741   3.487   2.751
   66    HB2  GLU   9           HB2      GLU   9  55.132   5.931   3.339
   67    HB3  GLU   9           HB1      GLU   9  55.521   4.781   4.618
   68    HG2  GLU   9           HG2      GLU   9  57.616   5.729   2.661
   69    HG3  GLU   9           HG1      GLU   9  57.256   6.628   4.136
   70    H1U  RCY  10           H1U      RCY  10  56.156  -0.596   0.704
   71    H1S  RCY  10           H1S      RCY  10  54.926   2.966  -1.187
   72    HB1  RCY  10           HB1      RCY  10  53.357   6.120  -2.237
   73    HB2  RCY  10           HB2      RCY  10  52.666   6.016  -0.618
   74    HA   RCY  10           HA       RCY  10  55.440   5.013  -1.311
   75    HN1  RCY  10           HN1      RCY  10  53.895   5.075   1.190
   76    H    ARG  11           HN       ARG  11  54.148   7.584  -2.204
   77    HA   ARG  11           HA       ARG  11  54.753   9.843  -2.340
   78    HE   ARG  11           HE       ARG  11  55.070  10.693   1.954
   79    HB2  ARG  11           HB2      ARG  11  55.647   9.667   0.538
   80    HB3  ARG  11           HB1      ARG  11  54.926  11.035  -0.310
   81    HG2  ARG  11           HG2      ARG  11  52.846   9.543  -0.591
   82    HG3  ARG  11           HG1      ARG  11  53.577   8.502   0.630
   83    HD2  ARG  11           HD2      ARG  11  52.615  11.341   0.907
   84    HD3  ARG  11           HD1      ARG  11  52.244   9.944   1.918
   85   HH11  ARG  11          HH21      ARG  11  51.911  11.158   3.253
   86   HH12  ARG  11          HH22      ARG  11  52.480  11.746   4.779
   87   HH21  ARG  11          HH11      ARG  11  55.832  11.458   3.939
   88   HH22  ARG  11          HH12      ARG  11  54.700  11.916   5.168
   89    H    SER  12           HN       SER  12  56.806   7.488  -2.435
   90    HA   SER  12           HA       SER  12  59.293   9.027  -1.889
   91    HG   SER  12           HG       SER  12  61.110   6.015  -2.115
   92    HB2  SER  12           HB2      SER  12  59.173   6.689  -1.085
   93    HB3  SER  12           HB1      SER  12  58.904   6.138  -2.736
   94    H    ALA  13           HN       ALA  13  61.047   8.630  -3.675
   95    HA   ALA  13           HA       ALA  13  61.715   9.171  -5.859
   96    HB1  ALA  13           HB1      ALA  13  60.720   6.863  -6.172
   97    HB2  ALA  13           HB2      ALA  13  60.685   7.878  -7.614
   98    HB3  ALA  13           HB3      ALA  13  59.220   7.651  -6.660
   99    H    THR  14           HN       THR  14  60.179  11.164  -4.551
  100    HA   THR  14           HA       THR  14  58.224  12.135  -6.551
  101    HB   THR  14           HB       THR  14  59.121  13.318  -3.905
  102    HG1  THR  14           HG1      THR  14  57.959  11.384  -3.702
  103   HG21  THR  14          HG21      THR  14  57.008  14.112  -5.913
  104   HG22  THR  14          HG22      THR  14  58.302  15.107  -5.245
  105   HG23  THR  14          HG23      THR  14  56.944  14.627  -4.228
  106    H    ARG  15           HN       ARG  15  61.325  13.143  -5.100
  107    HA   ARG  15           HA       ARG  15  62.013  14.540  -7.594
  108    HE   ARG  15           HE       ARG  15  60.570  18.714  -5.222
  109    HB2  ARG  15           HB2      ARG  15  60.665  16.167  -6.141
  110    HB3  ARG  15           HB1      ARG  15  62.024  16.122  -5.017
  111    HG2  ARG  15           HG2      ARG  15  63.505  16.702  -7.031
  112    HG3  ARG  15           HG1      ARG  15  62.008  17.088  -7.880
  113    HD2  ARG  15           HD2      ARG  15  62.908  18.322  -5.259
  114    HD3  ARG  15           HD1      ARG  15  62.982  19.105  -6.838
  115   HH11  ARG  15          HH21      ARG  15  61.966  19.239  -8.330
  116   HH12  ARG  15          HH22      ARG  15  60.537  19.954  -8.999
  117   HH21  ARG  15          HH11      ARG  15  58.695  19.644  -6.077
  118   HH22  ARG  15          HH12      ARG  15  58.685  20.183  -7.723
  119    H    VAL  16           HN       VAL  16  63.149  14.924  -4.237
  120    HA   VAL  16           HA       VAL  16  65.347  14.774  -3.413
  121    HB   VAL  16           HB       VAL  16  64.443  12.443  -3.257
  122   HG11  VAL  16          HG11      VAL  16  65.417  10.826  -4.985
  123   HG12  VAL  16          HG12      VAL  16  65.771  12.247  -5.968
  124   HG13  VAL  16          HG13      VAL  16  64.103  11.859  -5.547
  125   HG21  VAL  16          HG21      VAL  16  66.474  11.593  -2.552
  126   HG22  VAL  16          HG22      VAL  16  66.931  13.286  -2.740
  127   HG23  VAL  16          HG23      VAL  16  67.318  12.122  -4.007
  128    H    MET  17           HN       MET  17  67.698  13.769  -4.251
  129    HA   MET  17           HA       MET  17  69.510  14.348  -5.627
  130    HB2  MET  17           HB2      MET  17  67.355  13.781  -7.682
  131    HB3  MET  17           HB1      MET  17  69.049  14.048  -8.096
  132    HG2  MET  17           HG2      MET  17  68.098  11.923  -6.156
  133    HG3  MET  17           HG1      MET  17  68.443  11.620  -7.859
  134    HE1  MET  17           HE1      MET  17  70.046  10.276  -5.078
  135    HE2  MET  17           HE2      MET  17  71.387   9.911  -6.160
  136    HE3  MET  17           HE3      MET  17  69.731   9.784  -6.746
  137    H    GLY  18           HN       GLY  18  67.829  16.525  -4.621
  138    HA2  GLY  18           HA2      GLY  18  68.929  18.771  -5.731
  139    HA3  GLY  18           HA1      GLY  18  67.576  18.451  -6.815
  140    H    GLY  19           HN       GLY  19  68.478  19.446  -3.586
  141    HA2  GLY  19           HA2      GLY  19  66.474  21.182  -3.011
  142    HA3  GLY  19           HA1      GLY  19  65.680  19.639  -2.694
  143    HA   PRO  20           HA       PRO  20  67.980  21.426   1.119
  144    HB2  PRO  20           HB2      PRO  20  65.432  20.270   2.203
  145    HB3  PRO  20           HB1      PRO  20  66.304  21.735   2.697
  146    HG2  PRO  20           HG2      PRO  20  64.107  21.859   1.198
  147    HG3  PRO  20           HG1      PRO  20  65.456  22.983   0.966
  148    HD2  PRO  20           HD2      PRO  20  64.590  20.713  -0.751
  149    HD3  PRO  20           HD1      PRO  20  65.466  22.194  -1.194
  150    H1U  RCY  21           H1U      RCY  21  65.586  12.492  -0.208
  151    H1S  RCY  21           H1S      RCY  21  69.158  14.951   1.423
  152    HB1  RCY  21           HB1      RCY  21  71.600  17.501   1.600
  153    HB2  RCY  21           HB2      RCY  21  70.948  18.161   0.101
  154    HA   RCY  21           HA       RCY  21  68.761  16.880   1.267
  155    HN1  RCY  21           HN1      RCY  21  69.470  19.600   0.634
  156    H    THR  22           HN       THR  22  68.030  16.484   3.323
  157    HA   THR  22           HA       THR  22  68.874  17.882   5.663
  158    HB   THR  22           HB       THR  22  66.774  16.599   5.564
  159    HG1  THR  22           HG1      THR  22  67.915  16.920   7.576
  160   HG21  THR  22          HG21      THR  22  66.677  14.299   5.248
  161   HG22  THR  22          HG22      THR  22  68.321  14.046   5.834
  162   HG23  THR  22          HG23      THR  22  68.052  14.716   4.225
  163    HA   PRO  23           HA       PRO  23  73.079  16.204   5.865
  164    HB2  PRO  23           HB2      PRO  23  72.618  16.938   8.738
  165    HB3  PRO  23           HB1      PRO  23  74.020  17.272   7.701
  166    HG2  PRO  23           HG2      PRO  23  72.213  19.153   8.257
  167    HG3  PRO  23           HG1      PRO  23  72.999  19.058   6.673
  168    HD2  PRO  23           HD2      PRO  23  70.198  18.392   7.416
  169    HD3  PRO  23           HD1      PRO  23  70.860  18.893   5.845
  170    H    ARG  24           HN       ARG  24  74.158  14.437   7.137
  171    HA   ARG  24           HA       ARG  24  72.395  12.191   7.507
  172    HE   ARG  24           HE       ARG  24  73.505  11.729   5.155
  173    HB2  ARG  24           HB2      ARG  24  75.000  12.337   6.964
  174    HB3  ARG  24           HB1      ARG  24  75.141  12.222   8.717
  175    HG2  ARG  24           HG2      ARG  24  75.069   9.971   8.288
  176    HG3  ARG  24           HG1      ARG  24  73.328  10.256   8.277
  177    HD2  ARG  24           HD2      ARG  24  75.173  10.174   5.874
  178    HD3  ARG  24           HD1      ARG  24  73.895   9.024   6.270
  179   HH11  ARG  24          HH21      ARG  24  72.227   8.891   6.639
  180   HH12  ARG  24          HH22      ARG  24  70.602   9.190   6.120
  181   HH21  ARG  24          HH11      ARG  24  71.390  12.135   4.468
  182   HH22  ARG  24          HH12      ARG  24  70.128  11.027   4.891
  183    H    LYS  25           HN       LYS  25  71.899  11.090   9.509
  184    HA   LYS  25           HA       LYS  25  71.499  12.940  11.748
  185    HB2  LYS  25           HB2      LYS  25  70.575  10.727  12.807
  186    HB3  LYS  25           HB1      LYS  25  69.673  11.494  11.500
  187    HG2  LYS  25           HG2      LYS  25  71.782   9.567  10.677
  188    HG3  LYS  25           HG1      LYS  25  70.361   8.877  11.462
  189    HD2  LYS  25           HD2      LYS  25  68.885   9.831   9.834
  190    HD3  LYS  25           HD1      LYS  25  70.170  10.839   9.166
  191    HE2  LYS  25           HE2      LYS  25  69.782   8.896   7.715
  192    HE3  LYS  25           HE1      LYS  25  71.381   8.796   8.452
  193    HZ1  LYS  25           HZ1      LYS  25  70.784   7.058   9.743
  194    HZ2  LYS  25           HZ2      LYS  25  69.674   6.791   8.486
  195    HZ3  LYS  25           HZ3      LYS  25  69.176   7.571   9.910
  196    H    GLY  26           HN       GLY  26  73.706  13.344  12.375
  197    HA2  GLY  26           HA2      GLY  26  74.725  11.967  14.535
  198    HA3  GLY  26           HA1      GLY  26  75.443  11.134  13.155
  199    HA   PRO  27           HA       PRO  27  78.089  14.814  14.592
  200    HB2  PRO  27           HB2      PRO  27  80.096  12.746  13.778
  201    HB3  PRO  27           HB1      PRO  27  80.126  13.862  15.157
  202    HG2  PRO  27           HG2      PRO  27  79.541  11.282  15.463
  203    HG3  PRO  27           HG1      PRO  27  78.751  12.538  16.431
  204    HD2  PRO  27           HD2      PRO  27  77.641  10.920  14.187
  205    HD3  PRO  27           HD1      PRO  27  76.806  11.644  15.578
  206    HA   PRO  28           HA       PRO  28  78.807  16.631  10.623
  207    HB2  PRO  28           HB2      PRO  28  81.722  16.616  11.342
  208    HB3  PRO  28           HB1      PRO  28  80.731  17.936  10.688
  209    HG2  PRO  28           HG2      PRO  28  81.389  17.806  13.278
  210    HG3  PRO  28           HG1      PRO  28  79.836  18.458  12.731
  211    HD2  PRO  28           HD2      PRO  28  80.395  15.921  14.147
  212    HD3  PRO  28           HD1      PRO  28  78.873  16.829  14.021
  213    H    LYS  29           HN       LYS  29  78.907  15.602   8.665
  214    HA   LYS  29           HA       LYS  29  79.419  13.970   7.065
  215    HB2  LYS  29           HB2      LYS  29  81.862  15.099   8.039
  216    HB3  LYS  29           HB1      LYS  29  82.139  13.378   7.799
  217    HG2  LYS  29           HG2      LYS  29  82.620  14.399   5.696
  218    HG3  LYS  29           HG1      LYS  29  81.028  13.662   5.510
  219    HD2  LYS  29           HD2      LYS  29  79.915  15.746   5.717
  220    HD3  LYS  29           HD1      LYS  29  81.350  16.538   6.371
  221    HE2  LYS  29           HE2      LYS  29  80.690  16.875   3.834
  222    HE3  LYS  29           HE1      LYS  29  82.382  16.690   4.294
  223    HZ1  LYS  29           HZ1      LYS  29  80.782  14.303   3.681
  224    HZ2  LYS  29           HZ2      LYS  29  82.456  14.548   3.525
  225    HZ3  LYS  29           HZ3      LYS  29  81.385  15.244   2.405
  226    H1U  RCY  30           H1U      RCY  30  81.488  15.269   4.199
  227    H1S  RCY  30           H1S      RCY  30  80.011  11.120   6.271
  228    HB1  RCY  30           HB1      RCY  30  79.651   9.661   8.630
  229    HB2  RCY  30           HB2      RCY  30  81.015   8.760   9.290
  230    HA   RCY  30           HA       RCY  30  80.067  10.764  10.667
  231    HN1  RCY  30           HN1      RCY  30  81.721  12.714   9.451
  232    H    LYS  31           HN       LYS  31  82.793   9.201   9.379
  233    HA   LYS  31           HA       LYS  31  84.583  10.189  11.546
  234    HB2  LYS  31           HB2      LYS  31  83.870   7.281  11.043
  235    HB3  LYS  31           HB1      LYS  31  85.171   7.822  12.101
  236    HG2  LYS  31           HG2      LYS  31  83.544   7.736  13.707
  237    HG3  LYS  31           HG1      LYS  31  83.116   9.322  13.064
  238    HD2  LYS  31           HD2      LYS  31  81.544   8.187  11.471
  239    HD3  LYS  31           HD1      LYS  31  81.891   6.661  12.285
  240    HE2  LYS  31           HE2      LYS  31  80.839   9.122  13.706
  241    HE3  LYS  31           HE1      LYS  31  79.811   7.814  13.119
  242    HZ1  LYS  31           HZ1      LYS  31  82.026   6.841  14.631
  243    HZ2  LYS  31           HZ2      LYS  31  80.365   6.545  14.834
  244    HZ3  LYS  31           HZ3      LYS  31  81.079   7.917  15.538
  245    H    GLN  32           HN       GLN  32  86.767   8.700  11.196
  246    HA   GLN  32           HA       GLN  32  87.568   9.338   8.425
  247    HB2  GLN  32           HB2      GLN  32  88.970   9.970  10.440
  248    HB3  GLN  32           HB1      GLN  32  89.293   8.250  10.658
  249    HG2  GLN  32           HG2      GLN  32  90.070   8.242   8.215
  250    HG3  GLN  32           HG1      GLN  32  90.057  10.003   8.318
  251   HE21  GLN  32          HE21      GLN  32  92.338   7.861   8.213
  252   HE22  GLN  32          HE22      GLN  32  93.369   8.337   9.474
  253    H    ARG  33           HN       ARG  33  88.592   6.629  10.449
  254    HA   ARG  33           HA       ARG  33  88.833   4.352   9.944
  255    HE   ARG  33           HE       ARG  33  84.679   3.824  12.304
  256    HB2  ARG  33           HB2      ARG  33  86.400   4.911   8.216
  257    HB3  ARG  33           HB1      ARG  33  86.965   3.316   8.713
  258    HG2  ARG  33           HG2      ARG  33  86.679   3.991  11.094
  259    HG3  ARG  33           HG1      ARG  33  86.020   5.535  10.552
  260    HD2  ARG  33           HD2      ARG  33  84.116   4.505   9.577
  261    HD3  ARG  33           HD1      ARG  33  84.851   2.903   9.641
  262   HH11  ARG  33          HH21      ARG  33  82.642   3.068   9.627
  263   HH12  ARG  33          HH22      ARG  33  81.305   2.575  10.612
  264   HH21  ARG  33          HH11      ARG  33  82.945   3.184  13.606
  265   HH22  ARG  33          HH12      ARG  33  81.477   2.640  12.865
  266    H    GLN  34           HN       GLN  34  89.441   2.855   8.164
  267    HA   GLN  34           HA       GLN  34  89.800   3.869   5.475
  268    HB2  GLN  34           HB2      GLN  34  91.592   5.093   6.809
  269    HB3  GLN  34           HB1      GLN  34  92.334   3.518   7.090
  270    HG2  GLN  34           HG2      GLN  34  92.563   3.155   4.685
  271    HG3  GLN  34           HG1      GLN  34  91.730   4.675   4.352
  272   HE21  GLN  34          HE21      GLN  34  93.068   6.111   6.601
  273   HE22  GLN  34          HE22      GLN  34  94.670   6.365   6.102
  274    H    THR  35           HN       THR  35  90.869   1.568   7.947
  275    HA   THR  35           HA       THR  35  91.159  -0.755   7.836
  276    HB   THR  35           HB       THR  35  89.767  -0.723   5.159
  277    HG1  THR  35           HG1      THR  35  88.331   0.427   6.228
  278   HG21  THR  35          HG21      THR  35  89.000  -2.878   5.822
  279   HG22  THR  35          HG22      THR  35  89.456  -2.604   7.503
  280   HG23  THR  35          HG23      THR  35  90.703  -2.827   6.276
  281    H    ARG  36           HN       ARG  36  92.317   1.372   5.464
  282    HA   ARG  36           HA       ARG  36  94.159   1.285   4.030
  283    HE   ARG  36           HE       ARG  36  93.488  -0.050   7.692
  284    HB2  ARG  36           HB2      ARG  36  94.835  -1.120   5.751
  285    HB3  ARG  36           HB1      ARG  36  95.940  -0.348   4.616
  286    HG2  ARG  36           HG2      ARG  36  96.410   1.318   6.068
  287    HG3  ARG  36           HG1      ARG  36  94.701   1.592   6.410
  288    HD2  ARG  36           HD2      ARG  36  96.193  -0.766   7.566
  289    HD3  ARG  36           HD1      ARG  36  96.160   0.801   8.376
  290   HH11  ARG  36          HH21      ARG  36  96.137  -0.539   9.844
  291   HH12  ARG  36          HH22      ARG  36  95.145  -1.080  11.156
  292   HH21  ARG  36          HH11      ARG  36  92.176  -0.754   9.393
  293   HH22  ARG  36          HH12      ARG  36  92.902  -1.202  10.901
  294    H    GLN  37           HN       GLN  37  92.051  -1.442   4.314
  295    HA   GLN  37           HA       GLN  37  92.051  -1.918   1.497
  296    HB2  GLN  37           HB2      GLN  37  94.294  -3.017   2.614
  297    HB3  GLN  37           HB1      GLN  37  93.164  -4.359   2.770
  298    HG2  GLN  37           HG2      GLN  37  94.110  -4.677   0.631
  299    HG3  GLN  37           HG1      GLN  37  92.573  -3.882   0.291
  300   HE21  GLN  37          HE21      GLN  37  92.626  -1.733  -0.578
  301   HE22  GLN  37          HE22      GLN  37  94.072  -0.950  -1.001
  302    H1U  RCY  38           H1U      RCY  38  81.681  -2.516  -0.058
  303    H1S  RCY  38           H1S      RCY  38  84.948  -4.965  -0.283
  304    HB1  RCY  38           HB1      RCY  38  88.127  -2.792   1.366
  305    HB2  RCY  38           HB2      RCY  38  87.071  -3.709   2.437
  306    HA   RCY  38           HA       RCY  38  88.948  -4.666   3.268
  307    HN1  RCY  38           HN1      RCY  38  90.597  -3.753   0.948
  308    H    LYS  39           HN       LYS  39  91.002  -5.671   1.027
  309    HA   LYS  39           HA       LYS  39  91.444  -7.854   0.255
  310    HB2  LYS  39           HB2      LYS  39  89.698  -8.376   2.251
  311    HB3  LYS  39           HB1      LYS  39  88.705  -8.857   0.880
  312    HG2  LYS  39           HG2      LYS  39  89.842 -10.843   1.340
  313    HG3  LYS  39           HG1      LYS  39  90.883 -10.123   0.112
  314    HD2  LYS  39           HD2      LYS  39  92.275 -10.876   1.955
  315    HD3  LYS  39           HD1      LYS  39  92.258  -9.113   1.949
  316    HE2  LYS  39           HE2      LYS  39  91.747 -10.610   4.163
  317    HE3  LYS  39           HE1      LYS  39  91.105  -8.986   3.915
  318    HZ1  LYS  39           HZ1      LYS  39  89.385 -10.609   4.517
  319    HZ2  LYS  39           HZ2      LYS  39  89.731 -11.491   3.107
  320    HZ3  LYS  39           HZ3      LYS  39  89.107  -9.915   2.994
  321    H    SER  40           HN       SER  40  91.363  -8.367  -1.881
  322    HA   SER  40           HA       SER  40  89.373  -7.092  -3.583
  323    HG   SER  40           HG       SER  40  92.259  -6.792  -4.944
  324    HB2  SER  40           HB2      SER  40  91.407  -9.192  -4.371
  325    HB3  SER  40           HB1      SER  40  90.624  -8.015  -5.422
  326    H    LYS  41           HN       LYS  41  89.743 -10.212  -2.087
  327    HA   LYS  41           HA       LYS  41  87.149 -11.025  -3.238
  328    HB2  LYS  41           HB2      LYS  41  89.489 -11.955  -4.378
  329    HB3  LYS  41           HB1      LYS  41  89.119 -13.226  -3.220
  330    HG2  LYS  41           HG2      LYS  41  87.152 -12.126  -5.249
  331    HG3  LYS  41           HG1      LYS  41  88.058 -13.627  -5.443
  332    HD2  LYS  41           HD2      LYS  41  86.432 -13.202  -2.955
  333    HD3  LYS  41           HD1      LYS  41  85.625 -13.698  -4.443
  334    HE2  LYS  41           HE2      LYS  41  87.928 -15.138  -3.094
  335    HE3  LYS  41           HE1      LYS  41  86.250 -15.679  -3.146
  336    HZ1  LYS  41           HZ1      LYS  41  88.293 -15.807  -5.182
  337    HZ2  LYS  41           HZ2      LYS  41  86.785 -15.263  -5.742
  338    HZ3  LYS  41           HZ3      LYS  41  86.913 -16.769  -4.966
  339    HA   PRO  42           HA       PRO  42  87.622 -12.182   1.190
  340    HB2  PRO  42           HB2      PRO  42  85.432 -10.908   2.140
  341    HB3  PRO  42           HB1      PRO  42  86.956 -10.054   1.833
  342    HG2  PRO  42           HG2      PRO  42  84.455 -10.080   0.247
  343    HG3  PRO  42           HG1      PRO  42  85.632  -8.780   0.484
  344    HD2  PRO  42           HD2      PRO  42  85.467 -10.461  -1.771
  345    HD3  PRO  42           HD1      PRO  42  86.834  -9.405  -1.356
  346    HA   PRO  43           HA       PRO  43  84.701 -15.530   0.886
  347    HB2  PRO  43           HB2      PRO  43  84.548 -16.324   3.488
  348    HB3  PRO  43           HB1      PRO  43  85.993 -16.588   2.492
  349    HG2  PRO  43           HG2      PRO  43  85.474 -14.489   4.538
  350    HG3  PRO  43           HG1      PRO  43  86.951 -15.413   4.217
  351    HD2  PRO  43           HD2      PRO  43  86.565 -12.834   3.342
  352    HD3  PRO  43           HD1      PRO  43  87.625 -14.000   2.518
  353    H    LYS  44           HN       LYS  44  82.518 -15.329   0.580
  354    HA   LYS  44           HA       LYS  44  80.676 -14.775   2.693
  355    HB2  LYS  44           HB2      LYS  44  79.828 -12.560   1.788
  356    HB3  LYS  44           HB1      LYS  44  81.389 -12.480   2.603
  357    HG2  LYS  44           HG2      LYS  44  82.500 -12.699   0.358
  358    HG3  LYS  44           HG1      LYS  44  80.906 -12.573  -0.387
  359    HD2  LYS  44           HD2      LYS  44  80.636 -10.391   0.940
  360    HD3  LYS  44           HD1      LYS  44  82.371 -10.490   1.238
  361    HE2  LYS  44           HE2      LYS  44  82.245  -9.185  -0.716
  362    HE3  LYS  44           HE1      LYS  44  82.566 -10.803  -1.338
  363    HZ1  LYS  44           HZ1      LYS  44  80.700 -10.655  -2.492
  364    HZ2  LYS  44           HZ2      LYS  44  80.337  -9.145  -1.804
  365    HZ3  LYS  44           HZ3      LYS  44  79.816 -10.573  -1.046
  366    H    LYS  45           HN       LYS  45  81.339 -14.766  -0.776
  367    HA   LYS  45           HA       LYS  45  78.772 -14.834  -1.857
  368    HB2  LYS  45           HB2      LYS  45  81.383 -16.056  -2.602
  369    HB3  LYS  45           HB1      LYS  45  79.959 -16.742  -3.382
  370    HG2  LYS  45           HG2      LYS  45  80.307 -13.756  -3.262
  371    HG3  LYS  45           HG1      LYS  45  81.152 -14.692  -4.496
  372    HD2  LYS  45           HD2      LYS  45  78.225 -15.178  -4.072
  373    HD3  LYS  45           HD1      LYS  45  78.727 -13.745  -4.970
  374    HE2  LYS  45           HE2      LYS  45  79.911 -16.421  -5.657
  375    HE3  LYS  45           HE1      LYS  45  78.313 -15.989  -6.266
  376    HZ1  LYS  45           HZ1      LYS  45  79.514 -15.054  -7.902
  377    HZ2  LYS  45           HZ2      LYS  45  80.917 -14.907  -6.955
  378    HZ3  LYS  45           HZ3      LYS  45  79.666 -13.767  -6.807
  379    H    GLY  46           HN       GLY  46  77.078 -15.971  -1.044
  380    HA2  GLY  46           HA2      GLY  46  76.537 -18.611  -1.267
  381    HA3  GLY  46           HA1      GLY  46  77.514 -18.607   0.203
  382    H    VAL  47           HN       VAL  47  75.337 -15.995  -0.733
  383    HA   VAL  47           HA       VAL  47  73.476 -15.102   0.375
  384    HB   VAL  47           HB       VAL  47  72.945 -17.943   1.269
  385   HG11  VAL  47          HG11      VAL  47  70.630 -17.248   1.224
  386   HG12  VAL  47          HG12      VAL  47  71.057 -15.707   0.481
  387   HG13  VAL  47          HG13      VAL  47  71.531 -16.045   2.146
  388   HG21  VAL  47          HG21      VAL  47  73.406 -18.072  -1.096
  389   HG22  VAL  47          HG22      VAL  47  72.465 -16.614  -1.413
  390   HG23  VAL  47          HG23      VAL  47  71.653 -18.096  -0.907
  391    H    GLN  48           HN       GLN  48  74.024 -17.785   2.648
  392    HA   GLN  48           HA       GLN  48  73.813 -16.187   4.969
  393    HB2  GLN  48           HB2      GLN  48  73.799 -18.746   4.790
  394    HB3  GLN  48           HB1      GLN  48  75.560 -18.648   4.786
  395    HG2  GLN  48           HG2      GLN  48  74.954 -18.963   7.069
  396    HG3  GLN  48           HG1      GLN  48  75.338 -17.247   6.920
  397   HE21  GLN  48          HE21      GLN  48  72.654 -19.557   7.248
  398   HE22  GLN  48          HE22      GLN  48  71.487 -18.400   7.672
  399    H    GLY  49           HN       GLY  49  75.070 -14.348   5.104
  400    HA2  GLY  49           HA2      GLY  49  77.802 -14.539   5.861
  401    HA3  GLY  49           HA1      GLY  49  77.745 -14.096   4.154
  402    H1U  RCY  50           H1U      RCY  50  79.262  -5.062   6.889
  403    H1S  RCY  50           H1S      RCY  50  77.028  -8.474   6.729
  404    HB1  RCY  50           HB1      RCY  50  75.611 -11.437   8.253
  405    HB2  RCY  50           HB2      RCY  50  75.089 -10.682   6.747
  406    HA   RCY  50           HA       RCY  50  77.335 -10.105   6.151
  407    HN1  RCY  50           HN1      RCY  50  78.016 -12.760   7.124
  408    H    GLY  51           HN       GLY  51  79.722 -10.312   6.772
  409    HA2  GLY  51           HA2      GLY  51  81.461  -9.720   8.232
  410    HA3  GLY  51           HA1      GLY  51  80.230  -8.889   9.185
  411    H    ASP  52           HN       ASP  52  78.974 -10.236  10.724
  412    HA   ASP  52           HA       ASP  52  80.164 -12.854  11.418
  413    HB2  ASP  52           HB2      ASP  52  80.316 -12.026  13.860
  414    HB3  ASP  52           HB1      ASP  52  81.584 -11.504  12.752
  415    H    ASP  53           HN       ASP  53  78.183 -10.571  13.312
  416    HA   ASP  53           HA       ASP  53  75.715 -12.011  12.712
  417    HB2  ASP  53           HB2      ASP  53  75.356 -12.705  15.110
  418    HB3  ASP  53           HB1      ASP  53  76.634 -13.602  14.289
  419    H    ILE  54           HN       ILE  54  76.270  -9.347  12.372
  420    HA   ILE  54           HA       ILE  54  74.860  -8.014  14.655
  421    HB   ILE  54           HB       ILE  54  76.768  -6.836  12.616
  422   HG12  ILE  54          HG12      ILE  54  77.086  -7.155  15.614
  423   HG13  ILE  54          HG11      ILE  54  77.752  -8.293  14.441
  424   HG21  ILE  54          HG21      ILE  54  75.162  -5.155  13.186
  425   HG22  ILE  54          HG22      ILE  54  76.578  -4.831  14.186
  426   HG23  ILE  54          HG23      ILE  54  75.168  -5.629  14.884
  427   HD11  ILE  54          HD11      ILE  54  79.388  -6.529  15.184
  428   HD12  ILE  54          HD12      ILE  54  78.346  -5.321  14.430
  429   HD13  ILE  54          HD13      ILE  54  79.117  -6.562  13.441
  430    HA   PRO  55           HA       PRO  55  71.920  -7.660  11.179
  431    HB2  PRO  55           HB2      PRO  55  69.648  -7.717  12.650
  432    HB3  PRO  55           HB1      PRO  55  70.574  -9.187  12.289
  433    HG2  PRO  55           HG2      PRO  55  70.460  -7.599  14.795
  434    HG3  PRO  55           HG1      PRO  55  70.597  -9.349  14.570
  435    HD2  PRO  55           HD2      PRO  55  72.726  -7.635  15.165
  436    HD3  PRO  55           HD1      PRO  55  72.886  -9.271  14.489
  437    H    GLY  56           HN       GLY  56  73.127  -5.360  11.472
  438    HA2  GLY  56           HA2      GLY  56  72.690  -3.055  11.220
  439    HA3  GLY  56           HA1      GLY  56  70.989  -3.383  11.554
  440    H    MET  57           HN       MET  57  74.129  -2.781  13.050
  441    HA   MET  57           HA       MET  57  73.256  -2.915  15.776
  442    HB2  MET  57           HB2      MET  57  75.666  -2.794  14.870
  443    HB3  MET  57           HB1      MET  57  75.410  -1.053  14.760
  444    HG2  MET  57           HG2      MET  57  74.693  -1.133  17.206
  445    HG3  MET  57           HG1      MET  57  75.314  -2.784  17.240
  446    HE1  MET  57           HE1      MET  57  76.608  -1.902  19.233
  447    HE2  MET  57           HE2      MET  57  78.332  -1.635  18.991
  448    HE3  MET  57           HE3      MET  57  77.576  -3.093  18.355
  449    H    GLU  58           HN       GLU  58  73.060  -0.417  13.319
  450    HA   GLU  58           HA       GLU  58  71.152   1.070  14.976
  451    HB2  GLU  58           HB2      GLU  58  73.955   1.875  14.757
  452    HB3  GLU  58           HB1      GLU  58  72.874   3.132  14.158
  453    HG2  GLU  58           HG2      GLU  58  72.549   1.744  16.834
  454    HG3  GLU  58           HG1      GLU  58  73.332   3.310  16.619
  455    H    GLY  59           HN       GLY  59  71.073   3.422  13.465
  456    HA2  GLY  59           HA2      GLY  59  69.510   2.781  11.258
  457    HA3  GLY  59           HA1      GLY  59  70.433   4.281  11.365
  458    H1U  RCY  60           H1U      RCY  60  74.834   2.698   4.839
  459    H1S  RCY  60           H1S      RCY  60  74.237   2.582   8.816
  460    HB1  RCY  60           HB1      RCY  60  73.361  -0.507   8.317
  461    HB2  RCY  60           HB2      RCY  60  72.297  -0.685   9.712
  462    HA   RCY  60           HA       RCY  60  72.549   1.898   8.150
  463    HN1  RCY  60           HN1      RCY  60  70.258   1.162   9.889
  464    H    GLY  61           HN       GLY  61  69.888   2.081   7.433
  465    HA2  GLY  61           HA2      GLY  61  68.372   1.365   5.792
  466    HA3  GLY  61           HA1      GLY  61  69.744   0.523   5.070
  467    H    THR  62           HN       THR  62  68.520  -0.108   8.320
  468    HA   THR  62           HA       THR  62  68.338  -2.944   7.786
  469    HB   THR  62           HB       THR  62  67.821  -3.168  10.054
  470    HG1  THR  62           HG1      THR  62  66.306  -2.019  10.925
  471   HG21  THR  62          HG21      THR  62  68.996  -0.383  10.052
  472   HG22  THR  62          HG22      THR  62  69.937  -1.811   9.619
  473   HG23  THR  62          HG23      THR  62  69.250  -1.665  11.236
  474    H    ASP  63           HN       ASP  63  66.226  -0.311   7.249
  475    HA   ASP  63           HA       ASP  63  63.666  -1.358   7.659
  476    HB2  ASP  63           HB2      ASP  63  64.215   0.930   6.743
  477    HB3  ASP  63           HB1      ASP  63  64.520   0.169   5.181
  478    H    ILE  64           HN       ILE  64  66.133  -2.521   5.588
  479    HA   ILE  64           HA       ILE  64  64.227  -4.516   4.464
  480    HB   ILE  64           HB       ILE  64  66.255  -2.919   2.893
  481   HG12  ILE  64          HG12      ILE  64  63.760  -2.189   3.387
  482   HG13  ILE  64          HG11      ILE  64  64.428  -2.014   1.764
  483   HG21  ILE  64          HG21      ILE  64  65.287  -4.431   0.996
  484   HG22  ILE  64          HG22      ILE  64  64.863  -5.525   2.312
  485   HG23  ILE  64          HG23      ILE  64  66.549  -5.086   2.039
  486   HD11  ILE  64          HD11      ILE  64  62.106  -3.169   2.032
  487   HD12  ILE  64          HD12      ILE  64  63.043  -4.562   2.574
  488   HD13  ILE  64          HD13      ILE  64  63.294  -3.906   0.956
  489    H    THR  65           HN       THR  65  67.610  -3.622   5.037
  490    HA   THR  65           HA       THR  65  69.418  -4.948   5.692
  491    HB   THR  65           HB       THR  65  67.519  -7.244   6.140
  492    HG1  THR  65           HG1      THR  65  67.731  -5.836   8.338
  493   HG21  THR  65          HG21      THR  65  70.055  -7.369   6.480
  494   HG22  THR  65          HG22      THR  65  69.058  -7.845   7.855
  495   HG23  THR  65          HG23      THR  65  69.822  -6.255   7.828
  496    H    VAL  66           HN       VAL  66  67.350  -7.549   4.379
  497    HA   VAL  66           HA       VAL  66  69.314  -8.878   2.945
  498    HB   VAL  66           HB       VAL  66  67.179  -9.120   1.216
  499   HG11  VAL  66          HG11      VAL  66  68.343 -10.951   2.376
  500   HG12  VAL  66          HG12      VAL  66  66.598 -11.112   2.570
  501   HG13  VAL  66          HG13      VAL  66  67.579 -10.487   3.896
  502   HG21  VAL  66          HG21      VAL  66  66.002  -8.661   3.968
  503   HG22  VAL  66          HG22      VAL  66  65.136  -8.949   2.459
  504   HG23  VAL  66          HG23      VAL  66  65.987  -7.425   2.711
  505    H    ILE  67           HN       ILE  67  67.025  -6.943   1.000
  506    HA   ILE  67           HA       ILE  67  69.389  -5.672  -0.319
  507    HB   ILE  67           HB       ILE  67  67.068  -7.039  -1.707
  508   HG12  ILE  67          HG12      ILE  67  70.050  -7.546  -1.914
  509   HG13  ILE  67          HG11      ILE  67  68.987  -8.453  -0.837
  510   HG21  ILE  67          HG21      ILE  67  68.436  -6.362  -3.776
  511   HG22  ILE  67          HG22      ILE  67  69.258  -5.217  -2.716
  512   HG23  ILE  67          HG23      ILE  67  67.520  -5.082  -2.980
  513   HD11  ILE  67          HD11      ILE  67  67.620  -9.153  -2.765
  514   HD12  ILE  67          HD12      ILE  67  69.301  -9.640  -2.982
  515   HD13  ILE  67          HD13      ILE  67  68.670  -8.238  -3.846
  516    H1U  RCY  68           H1U      RCY  68  73.054  -3.987  -3.020
  517    H1S  RCY  68           H1S      RCY  68  70.075  -2.599   0.129
  518    HB1  RCY  68           HB1      RCY  68  68.299  -1.889   2.082
  519    HB2  RCY  68           HB2      RCY  68  67.185  -0.621   1.575
  520    HA   RCY  68           HA       RCY  68  66.216  -2.514   0.603
  521    HN1  RCY  68           HN1      RCY  68  68.830  -3.686   0.742
  522    HA   PRO  69           HA       PRO  69  65.678  -1.227  -3.595
  523    HB2  PRO  69           HB2      PRO  69  65.285   1.488  -2.376
  524    HB3  PRO  69           HB1      PRO  69  64.299   0.645  -3.587
  525    HG2  PRO  69           HG2      PRO  69  63.589   0.774  -1.005
  526    HG3  PRO  69           HG1      PRO  69  63.221  -0.628  -2.021
  527    HD2  PRO  69           HD2      PRO  69  65.143  -0.407   0.209
  528    HD3  PRO  69           HD1      PRO  69  64.431  -1.861  -0.522
  529    H    TRP  70           HN       TRP  70  67.714   0.798  -1.491
  530    HA   TRP  70           HA       TRP  70  69.084   2.085  -3.708
  531    HD1  TRP  70           HD1      TRP  70  69.519   4.601  -3.522
  532    HE1  TRP  70           HE1      TRP  70  67.814   6.408  -2.841
  533    HE3  TRP  70           HE3      TRP  70  67.811   2.595   0.851
  534    HZ2  TRP  70           HZ2      TRP  70  65.965   6.935  -0.717
  535    HZ3  TRP  70           HZ3      TRP  70  66.082   3.766   2.181
  536    HH2  TRP  70           HH2      TRP  70  65.157   5.930   1.406
  537    HB2  TRP  70           HB2      TRP  70  69.595   1.909  -0.738
  538    HB3  TRP  70           HB1      TRP  70  70.745   2.688  -1.822
  539    H    GLU  71           HN       GLU  71  69.058  -0.851  -3.810
  540    HA   GLU  71           HA       GLU  71  72.001  -1.251  -4.019
  541    HB2  GLU  71           HB2      GLU  71  70.064  -3.038  -2.531
  542    HB3  GLU  71           HB1      GLU  71  71.630  -3.610  -3.104
  543    HG2  GLU  71           HG2      GLU  71  71.297  -1.168  -1.343
  544    HG3  GLU  71           HG1      GLU  71  71.624  -2.782  -0.710
  545    H    ALA  72           HN       ALA  72  68.817  -1.703  -5.182
  546    HA   ALA  72           HA       ALA  72  69.389  -3.936  -6.959
  547    HB1  ALA  72           HB1      ALA  72  67.087  -3.427  -6.208
  548    HB2  ALA  72           HB2      ALA  72  67.206  -3.384  -7.967
  549    HB3  ALA  72           HB3      ALA  72  67.159  -1.879  -7.050
  550    H1U  RCY  73           H1U      RCY  73  73.942  -5.528  -5.761
  551    H1S  RCY  73           H1S      RCY  73  72.261  -2.179  -7.251
  552    HB1  RCY  73           HB1      RCY  73  71.547   1.546  -8.234
  553    HB2  RCY  73           HB2      RCY  73  72.871   0.778  -9.111
  554    HA   RCY  73           HA       RCY  73  70.309   0.099  -9.538
  555    HN1  RCY  73           HN1      RCY  73  70.692  -0.973  -6.943
  556    H    ASN  74           HN       ASN  74  70.223  -1.620 -11.059
  557    HA   ASN  74           HA       ASN  74  71.117  -3.123 -12.621
  558    HB2  ASN  74           HB2      ASN  74  72.702  -1.085 -12.828
  559    HB3  ASN  74           HB1      ASN  74  73.842  -2.049 -11.888
  560   HD21  ASN  74          HD21      ASN  74  72.155  -4.366 -13.464
  561   HD22  ASN  74          HD22      ASN  74  73.074  -4.504 -14.885
  562    H    HIS  75           HN       HIS  75  73.709  -4.409 -12.499
  563    HA   HIS  75           HA       HIS  75  73.323  -6.096 -10.050
  564    HD1  HIS  75           HD1      HIS  75  75.458  -4.999 -12.769
  565    HD2  HIS  75           HD2      HIS  75  73.469  -8.118 -14.698
  566    HE1  HIS  75           HE1      HIS  75  75.974  -4.758 -15.237
  567    HE2  HIS  75           HE2      HIS  75  74.769  -6.651 -16.422
  568    HB2  HIS  75           HB2      HIS  75  74.441  -7.892 -11.500
  569    HB3  HIS  75           HB1      HIS  75  72.794  -7.443 -11.945
  570    H1U  RCY  76           H1U      RCY  76  82.574  -5.121  -3.346
  571    H1S  RCY  76           H1S      RCY  76  79.173  -3.351  -6.085
  572    HB1  RCY  76           HB1      RCY  76  77.081  -5.716  -7.233
  573    HB2  RCY  76           HB2      RCY  76  76.723  -4.398  -8.347
  574    HA   RCY  76           HA       RCY  76  77.887  -5.830 -10.143
  575    HN1  RCY  76           HN1      RCY  76  75.394  -7.170  -9.323
  576    H    GLU  77           HN       GLU  77  76.350  -8.575  -9.483
  577    HA   GLU  77           HA       GLU  77  77.831 -10.012  -7.580
  578    HB2  GLU  77           HB2      GLU  77  76.798 -11.006 -10.256
  579    HB3  GLU  77           HB1      GLU  77  77.274 -12.032  -8.902
  580    HG2  GLU  77           HG2      GLU  77  75.125  -9.904  -8.720
  581    HG3  GLU  77           HG1      GLU  77  74.792 -11.606  -9.044
  582    H    LEU  78           HN       LEU  78  78.557  -9.689 -11.076
  583    HA   LEU  78           HA       LEU  78  81.185 -10.929 -10.713
  584    HG   LEU  78           HG       LEU  78  80.972 -12.408 -12.579
  585    HB2  LEU  78           HB2      LEU  78  79.719  -9.681 -13.036
  586    HB3  LEU  78           HB1      LEU  78  81.435 -10.070 -13.163
  587   HD11  LEU  78          HD11      LEU  78  79.127 -12.392 -11.142
  588   HD12  LEU  78          HD12      LEU  78  78.412 -12.990 -12.639
  589   HD13  LEU  78          HD13      LEU  78  78.206 -11.301 -12.177
  590   HD21  LEU  78          HD21      LEU  78  80.775 -11.572 -14.967
  591   HD22  LEU  78          HD22      LEU  78  79.030 -11.504 -14.724
  592   HD23  LEU  78          HD23      LEU  78  79.873 -13.049 -14.627
  593    H    HIS  79           HN       HIS  79  79.870  -7.798 -10.362
  594    HA   HIS  79           HA       HIS  79  80.889  -5.775  -9.769
  595    HD1  HIS  79           HD1      HIS  79  81.259  -4.483  -8.550
  596    HD2  HIS  79           HD2      HIS  79  85.276  -5.540  -8.177
  597    HE1  HIS  79           HE1      HIS  79  82.400  -2.551  -7.375
  598    HE2  HIS  79           HE2      HIS  79  84.847  -3.182  -7.142
  599    HB2  HIS  79           HB2      HIS  79  82.473  -7.480  -8.568
  600    HB3  HIS  79           HB1      HIS  79  83.592  -7.102  -9.878
  601    H    GLU  80           HN       GLU  80  83.217  -7.461 -11.928
  602    HA   GLU  80           HA       GLU  80  83.995  -5.140 -13.356
  603    HB2  GLU  80           HB2      GLU  80  84.515  -6.842 -15.230
  604    HB3  GLU  80           HB1      GLU  80  85.335  -7.064 -13.684
  605    HG2  GLU  80           HG2      GLU  80  83.943  -8.859 -13.061
  606    HG3  GLU  80           HG1      GLU  80  82.702  -8.423 -14.237
  607    H    LEU  81           HN       LEU  81  80.978  -6.662 -13.290
  608    HA   LEU  81           HA       LEU  81  80.230  -5.928 -16.047
  609    HG   LEU  81           HG       LEU  81  78.053  -8.700 -15.805
  610    HB2  LEU  81           HB2      LEU  81  79.126  -7.575 -13.901
  611    HB3  LEU  81           HB1      LEU  81  77.894  -6.531 -14.606
  612   HD11  LEU  81          HD11      LEU  81  77.570  -7.649 -17.752
  613   HD12  LEU  81          HD12      LEU  81  79.181  -6.940 -17.861
  614   HD13  LEU  81          HD13      LEU  81  77.935  -6.154 -16.891
  615   HD21  LEU  81          HD21      LEU  81  80.696  -8.601 -15.334
  616   HD22  LEU  81          HD22      LEU  81  80.690  -7.911 -16.957
  617   HD23  LEU  81          HD23      LEU  81  80.023  -9.520 -16.680
  618    H    ALA  82           HN       ALA  82  80.202  -4.534 -12.887
  619    HA   ALA  82           HA       ALA  82  78.042  -2.766 -12.941
  620    HB1  ALA  82           HB1      ALA  82  79.438  -1.242 -11.576
  621    HB2  ALA  82           HB2      ALA  82  80.872  -2.167 -12.024
  622    HB3  ALA  82           HB3      ALA  82  79.610  -2.916 -11.048
  623    H    GLN  83           HN       GLN  83  78.184  -0.329 -13.432
  624    HA   GLN  83           HA       GLN  83  79.989   0.368 -15.657
  625    HB2  GLN  83           HB2      GLN  83  77.852  -0.825 -16.543
  626    HB3  GLN  83           HB1      GLN  83  77.020   0.667 -16.104
  627    HG2  GLN  83           HG2      GLN  83  78.459   1.969 -17.555
  628    HG3  GLN  83           HG1      GLN  83  79.472   0.563 -17.885
  629   HE21  GLN  83          HE21      GLN  83  78.834  -0.803 -19.597
  630   HE22  GLN  83          HE22      GLN  83  77.371  -0.647 -20.442
  631    H    TYR  84           HN       TYR  84  77.515   1.250 -13.325
  632    HA   TYR  84           HA       TYR  84  77.209   3.988 -13.769
  633    HD1  TYR  84           HD2      TYR  84  75.376   1.535 -13.126
  634    HD2  TYR  84           HD1      TYR  84  75.376   5.251 -10.970
  635    HE1  TYR  84           HE2      TYR  84  72.944   1.780 -13.548
  636    HE2  TYR  84           HE1      TYR  84  72.944   5.495 -11.393
  637    HH   TYR  84           HH       TYR  84  71.298   3.803 -13.683
  638    HB2  TYR  84           HB2      TYR  84  77.209   2.254 -11.343
  639    HB3  TYR  84           HB1      TYR  84  77.336   3.992 -11.069
  640    H    GLY  85           HN       GLY  85  80.045   2.276 -12.641
  641    HA2  GLY  85           HA2      GLY  85  82.006   4.013 -13.319
  642    HA3  GLY  85           HA1      GLY  85  81.406   4.765 -11.841
  643    H    ILE  86           HN       ILE  86  81.643   1.289 -12.521
  644    HA   ILE  86           HA       ILE  86  82.772  -0.405 -11.364
  645    HB   ILE  86           HB       ILE  86  84.816   1.771 -10.824
  646   HG12  ILE  86          HG12      ILE  86  84.027   1.290 -13.279
  647   HG13  ILE  86          HG11      ILE  86  85.755   1.349 -12.931
  648   HG21  ILE  86          HG21      ILE  86  85.345  -0.125  -9.498
  649   HG22  ILE  86          HG22      ILE  86  86.339  -0.303 -10.944
  650   HG23  ILE  86          HG23      ILE  86  84.861  -1.249 -10.768
  651   HD11  ILE  86          HD11      ILE  86  84.295  -1.264 -12.698
  652   HD12  ILE  86          HD12      ILE  86  85.997  -0.968 -13.052
  653   HD13  ILE  86          HD13      ILE  86  84.775  -0.678 -14.290
  654    H1U  RCY  87           H1U      RCY  87  82.065  -1.503  -1.949
  655    H1S  RCY  87           H1S      RCY  87  81.183   2.250  -4.600
  656    HB1  RCY  87           HB1      RCY  87  83.173   4.038  -7.662
  657    HB2  RCY  87           HB2      RCY  87  84.542   3.202  -6.929
  658    HA   RCY  87           HA       RCY  87  83.362   1.117  -6.889
  659    HN1  RCY  87           HN1      RCY  87  83.741   2.400  -9.371
  Start of MODEL   30
    1    HA   MET   1           HA       MET   1  57.677  -1.431  12.882
    2    HB2  MET   1           HB2      MET   1  56.327  -1.426  15.130
    3    HB3  MET   1           HB1      MET   1  54.962  -1.876  14.110
    4    HG2  MET   1           HG2      MET   1  56.399  -3.741  13.174
    5    HG3  MET   1           HG1      MET   1  57.583  -3.361  14.426
    6    HE1  MET   1           HE1      MET   1  56.720  -6.164  14.318
    7    HE2  MET   1           HE2      MET   1  56.240  -6.547  15.970
    8    HE3  MET   1           HE3      MET   1  57.642  -5.519  15.682
    9    H    ASN   2           HN       ASN   2  55.964   0.546  11.214
   10    HA   ASN   2           HA       ASN   2  54.996  -1.520   9.335
   11    HB2  ASN   2           HB2      ASN   2  53.177   0.725  10.254
   12    HB3  ASN   2           HB1      ASN   2  52.776  -0.575   9.131
   13   HD21  ASN   2          HD21      ASN   2  53.412  -2.890  10.257
   14   HD22  ASN   2          HD22      ASN   2  52.784  -3.070  11.824
   15    H    LEU   3           HN       LEU   3  56.787   1.128   9.839
   16    HA   LEU   3           HA       LEU   3  56.088   3.012   7.855
   17    HG   LEU   3           HG       LEU   3  57.127   4.705   9.090
   18    HB2  LEU   3           HB2      LEU   3  58.729   2.128   9.013
   19    HB3  LEU   3           HB1      LEU   3  58.677   3.328   7.721
   20   HD11  LEU   3          HD11      LEU   3  56.027   3.099  10.458
   21   HD12  LEU   3          HD12      LEU   3  57.027   4.034  11.569
   22   HD13  LEU   3          HD13      LEU   3  57.554   2.435  11.040
   23   HD21  LEU   3          HD21      LEU   3  58.817   5.307  10.869
   24   HD22  LEU   3          HD22      LEU   3  59.488   5.218   9.240
   25   HD23  LEU   3          HD23      LEU   3  59.751   3.895  10.376
   26    H    GLU   4           HN       GLU   4  58.661   0.556   7.423
   27    HA   GLU   4           HA       GLU   4  58.676   0.759   4.581
   28    HB2  GLU   4           HB2      GLU   4  59.666  -1.270   6.565
   29    HB3  GLU   4           HB1      GLU   4  59.690  -1.671   4.849
   30    HG2  GLU   4           HG2      GLU   4  61.825  -0.628   5.649
   31    HG3  GLU   4           HG1      GLU   4  61.046   0.286   4.356
   32    HA   PRO   5           HA       PRO   5  55.076  -1.442   3.304
   33    HB2  PRO   5           HB2      PRO   5  56.091  -2.880   1.147
   34    HB3  PRO   5           HB1      PRO   5  55.603  -1.176   1.090
   35    HG2  PRO   5           HG2      PRO   5  58.314  -2.359   1.343
   36    HG3  PRO   5           HG1      PRO   5  57.785  -0.914   0.465
   37    HD2  PRO   5           HD2      PRO   5  59.077  -0.763   2.855
   38    HD3  PRO   5           HD1      PRO   5  57.855   0.431   2.360
   39    HA   PRO   6           HA       PRO   6  55.019  -5.515   5.005
   40    HB2  PRO   6           HB2      PRO   6  53.272  -6.832   3.317
   41    HB3  PRO   6           HB1      PRO   6  52.768  -5.687   4.574
   42    HG2  PRO   6           HG2      PRO   6  53.076  -5.262   1.648
   43    HG3  PRO   6           HG1      PRO   6  51.847  -4.635   2.759
   44    HD2  PRO   6           HD2      PRO   6  53.928  -3.111   1.879
   45    HD3  PRO   6           HD1      PRO   6  53.194  -2.888   3.483
   46    H    LYS   7           HN       LYS   7  55.525  -7.839   4.547
   47    HA   LYS   7           HA       LYS   7  56.838  -8.393   1.955
   48    HB2  LYS   7           HB2      LYS   7  58.844  -9.303   3.406
   49    HB3  LYS   7           HB1      LYS   7  58.775  -7.590   2.990
   50    HG2  LYS   7           HG2      LYS   7  57.860  -7.022   5.141
   51    HG3  LYS   7           HG1      LYS   7  57.620  -8.721   5.550
   52    HD2  LYS   7           HD2      LYS   7  60.080  -9.070   5.438
   53    HD3  LYS   7           HD1      LYS   7  60.290  -7.349   5.115
   54    HE2  LYS   7           HE2      LYS   7  60.618  -7.860   7.515
   55    HE3  LYS   7           HE1      LYS   7  59.229  -6.801   7.266
   56    HZ1  LYS   7           HZ1      LYS   7  58.617  -9.618   7.157
   57    HZ2  LYS   7           HZ2      LYS   7  57.813  -8.360   7.968
   58    HZ3  LYS   7           HZ3      LYS   7  59.176  -9.093   8.670
   59    H    ALA   8           HN       ALA   8  55.640 -10.207   1.491
   60    HA   ALA   8           HA       ALA   8  54.839 -12.089   3.572
   61    HB1  ALA   8           HB1      ALA   8  53.724 -13.279   1.830
   62    HB2  ALA   8           HB2      ALA   8  54.750 -12.564   0.587
   63    HB3  ALA   8           HB3      ALA   8  53.552 -11.573   1.419
   64    H    GLU   9           HN       GLU   9  57.317 -11.971   1.039
   65    HA   GLU   9           HA       GLU   9  59.009 -13.818   2.466
   66    HB2  GLU   9           HB2      GLU   9  57.338 -15.434   1.587
   67    HB3  GLU   9           HB1      GLU   9  57.686 -14.879  -0.051
   68    HG2  GLU   9           HG2      GLU   9  59.920 -15.699   0.034
   69    HG3  GLU   9           HG1      GLU   9  59.849 -15.926   1.782
   70    H1U  RCY  10           H1U      RCY  10  65.879 -11.765  -1.329
   71    H1S  RCY  10           H1S      RCY  10  62.573 -14.748  -1.457
   72    HB1  RCY  10           HB1      RCY  10  60.709 -12.767  -3.830
   73    HB2  RCY  10           HB2      RCY  10  59.167 -13.436  -3.294
   74    HA   RCY  10           HA       RCY  10  61.403 -12.840  -1.351
   75    HN1  RCY  10           HN1      RCY  10  58.662 -13.772  -1.057
   76    H    ARG  11           HN       ARG  11  59.725 -10.979   0.078
   77    HA   ARG  11           HA       ARG  11  59.164  -8.699   0.092
   78    HE   ARG  11           HE       ARG  11  63.622  -7.286  -1.691
   79    HB2  ARG  11           HB2      ARG  11  61.584  -8.524  -0.377
   80    HB3  ARG  11           HB1      ARG  11  61.256  -8.651  -2.106
   81    HG2  ARG  11           HG2      ARG  11  60.113  -6.566  -2.151
   82    HG3  ARG  11           HG1      ARG  11  59.983  -6.512  -0.392
   83    HD2  ARG  11           HD2      ARG  11  61.792  -5.028  -1.440
   84    HD3  ARG  11           HD1      ARG  11  62.313  -6.088  -0.130
   85   HH11  ARG  11          HH21      ARG  11  61.277  -5.269  -3.214
   86   HH12  ARG  11          HH22      ARG  11  61.893  -5.534  -4.812
   87   HH21  ARG  11          HH11      ARG  11  64.439  -7.643  -3.768
   88   HH22  ARG  11          HH12      ARG  11  63.683  -6.878  -5.125
   89    H    SER  12           HN       SER  12  57.056  -8.569  -0.658
   90    HA   SER  12           HA       SER  12  55.290  -8.289  -2.185
   91    HG   SER  12           HG       SER  12  55.595  -5.690  -4.481
   92    HB2  SER  12           HB2      SER  12  56.693  -6.157  -2.419
   93    HB3  SER  12           HB1      SER  12  57.365  -6.882  -3.877
   94    H    ALA  13           HN       ALA  13  56.162  -7.903  -5.165
   95    HA   ALA  13           HA       ALA  13  57.076 -10.594  -5.891
   96    HB1  ALA  13           HB1      ALA  13  54.675 -10.977  -5.435
   97    HB2  ALA  13           HB2      ALA  13  55.038 -11.175  -7.150
   98    HB3  ALA  13           HB3      ALA  13  54.259  -9.700  -6.578
   99    H    THR  14           HN       THR  14  56.982  -7.368  -6.423
  100    HA   THR  14           HA       THR  14  58.112  -7.663  -9.110
  101    HB   THR  14           HB       THR  14  55.769  -5.781  -8.851
  102    HG1  THR  14           HG1      THR  14  54.566  -7.488  -8.739
  103   HG21  THR  14          HG21      THR  14  55.773  -5.953 -11.281
  104   HG22  THR  14          HG22      THR  14  57.017  -7.201 -11.220
  105   HG23  THR  14          HG23      THR  14  57.398  -5.551 -10.728
  106    H    ARG  15           HN       ARG  15  59.156  -6.761  -6.603
  107    HA   ARG  15           HA       ARG  15  60.286  -4.935  -5.643
  108    HE   ARG  15           HE       ARG  15  63.671  -7.087  -9.757
  109    HB2  ARG  15           HB2      ARG  15  60.410  -4.183  -8.580
  110    HB3  ARG  15           HB1      ARG  15  61.402  -3.462  -7.311
  111    HG2  ARG  15           HG2      ARG  15  62.499  -5.539  -6.859
  112    HG3  ARG  15           HG1      ARG  15  61.340  -6.440  -7.837
  113    HD2  ARG  15           HD2      ARG  15  62.136  -5.306  -9.863
  114    HD3  ARG  15           HD1      ARG  15  63.264  -4.351  -8.901
  115   HH11  ARG  15          HH21      ARG  15  64.195  -4.787  -7.242
  116   HH12  ARG  15          HH22      ARG  15  65.630  -5.558  -6.655
  117   HH21  ARG  15          HH11      ARG  15  65.542  -8.106  -9.004
  118   HH22  ARG  15          HH12      ARG  15  66.393  -7.437  -7.653
  119    H    VAL  16           HN       VAL  16  58.680  -3.875  -4.460
  120    HA   VAL  16           HA       VAL  16  56.491  -2.417  -5.341
  121    HB   VAL  16           HB       VAL  16  56.691  -1.085  -3.272
  122   HG11  VAL  16          HG11      VAL  16  56.640  -2.935  -1.715
  123   HG12  VAL  16          HG12      VAL  16  57.590  -3.942  -2.807
  124   HG13  VAL  16          HG13      VAL  16  55.939  -3.492  -3.234
  125   HG21  VAL  16          HG21      VAL  16  58.714  -1.511  -1.826
  126   HG22  VAL  16          HG22      VAL  16  59.064  -0.598  -3.293
  127   HG23  VAL  16          HG23      VAL  16  59.462  -2.314  -3.206
  128    H    MET  17           HN       MET  17  59.795  -1.677  -5.898
  129    HA   MET  17           HA       MET  17  59.085   0.633  -7.502
  130    HB2  MET  17           HB2      MET  17  59.077   1.550  -5.135
  131    HB3  MET  17           HB1      MET  17  60.799   1.177  -5.065
  132    HG2  MET  17           HG2      MET  17  60.584   3.488  -5.732
  133    HG3  MET  17           HG1      MET  17  61.102   2.572  -7.147
  134    HE1  MET  17           HE1      MET  17  57.186   2.801  -5.673
  135    HE2  MET  17           HE2      MET  17  57.164   4.506  -6.117
  136    HE3  MET  17           HE3      MET  17  58.436   3.892  -5.063
  137    H    GLY  18           HN       GLY  18  60.326  -0.053  -9.207
  138    HA2  GLY  18           HA2      GLY  18  63.227   0.069  -8.944
  139    HA3  GLY  18           HA1      GLY  18  62.634  -1.566  -9.243
  140    H    GLY  19           HN       GLY  19  61.764   1.675 -10.506
  141    HA2  GLY  19           HA2      GLY  19  61.242   0.607 -13.150
  142    HA3  GLY  19           HA1      GLY  19  61.297   2.318 -12.724
  143    HA   PRO  20           HA       PRO  20  64.903   1.143 -15.569
  144    HB2  PRO  20           HB2      PRO  20  64.298   4.008 -16.216
  145    HB3  PRO  20           HB1      PRO  20  64.736   2.675 -17.303
  146    HG2  PRO  20           HG2      PRO  20  62.226   3.538 -17.099
  147    HG3  PRO  20           HG1      PRO  20  62.604   1.824 -17.337
  148    HD2  PRO  20           HD2      PRO  20  61.617   3.206 -14.891
  149    HD3  PRO  20           HD1      PRO  20  61.404   1.516 -15.397
  150    H1U  RCY  21           H1U      RCY  21  63.435   3.136  -9.969
  151    H1S  RCY  21           H1S      RCY  21  65.453   1.556 -11.768
  152    HB1  RCY  21           HB1      RCY  21  69.146   1.972 -11.692
  153    HB2  RCY  21           HB2      RCY  21  68.398   0.743 -12.712
  154    HA   RCY  21           HA       RCY  21  67.007   3.358 -12.125
  155    HN1  RCY  21           HN1      RCY  21  66.300   1.074 -13.687
  156    H    THR  22           HN       THR  22  67.518   5.157 -13.403
  157    HA   THR  22           HA       THR  22  69.663   4.864 -15.437
  158    HB   THR  22           HB       THR  22  69.067   7.370 -15.790
  159    HG1  THR  22           HG1      THR  22  66.767   7.602 -15.082
  160   HG21  THR  22          HG21      THR  22  68.390   5.770 -17.426
  161   HG22  THR  22          HG22      THR  22  66.937   6.685 -17.020
  162   HG23  THR  22          HG23      THR  22  67.182   5.074 -16.346
  163    HA   PRO  23           HA       PRO  23  73.072   6.306 -13.033
  164    HB2  PRO  23           HB2      PRO  23  73.141   8.630 -14.937
  165    HB3  PRO  23           HB1      PRO  23  74.468   7.593 -14.379
  166    HG2  PRO  23           HG2      PRO  23  73.322   7.284 -16.783
  167    HG3  PRO  23           HG1      PRO  23  73.960   5.920 -15.852
  168    HD2  PRO  23           HD2      PRO  23  71.152   6.609 -16.445
  169    HD3  PRO  23           HD1      PRO  23  71.842   5.060 -15.915
  170    H    ARG  24           HN       ARG  24  71.757   9.413 -14.182
  171    HA   ARG  24           HA       ARG  24  71.016  11.288 -12.990
  172    HE   ARG  24           HE       ARG  24  70.094  10.075 -14.980
  173    HB2  ARG  24           HB2      ARG  24  70.043   9.199 -11.019
  174    HB3  ARG  24           HB1      ARG  24  69.459  10.855 -11.164
  175    HG2  ARG  24           HG2      ARG  24  69.307   8.784 -13.374
  176    HG3  ARG  24           HG1      ARG  24  67.968   9.207 -12.305
  177    HD2  ARG  24           HD2      ARG  24  67.524  10.638 -14.068
  178    HD3  ARG  24           HD1      ARG  24  68.574  11.674 -13.101
  179   HH11  ARG  24          HH21      ARG  24  68.094  12.852 -14.566
  180   HH12  ARG  24          HH22      ARG  24  68.784  13.714 -15.900
  181   HH21  ARG  24          HH11      ARG  24  71.008  11.185 -16.725
  182   HH22  ARG  24          HH12      ARG  24  70.434  12.770 -17.123
  183    H    LYS  25           HN       LYS  25  71.587  12.647 -11.197
  184    HA   LYS  25           HA       LYS  25  73.113  11.729  -8.943
  185    HB2  LYS  25           HB2      LYS  25  75.311  12.713  -9.610
  186    HB3  LYS  25           HB1      LYS  25  74.863  11.317 -10.589
  187    HG2  LYS  25           HG2      LYS  25  73.727  13.268 -12.070
  188    HG3  LYS  25           HG1      LYS  25  75.056  14.185 -11.359
  189    HD2  LYS  25           HD2      LYS  25  76.654  12.467 -12.140
  190    HD3  LYS  25           HD1      LYS  25  75.324  11.569 -12.872
  191    HE2  LYS  25           HE2      LYS  25  75.963  14.444 -13.575
  192    HE3  LYS  25           HE1      LYS  25  76.601  13.066 -14.472
  193    HZ1  LYS  25           HZ1      LYS  25  74.569  12.544 -15.307
  194    HZ2  LYS  25           HZ2      LYS  25  74.354  14.221 -15.141
  195    HZ3  LYS  25           HZ3      LYS  25  73.721  13.161 -13.974
  196    H    GLY  26           HN       GLY  26  72.722  14.465 -11.203
  197    HA2  GLY  26           HA2      GLY  26  72.318  16.736 -10.780
  198    HA3  GLY  26           HA1      GLY  26  71.397  16.162  -9.390
  199    HA   PRO  27           HA       PRO  27  75.168  18.905  -8.227
  200    HB2  PRO  27           HB2      PRO  27  72.973  19.642  -6.320
  201    HB3  PRO  27           HB1      PRO  27  74.214  20.673  -7.061
  202    HG2  PRO  27           HG2      PRO  27  71.703  20.638  -7.959
  203    HG3  PRO  27           HG1      PRO  27  73.084  20.835  -9.051
  204    HD2  PRO  27           HD2      PRO  27  71.291  18.496  -8.708
  205    HD3  PRO  27           HD1      PRO  27  72.283  18.962 -10.106
  206    HA   PRO  28           HA       PRO  28  76.216  15.572  -5.338
  207    HB2  PRO  28           HB2      PRO  28  78.109  17.699  -4.400
  208    HB3  PRO  28           HB1      PRO  28  78.425  15.991  -4.763
  209    HG2  PRO  28           HG2      PRO  28  79.111  17.937  -6.457
  210    HG3  PRO  28           HG1      PRO  28  78.548  16.357  -7.026
  211    HD2  PRO  28           HD2      PRO  28  77.146  18.978  -7.085
  212    HD3  PRO  28           HD1      PRO  28  76.925  17.556  -8.128
  213    H    LYS  29           HN       LYS  29  75.204  15.141  -3.420
  214    HA   LYS  29           HA       LYS  29  75.198  16.931  -1.173
  215    HB2  LYS  29           HB2      LYS  29  73.549  18.133  -2.611
  216    HB3  LYS  29           HB1      LYS  29  72.555  16.677  -2.644
  217    HG2  LYS  29           HG2      LYS  29  72.107  16.797  -0.316
  218    HG3  LYS  29           HG1      LYS  29  73.408  17.956  -0.044
  219    HD2  LYS  29           HD2      LYS  29  71.312  18.785  -1.977
  220    HD3  LYS  29           HD1      LYS  29  70.814  18.690  -0.287
  221    HE2  LYS  29           HE2      LYS  29  71.737  20.943  -1.002
  222    HE3  LYS  29           HE1      LYS  29  72.538  20.220   0.393
  223    HZ1  LYS  29           HZ1      LYS  29  73.495  20.031  -2.413
  224    HZ2  LYS  29           HZ2      LYS  29  74.278  19.406  -1.041
  225    HZ3  LYS  29           HZ3      LYS  29  74.119  21.086  -1.240
  226    H1U  RCY  30           H1U      RCY  30  77.954   7.839  -1.541
  227    H1S  RCY  30           H1S      RCY  30  77.459  11.870   0.932
  228    HB1  RCY  30           HB1      RCY  30  75.416  13.068  -0.128
  229    HB2  RCY  30           HB2      RCY  30  74.176  11.859   0.198
  230    HA   RCY  30           HA       RCY  30  72.710  13.528   0.589
  231    HN1  RCY  30           HN1      RCY  30  74.352  15.870   0.691
  232    H    LYS  31           HN       LYS  31  71.806  13.446   2.587
  233    HA   LYS  31           HA       LYS  31  72.802  15.080   4.746
  234    HB2  LYS  31           HB2      LYS  31  70.698  12.897   4.673
  235    HB3  LYS  31           HB1      LYS  31  71.012  13.915   6.079
  236    HG2  LYS  31           HG2      LYS  31  70.323  15.884   4.946
  237    HG3  LYS  31           HG1      LYS  31  70.405  15.101   3.368
  238    HD2  LYS  31           HD2      LYS  31  68.063  15.345   4.164
  239    HD3  LYS  31           HD1      LYS  31  68.519  13.653   3.958
  240    HE2  LYS  31           HE2      LYS  31  67.289  14.295   6.140
  241    HE3  LYS  31           HE1      LYS  31  68.743  13.307   6.286
  242    HZ1  LYS  31           HZ1      LYS  31  69.047  16.217   6.324
  243    HZ2  LYS  31           HZ2      LYS  31  69.944  15.021   7.132
  244    HZ3  LYS  31           HZ3      LYS  31  68.411  15.471   7.709
  245    H    GLN  32           HN       GLN  32  71.867  12.110   6.039
  246    HA   GLN  32           HA       GLN  32  73.040  10.491   7.262
  247    HB2  GLN  32           HB2      GLN  32  73.922  10.117   4.857
  248    HB3  GLN  32           HB1      GLN  32  75.369  10.968   5.400
  249    HG2  GLN  32           HG2      GLN  32  75.453   9.330   7.348
  250    HG3  GLN  32           HG1      GLN  32  74.212   8.401   6.507
  251   HE21  GLN  32          HE21      GLN  32  77.541   9.679   6.108
  252   HE22  GLN  32          HE22      GLN  32  78.018   8.515   4.969
  253    H    ARG  33           HN       ARG  33  74.702  10.321   8.893
  254    HA   ARG  33           HA       ARG  33  76.744  12.326   9.234
  255    HE   ARG  33           HE       ARG  33  72.429  14.814  10.117
  256    HB2  ARG  33           HB2      ARG  33  75.791  13.529  11.142
  257    HB3  ARG  33           HB1      ARG  33  74.735  13.712   9.741
  258    HG2  ARG  33           HG2      ARG  33  73.421  11.716  10.624
  259    HG3  ARG  33           HG1      ARG  33  74.353  11.874  12.114
  260    HD2  ARG  33           HD2      ARG  33  72.384  13.137  12.509
  261    HD3  ARG  33           HD1      ARG  33  73.610  14.340  12.111
  262   HH11  ARG  33          HH21      ARG  33  71.407  11.870  11.593
  263   HH12  ARG  33          HH22      ARG  33  70.055  11.652  10.533
  264   HH21  ARG  33          HH11      ARG  33  70.669  14.547   8.724
  265   HH22  ARG  33          HH12      ARG  33  69.637  13.168   8.908
  266    H    GLN  34           HN       GLN  34  75.726   9.361   9.634
  267    HA   GLN  34           HA       GLN  34  76.335   8.825  12.428
  268    HB2  GLN  34           HB2      GLN  34  74.908   7.417  10.748
  269    HB3  GLN  34           HB1      GLN  34  76.460   6.754  10.239
  270    HG2  GLN  34           HG2      GLN  34  75.639   5.296  11.956
  271    HG3  GLN  34           HG1      GLN  34  76.919   6.258  12.695
  272   HE21  GLN  34          HE21      GLN  34  73.549   7.273  11.971
  273   HE22  GLN  34          HE22      GLN  34  73.138   7.599  13.586
  274    H    THR  35           HN       THR  35  78.207   7.427  13.070
  275    HA   THR  35           HA       THR  35  80.691   8.538  12.212
  276    HB   THR  35           HB       THR  35  80.430   5.815  13.493
  277    HG1  THR  35           HG1      THR  35  79.837   6.730  15.323
  278   HG21  THR  35          HG21      THR  35  82.658   6.942  12.797
  279   HG22  THR  35          HG22      THR  35  82.532   6.304  14.436
  280   HG23  THR  35          HG23      THR  35  82.358   8.035  14.149
  281    H    ARG  36           HN       ARG  36  81.591   5.425  12.177
  282    HA   ARG  36           HA       ARG  36  80.831   4.592   9.510
  283    HE   ARG  36           HE       ARG  36  84.273   6.041   7.520
  284    HB2  ARG  36           HB2      ARG  36  82.938   4.951   8.370
  285    HB3  ARG  36           HB1      ARG  36  82.395   6.501   9.014
  286    HG2  ARG  36           HG2      ARG  36  83.823   5.904  11.094
  287    HG3  ARG  36           HG1      ARG  36  84.582   4.701  10.051
  288    HD2  ARG  36           HD2      ARG  36  84.519   7.701   9.682
  289    HD3  ARG  36           HD1      ARG  36  85.931   6.660   9.854
  290   HH11  ARG  36          HH21      ARG  36  86.863   7.867   8.878
  291   HH12  ARG  36          HH22      ARG  36  87.643   8.142   7.356
  292   HH21  ARG  36          HH11      ARG  36  85.276   6.390   5.525
  293   HH22  ARG  36          HH12      ARG  36  86.745   7.306   5.458
  294    H    GLN  37           HN       GLN  37  81.115   3.524  12.253
  295    HA   GLN  37           HA       GLN  37  83.397   1.705  12.212
  296    HB2  GLN  37           HB2      GLN  37  80.938   1.922  13.962
  297    HB3  GLN  37           HB1      GLN  37  82.147   0.656  14.176
  298    HG2  GLN  37           HG2      GLN  37  83.899   2.426  14.394
  299    HG3  GLN  37           HG1      GLN  37  82.627   3.646  14.315
  300   HE21  GLN  37          HE21      GLN  37  81.674   4.210  16.286
  301   HE22  GLN  37          HE22      GLN  37  81.802   3.304  17.716
  302    H1U  RCY  38           H1U      RCY  38  83.808  -4.018   3.663
  303    H1S  RCY  38           H1S      RCY  38  80.554  -3.327   6.750
  304    HB1  RCY  38           HB1      RCY  38  82.748  -1.280   9.391
  305    HB2  RCY  38           HB2      RCY  38  81.024  -0.940   9.250
  306    HA   RCY  38           HA       RCY  38  80.553  -1.902  11.372
  307    HN1  RCY  38           HN1      RCY  38  82.923  -0.736  12.441
  308    H    LYS  39           HN       LYS  39  80.843  -3.621  12.762
  309    HA   LYS  39           HA       LYS  39  83.477  -4.982  12.847
  310    HB2  LYS  39           HB2      LYS  39  82.239  -4.481  14.964
  311    HB3  LYS  39           HB1      LYS  39  80.950  -5.557  14.428
  312    HG2  LYS  39           HG2      LYS  39  83.671  -6.717  14.312
  313    HG3  LYS  39           HG1      LYS  39  83.074  -6.375  15.937
  314    HD2  LYS  39           HD2      LYS  39  81.276  -7.763  13.975
  315    HD3  LYS  39           HD1      LYS  39  82.524  -8.689  14.809
  316    HE2  LYS  39           HE2      LYS  39  81.647  -7.827  16.985
  317    HE3  LYS  39           HE1      LYS  39  80.338  -7.036  16.106
  318    HZ1  LYS  39           HZ1      LYS  39  79.460  -9.072  16.776
  319    HZ2  LYS  39           HZ2      LYS  39  80.877  -9.928  16.392
  320    HZ3  LYS  39           HZ3      LYS  39  79.881  -9.329  15.153
  321    H    SER  40           HN       SER  40  80.430  -5.260  11.306
  322    HA   SER  40           HA       SER  40  80.153  -8.071  11.051
  323    HG   SER  40           HG       SER  40  79.462  -6.935   7.715
  324    HB2  SER  40           HB2      SER  40  78.311  -6.938  10.209
  325    HB3  SER  40           HB1      SER  40  79.297  -5.707   9.426
  326    H    LYS  41           HN       LYS  41  81.130  -9.573   9.729
  327    HA   LYS  41           HA       LYS  41  83.091  -8.614   7.697
  328    HB2  LYS  41           HB2      LYS  41  84.706 -10.329   8.499
  329    HB3  LYS  41           HB1      LYS  41  84.388  -9.088   9.710
  330    HG2  LYS  41           HG2      LYS  41  82.415 -10.989  10.197
  331    HG3  LYS  41           HG1      LYS  41  83.838 -11.959   9.813
  332    HD2  LYS  41           HD2      LYS  41  85.142 -10.581  11.461
  333    HD3  LYS  41           HD1      LYS  41  83.633  -9.792  11.923
  334    HE2  LYS  41           HE2      LYS  41  84.062 -11.610  13.479
  335    HE3  LYS  41           HE1      LYS  41  82.686 -12.049  12.467
  336    HZ1  LYS  41           HZ1      LYS  41  85.452 -12.835  11.776
  337    HZ2  LYS  41           HZ2      LYS  41  83.994 -13.479  11.188
  338    HZ3  LYS  41           HZ3      LYS  41  84.478 -13.787  12.788
  339    HA   PRO  42           HA       PRO  42  80.527 -12.004   5.981
  340    HB2  PRO  42           HB2      PRO  42  80.301 -11.004   3.463
  341    HB3  PRO  42           HB1      PRO  42  79.293 -10.439   4.809
  342    HG2  PRO  42           HG2      PRO  42  81.659  -9.161   3.556
  343    HG3  PRO  42           HG1      PRO  42  80.196  -8.423   4.225
  344    HD2  PRO  42           HD2      PRO  42  82.656  -8.564   5.537
  345    HD3  PRO  42           HD1      PRO  42  81.090  -8.288   6.331
  346    HA   PRO  43           HA       PRO  43  83.784 -14.274   4.007
  347    HB2  PRO  43           HB2      PRO  43  82.389 -15.999   2.421
  348    HB3  PRO  43           HB1      PRO  43  82.414 -16.128   4.191
  349    HG2  PRO  43           HG2      PRO  43  80.321 -14.972   2.416
  350    HG3  PRO  43           HG1      PRO  43  80.145 -15.970   3.869
  351    HD2  PRO  43           HD2      PRO  43  79.823 -13.243   3.875
  352    HD3  PRO  43           HD1      PRO  43  80.357 -14.165   5.298
  353    H    LYS  44           HN       LYS  44  85.134 -13.556   2.418
  354    HA   LYS  44           HA       LYS  44  84.200 -13.347  -0.347
  355    HB2  LYS  44           HB2      LYS  44  84.418 -10.982   1.364
  356    HB3  LYS  44           HB1      LYS  44  85.468 -10.859  -0.046
  357    HG2  LYS  44           HG2      LYS  44  82.601 -11.750  -0.330
  358    HG3  LYS  44           HG1      LYS  44  83.016 -10.036  -0.283
  359    HD2  LYS  44           HD2      LYS  44  84.363 -10.201  -2.237
  360    HD3  LYS  44           HD1      LYS  44  84.384 -11.963  -2.166
  361    HE2  LYS  44           HE2      LYS  44  82.044 -12.088  -2.736
  362    HE3  LYS  44           HE1      LYS  44  81.858 -10.342  -2.575
  363    HZ1  LYS  44           HZ1      LYS  44  82.259 -10.300  -4.753
  364    HZ2  LYS  44           HZ2      LYS  44  82.877 -11.882  -4.777
  365    HZ3  LYS  44           HZ3      LYS  44  83.883 -10.581  -4.351
  366    H    LYS  45           HN       LYS  45  86.900 -11.538   1.045
  367    HA   LYS  45           HA       LYS  45  88.839 -13.647   0.539
  368    HB2  LYS  45           HB2      LYS  45  88.068 -12.248  -1.706
  369    HB3  LYS  45           HB1      LYS  45  89.466 -11.317  -1.171
  370    HG2  LYS  45           HG2      LYS  45  89.469 -14.329  -1.525
  371    HG3  LYS  45           HG1      LYS  45  90.059 -13.190  -2.736
  372    HD2  LYS  45           HD2      LYS  45  91.754 -12.359  -1.214
  373    HD3  LYS  45           HD1      LYS  45  91.101 -13.329   0.107
  374    HE2  LYS  45           HE2      LYS  45  93.128 -14.340  -0.999
  375    HE3  LYS  45           HE1      LYS  45  91.706 -15.384  -1.014
  376    HZ1  LYS  45           HZ1      LYS  45  93.023 -15.066  -3.176
  377    HZ2  LYS  45           HZ2      LYS  45  92.251 -13.555  -3.261
  378    HZ3  LYS  45           HZ3      LYS  45  91.330 -14.983  -3.244
  379    H    GLY  46           HN       GLY  46  88.894 -10.067   0.351
  380    HA2  GLY  46           HA2      GLY  46  91.167  -9.989   2.197
  381    HA3  GLY  46           HA1      GLY  46  90.381  -8.591   1.462
  382    H    VAL  47           HN       VAL  47  91.095  -9.356   4.356
  383    HA   VAL  47           HA       VAL  47  88.510  -9.569   5.692
  384    HB   VAL  47           HB       VAL  47  91.046  -8.632   7.025
  385   HG11  VAL  47          HG11      VAL  47  90.125  -9.705   8.940
  386   HG12  VAL  47          HG12      VAL  47  88.961 -10.606   7.969
  387   HG13  VAL  47          HG13      VAL  47  88.767  -8.867   8.188
  388   HG21  VAL  47          HG21      VAL  47  91.810 -10.481   5.687
  389   HG22  VAL  47          HG22      VAL  47  90.366 -11.423   6.061
  390   HG23  VAL  47          HG23      VAL  47  91.561 -11.104   7.318
  391    H    GLN  48           HN       GLN  48  89.748  -7.431   7.664
  392    HA   GLN  48           HA       GLN  48  89.513  -4.905   6.314
  393    HB2  GLN  48           HB2      GLN  48  87.278  -4.336   7.563
  394    HB3  GLN  48           HB1      GLN  48  87.207  -5.206   6.030
  395    HG2  GLN  48           HG2      GLN  48  86.859  -7.296   7.111
  396    HG3  GLN  48           HG1      GLN  48  87.330  -6.649   8.682
  397   HE21  GLN  48          HE21      GLN  48  85.004  -5.489   6.170
  398   HE22  GLN  48          HE22      GLN  48  83.695  -5.351   7.241
  399    H    GLY  49           HN       GLY  49  87.786  -5.035   9.284
  400    HA2  GLY  49           HA2      GLY  49  88.657  -4.908  11.544
  401    HA3  GLY  49           HA1      GLY  49  90.255  -4.571  10.877
  402    H1U  RCY  50           H1U      RCY  50  82.830   3.006   5.332
  403    H1S  RCY  50           H1S      RCY  50  85.539   0.310   7.245
  404    HB1  RCY  50           HB1      RCY  50  87.109  -0.988   8.056
  405    HB2  RCY  50           HB2      RCY  50  88.699  -0.228   8.122
  406    HA   RCY  50           HA       RCY  50  88.766  -0.334  10.499
  407    HN1  RCY  50           HN1      RCY  50  87.885  -2.843   9.224
  408    H    GLY  51           HN       GLY  51  87.619  -0.950  12.559
  409    HA2  GLY  51           HA2      GLY  51  85.578   0.484  13.416
  410    HA3  GLY  51           HA1      GLY  51  84.663  -0.648  12.419
  411    H    ASP  52           HN       ASP  52  83.785  -0.938  14.804
  412    HA   ASP  52           HA       ASP  52  84.774  -3.509  15.721
  413    HB2  ASP  52           HB2      ASP  52  86.414  -1.876  16.746
  414    HB3  ASP  52           HB1      ASP  52  85.062  -1.189  17.647
  415    H    ASP  53           HN       ASP  53  82.290  -1.755  15.016
  416    HA   ASP  53           HA       ASP  53  80.458  -3.168  16.743
  417    HB2  ASP  53           HB2      ASP  53  81.356  -1.289  18.237
  418    HB3  ASP  53           HB1      ASP  53  80.513  -0.173  17.162
  419    H    ILE  54           HN       ILE  54  78.139  -2.225  16.364
  420    HA   ILE  54           HA       ILE  54  77.941  -1.577  13.467
  421    HB   ILE  54           HB       ILE  54  75.760  -2.461  15.377
  422   HG12  ILE  54          HG12      ILE  54  76.084  -4.674  14.124
  423   HG13  ILE  54          HG11      ILE  54  77.626  -4.017  13.572
  424   HG21  ILE  54          HG21      ILE  54  75.168  -1.249  13.204
  425   HG22  ILE  54          HG22      ILE  54  74.458  -2.850  13.412
  426   HG23  ILE  54          HG23      ILE  54  75.857  -2.636  12.359
  427   HD11  ILE  54          HD11      ILE  54  77.287  -5.398  15.916
  428   HD12  ILE  54          HD12      ILE  54  77.150  -3.728  16.469
  429   HD13  ILE  54          HD13      ILE  54  78.598  -4.258  15.613
  430    HA   PRO  55           HA       PRO  55  76.819   2.499  15.155
  431    HB2  PRO  55           HB2      PRO  55  77.351   3.951  12.932
  432    HB3  PRO  55           HB1      PRO  55  78.640   3.334  13.984
  433    HG2  PRO  55           HG2      PRO  55  77.686   2.297  11.368
  434    HG3  PRO  55           HG1      PRO  55  79.330   2.381  12.019
  435    HD2  PRO  55           HD2      PRO  55  77.752   0.086  12.005
  436    HD3  PRO  55           HD1      PRO  55  79.141   0.353  13.081
  437    H    GLY  56           HN       GLY  56  75.740   1.231  12.011
  438    HA2  GLY  56           HA2      GLY  56  73.493   3.030  11.763
  439    HA3  GLY  56           HA1      GLY  56  73.712   1.532  10.857
  440    H    MET  57           HN       MET  57  73.683  -0.429  12.687
  441    HA   MET  57           HA       MET  57  72.137  -1.750  13.870
  442    HB2  MET  57           HB2      MET  57  71.516   0.801  15.371
  443    HB3  MET  57           HB1      MET  57  71.493  -0.855  15.980
  444    HG2  MET  57           HG2      MET  57  73.968  -0.975  15.548
  445    HG3  MET  57           HG1      MET  57  73.930   0.743  15.148
  446    HE1  MET  57           HE1      MET  57  73.119  -1.981  17.411
  447    HE2  MET  57           HE2      MET  57  71.849  -1.114  18.271
  448    HE3  MET  57           HE3      MET  57  73.392  -1.422  19.066
  449    H    GLU  58           HN       GLU  58  70.857  -1.581  11.731
  450    HA   GLU  58           HA       GLU  58  68.834  -1.186  10.592
  451    HB2  GLU  58           HB2      GLU  58  68.250  -2.628  12.678
  452    HB3  GLU  58           HB1      GLU  58  67.561  -1.141  13.328
  453    HG2  GLU  58           HG2      GLU  58  66.218  -0.937  11.195
  454    HG3  GLU  58           HG1      GLU  58  66.777  -2.554  10.766
  455    H    GLY  59           HN       GLY  59  70.302   1.190  11.206
  456    HA2  GLY  59           HA2      GLY  59  68.046   3.117  11.279
  457    HA3  GLY  59           HA1      GLY  59  69.368   3.359  12.422
  458    H1U  RCY  60           H1U      RCY  60  70.818   7.488   3.172
  459    H1S  RCY  60           H1S      RCY  60  73.909   5.442   5.724
  460    HB1  RCY  60           HB1      RCY  60  71.770   2.809   7.092
  461    HB2  RCY  60           HB2      RCY  60  71.961   2.964   8.838
  462    HA   RCY  60           HA       RCY  60  70.420   5.167   8.236
  463    HN1  RCY  60           HN1      RCY  60  68.841   2.843   8.920
  464    H    GLY  61           HN       GLY  61  67.840   3.741   7.638
  465    HA2  GLY  61           HA2      GLY  61  68.064   2.903   4.844
  466    HA3  GLY  61           HA1      GLY  61  66.566   3.061   5.760
  467    H    THR  62           HN       THR  62  68.682   5.771   5.885
  468    HA   THR  62           HA       THR  62  66.729   7.342   4.313
  469    HB   THR  62           HB       THR  62  68.224   9.271   5.099
  470    HG1  THR  62           HG1      THR  62  69.174   7.571   7.067
  471   HG21  THR  62          HG21      THR  62  67.340   9.127   7.433
  472   HG22  THR  62          HG22      THR  62  66.876   7.455   7.116
  473   HG23  THR  62          HG23      THR  62  66.120   8.767   6.210
  474    H    ASP  63           HN       ASP  63  70.083   6.268   4.172
  475    HA   ASP  63           HA       ASP  63  70.821   7.900   1.906
  476    HB2  ASP  63           HB2      ASP  63  72.052   5.231   2.601
  477    HB3  ASP  63           HB1      ASP  63  72.828   6.638   1.870
  478    H    ILE  64           HN       ILE  64  68.285   6.334   1.697
  479    HA   ILE  64           HA       ILE  64  68.927   4.685  -0.710
  480    HB   ILE  64           HB       ILE  64  67.835   3.548   1.301
  481   HG12  ILE  64          HG12      ILE  64  66.311   3.610  -1.325
  482   HG13  ILE  64          HG11      ILE  64  67.727   2.614  -0.983
  483   HG21  ILE  64          HG21      ILE  64  65.367   5.017   0.358
  484   HG22  ILE  64          HG22      ILE  64  66.345   5.604   1.703
  485   HG23  ILE  64          HG23      ILE  64  65.560   4.028   1.805
  486   HD11  ILE  64          HD11      ILE  64  64.994   2.442   0.305
  487   HD12  ILE  64          HD12      ILE  64  66.414   1.628   0.962
  488   HD13  ILE  64          HD13      ILE  64  65.818   1.205  -0.643
  489    H    THR  65           HN       THR  65  66.699   7.037   0.684
  490    HA   THR  65           HA       THR  65  65.319   7.496  -1.855
  491    HB   THR  65           HB       THR  65  65.356   9.110   0.715
  492    HG1  THR  65           HG1      THR  65  64.209   7.516   1.413
  493   HG21  THR  65          HG21      THR  65  63.542   9.136  -1.710
  494   HG22  THR  65          HG22      THR  65  64.553  10.456  -1.121
  495   HG23  THR  65          HG23      THR  65  63.152   9.934  -0.186
  496    H    VAL  66           HN       VAL  66  68.107   8.686  -0.180
  497    HA   VAL  66           HA       VAL  66  68.262  11.088  -1.910
  498    HB   VAL  66           HB       VAL  66  70.260  10.328   0.213
  499   HG11  VAL  66          HG11      VAL  66  69.194  12.983  -0.797
  500   HG12  VAL  66          HG12      VAL  66  70.716  12.247  -1.297
  501   HG13  VAL  66          HG13      VAL  66  70.494  12.766   0.374
  502   HG21  VAL  66          HG21      VAL  66  68.156  10.122   1.357
  503   HG22  VAL  66          HG22      VAL  66  67.513  11.558   0.560
  504   HG23  VAL  66          HG23      VAL  66  68.793  11.715   1.763
  505    H    ILE  67           HN       ILE  67  70.382   8.300  -1.007
  506    HA   ILE  67           HA       ILE  67  71.572   8.588  -3.749
  507    HB   ILE  67           HB       ILE  67  73.134   8.306  -1.173
  508   HG12  ILE  67          HG12      ILE  67  72.294  10.594  -1.778
  509   HG13  ILE  67          HG11      ILE  67  74.054  10.475  -1.784
  510   HG21  ILE  67          HG21      ILE  67  74.343   6.991  -2.692
  511   HG22  ILE  67          HG22      ILE  67  75.067   8.584  -2.914
  512   HG23  ILE  67          HG23      ILE  67  73.877   7.987  -4.071
  513   HD11  ILE  67          HD11      ILE  67  72.216  11.014  -4.004
  514   HD12  ILE  67          HD12      ILE  67  73.381   9.741  -4.366
  515   HD13  ILE  67          HD13      ILE  67  73.945  11.338  -3.874
  516    H1U  RCY  68           H1U      RCY  68  71.900   6.031   1.983
  517    H1S  RCY  68           H1S      RCY  68  70.809   2.332  -0.695
  518    HB1  RCY  68           HB1      RCY  68  68.995   3.879  -4.540
  519    HB2  RCY  68           HB2      RCY  68  69.038   4.817  -3.049
  520    HA   RCY  68           HA       RCY  68  71.705   4.184  -3.423
  521    HN1  RCY  68           HN1      RCY  68  70.468   6.710  -4.420
  522    HA   PRO  69           HA       PRO  69  72.756   2.871  -7.490
  523    HB2  PRO  69           HB2      PRO  69  70.200   1.324  -7.812
  524    HB3  PRO  69           HB1      PRO  69  71.862   0.847  -8.220
  525    HG2  PRO  69           HG2      PRO  69  70.702  -0.028  -6.004
  526    HG3  PRO  69           HG1      PRO  69  72.411   0.439  -6.003
  527    HD2  PRO  69           HD2      PRO  69  70.073   1.870  -4.821
  528    HD3  PRO  69           HD1      PRO  69  71.778   1.882  -4.315
  529    H    TRP  70           HN       TRP  70  69.426   4.053  -7.197
  530    HA   TRP  70           HA       TRP  70  69.294   4.734 -10.044
  531    HD1  TRP  70           HD1      TRP  70  69.145   6.374  -6.629
  532    HE1  TRP  70           HE1      TRP  70  68.112   6.037  -4.293
  533    HE3  TRP  70           HE3      TRP  70  64.992   3.681  -7.882
  534    HZ2  TRP  70           HZ2      TRP  70  65.822   4.788  -3.108
  535    HZ3  TRP  70           HZ3      TRP  70  63.405   2.932  -6.136
  536    HH2  TRP  70           HH2      TRP  70  63.812   3.480  -3.754
  537    HB2  TRP  70           HB2      TRP  70  67.221   6.068  -9.216
  538    HB3  TRP  70           HB1      TRP  70  67.165   4.310  -9.165
  539    H    GLU  71           HN       GLU  71  71.086   5.995  -7.623
  540    HA   GLU  71           HA       GLU  71  71.240   8.625  -8.981
  541    HB2  GLU  71           HB2      GLU  71  70.616   8.224  -6.046
  542    HB3  GLU  71           HB1      GLU  71  71.303   9.725  -6.667
  543    HG2  GLU  71           HG2      GLU  71  69.401  10.007  -8.181
  544    HG3  GLU  71           HG1      GLU  71  68.725   8.466  -7.652
  545    H    ALA  72           HN       ALA  72  72.699   5.953  -7.644
  546    HA   ALA  72           HA       ALA  72  75.082   7.216  -6.546
  547    HB1  ALA  72           HB1      ALA  72  74.083   4.833  -6.083
  548    HB2  ALA  72           HB2      ALA  72  75.833   5.043  -6.112
  549    HB3  ALA  72           HB3      ALA  72  75.003   4.370  -7.515
  550    H1U  RCY  73           H1U      RCY  73  74.160   3.547  -4.924
  551    H1S  RCY  73           H1S      RCY  73  78.465   2.880  -7.041
  552    HB1  RCY  73           HB1      RCY  73  79.354   5.607  -8.938
  553    HB2  RCY  73           HB2      RCY  73  79.312   5.128 -10.634
  554    HA   RCY  73           HA       RCY  73  77.727   6.999 -10.090
  555    HN1  RCY  73           HN1      RCY  73  76.850   5.225  -7.985
  556    H    ASN  74           HN       ASN  74  76.167   3.788 -10.105
  557    HA   ASN  74           HA       ASN  74  74.547   4.347 -12.383
  558    HB2  ASN  74           HB2      ASN  74  75.797   2.713 -13.952
  559    HB3  ASN  74           HB1      ASN  74  76.459   4.339 -13.785
  560   HD21  ASN  74          HD21      ASN  74  78.590   4.519 -12.999
  561   HD22  ASN  74          HD22      ASN  74  79.494   3.217 -12.392
  562    H    HIS  75           HN       HIS  75  76.044   1.281 -12.641
  563    HA   HIS  75           HA       HIS  75  73.634  -0.046 -11.673
  564    HD1  HIS  75           HD1      HIS  75  72.871  -0.870 -14.018
  565    HD2  HIS  75           HD2      HIS  75  76.916  -0.442 -14.941
  566    HE1  HIS  75           HE1      HIS  75  72.980  -0.196 -16.457
  567    HE2  HIS  75           HE2      HIS  75  75.437   0.068 -17.032
  568    HB2  HIS  75           HB2      HIS  75  76.304  -1.293 -12.389
  569    HB3  HIS  75           HB1      HIS  75  74.738  -2.101 -12.326
  570    H1U  RCY  76           H1U      RCY  76  74.044  -3.587  -0.678
  571    H1S  RCY  76           H1S      RCY  76  73.361  -1.883  -5.020
  572    HB1  RCY  76           HB1      RCY  76  74.630  -3.028  -7.674
  573    HB2  RCY  76           HB2      RCY  76  74.157  -1.360  -7.993
  574    HA   RCY  76           HA       RCY  76  76.789  -1.014  -8.179
  575    HN1  RCY  76           HN1      RCY  76  75.872  -2.143 -10.663
  576    H    GLU  77           HN       GLU  77  78.699  -2.114  -8.800
  577    HA   GLU  77           HA       GLU  77  78.720  -4.945  -9.412
  578    HB2  GLU  77           HB2      GLU  77  81.051  -3.277  -8.435
  579    HB3  GLU  77           HB1      GLU  77  81.115  -4.747  -9.407
  580    HG2  GLU  77           HG2      GLU  77  80.010  -3.599 -11.268
  581    HG3  GLU  77           HG1      GLU  77  79.859  -2.134 -10.297
  582    H    LEU  78           HN       LEU  78  81.176  -5.124  -7.502
  583    HA   LEU  78           HA       LEU  78  80.134  -5.143  -4.824
  584    HG   LEU  78           HG       LEU  78  79.047  -8.504  -4.028
  585    HB2  LEU  78           HB2      LEU  78  78.909  -7.094  -6.084
  586    HB3  LEU  78           HB1      LEU  78  80.456  -7.924  -5.943
  587   HD11  LEU  78          HD11      LEU  78  80.632  -8.092  -2.329
  588   HD12  LEU  78          HD12      LEU  78  81.061  -6.514  -2.989
  589   HD13  LEU  78          HD13      LEU  78  81.581  -7.984  -3.812
  590   HD21  LEU  78          HD21      LEU  78  79.085  -5.740  -2.942
  591   HD22  LEU  78          HD22      LEU  78  77.839  -6.981  -2.815
  592   HD23  LEU  78          HD23      LEU  78  77.982  -6.022  -4.288
  593    H    HIS  79           HN       HIS  79  82.223  -7.273  -6.806
  594    HA   HIS  79           HA       HIS  79  84.673  -6.125  -5.839
  595    HD1  HIS  79           HD1      HIS  79  86.001 -10.015  -3.948
  596    HD2  HIS  79           HD2      HIS  79  86.710  -5.929  -4.390
  597    HE1  HIS  79           HE1      HIS  79  88.480  -9.673  -3.557
  598    HE2  HIS  79           HE2      HIS  79  88.925  -7.189  -3.823
  599    HB2  HIS  79           HB2      HIS  79  83.888  -7.266  -3.742
  600    HB3  HIS  79           HB1      HIS  79  83.933  -8.799  -4.612
  601    H    GLU  80           HN       GLU  80  82.968  -7.770  -8.009
  602    HA   GLU  80           HA       GLU  80  85.122  -9.623  -8.871
  603    HB2  GLU  80           HB2      GLU  80  83.226  -9.917 -10.773
  604    HB3  GLU  80           HB1      GLU  80  83.161 -10.772  -9.234
  605    HG2  GLU  80           HG2      GLU  80  81.669  -9.128  -8.296
  606    HG3  GLU  80           HG1      GLU  80  81.878  -8.066  -9.689
  607    H    LEU  81           HN       LEU  81  83.069  -7.160 -10.501
  608    HA   LEU  81           HA       LEU  81  85.179  -6.762 -12.518
  609    HG   LEU  81           HG       LEU  81  81.966  -6.791 -14.234
  610    HB2  LEU  81           HB2      LEU  81  82.391  -5.667 -12.129
  611    HB3  LEU  81           HB1      LEU  81  83.479  -4.985 -13.337
  612   HD11  LEU  81          HD11      LEU  81  83.598  -7.531 -15.688
  613   HD12  LEU  81          HD12      LEU  81  84.744  -7.875 -14.393
  614   HD13  LEU  81          HD13      LEU  81  84.487  -6.213 -14.924
  615   HD21  LEU  81          HD21      LEU  81  83.726  -8.689 -12.672
  616   HD22  LEU  81          HD22      LEU  81  82.233  -9.048 -13.540
  617   HD23  LEU  81          HD23      LEU  81  82.180  -8.127 -12.036
  618    H    ALA  82           HN       ALA  82  84.116  -5.313  -9.561
  619    HA   ALA  82           HA       ALA  82  85.018  -2.640  -9.958
  620    HB1  ALA  82           HB1      ALA  82  83.673  -3.557  -7.991
  621    HB2  ALA  82           HB2      ALA  82  84.961  -2.425  -7.578
  622    HB3  ALA  82           HB3      ALA  82  85.201  -4.157  -7.347
  623    H    GLN  83           HN       GLN  83  86.902  -2.683  -7.596
  624    HA   GLN  83           HA       GLN  83  89.228  -2.684  -7.293
  625    HB2  GLN  83           HB2      GLN  83  89.275  -5.086  -9.127
  626    HB3  GLN  83           HB1      GLN  83  90.370  -4.709  -7.797
  627    HG2  GLN  83           HG2      GLN  83  88.471  -4.946  -6.204
  628    HG3  GLN  83           HG1      GLN  83  87.432  -5.417  -7.550
  629   HE21  GLN  83          HE21      GLN  83  87.328  -7.635  -7.923
  630   HE22  GLN  83          HE22      GLN  83  88.500  -8.761  -7.434
  631    H    TYR  84           HN       TYR  84  87.766  -2.024 -10.148
  632    HA   TYR  84           HA       TYR  84  90.348  -1.196 -11.418
  633    HD1  TYR  84           HD1      TYR  84  90.267  -4.386 -12.319
  634    HD2  TYR  84           HD2      TYR  84  90.308  -0.817 -14.709
  635    HE1  TYR  84           HE1      TYR  84  92.331  -5.167 -13.450
  636    HE2  TYR  84           HE2      TYR  84  92.372  -1.598 -15.840
  637    HH   TYR  84           HH       TYR  84  94.267  -4.115 -14.670
  638    HB2  TYR  84           HB2      TYR  84  88.297  -2.928 -12.471
  639    HB3  TYR  84           HB1      TYR  84  88.333  -1.449 -13.428
  640    H    GLY  85           HN       GLY  85  87.384  -0.300 -10.104
  641    HA2  GLY  85           HA2      GLY  85  87.757   2.477 -11.043
  642    HA3  GLY  85           HA1      GLY  85  86.198   1.729 -11.402
  643    H    ILE  86           HN       ILE  86  87.695   0.611  -8.541
  644    HA   ILE  86           HA       ILE  86  85.553   1.461  -6.857
  645    HB   ILE  86           HB       ILE  86  87.112  -0.461  -6.396
  646   HG12  ILE  86          HG12      ILE  86  87.573   0.616  -3.895
  647   HG13  ILE  86          HG11      ILE  86  86.254   1.618  -4.500
  648   HG21  ILE  86          HG21      ILE  86  89.338  -0.146  -6.191
  649   HG22  ILE  86          HG22      ILE  86  89.109   1.178  -5.048
  650   HG23  ILE  86          HG23      ILE  86  89.073   1.494  -6.783
  651   HD11  ILE  86          HD11      ILE  86  85.379  -0.367  -3.325
  652   HD12  ILE  86          HD12      ILE  86  86.272  -1.414  -4.428
  653   HD13  ILE  86          HD13      ILE  86  84.955  -0.412  -5.037
  654    H1U  RCY  87           H1U      RCY  87  84.772  -0.140  -3.269
  655    H1S  RCY  87           H1S      RCY  87  85.456   4.146  -2.349
  656    HB1  RCY  87           HB1      RCY  87  89.632   5.148  -3.575
  657    HB2  RCY  87           HB2      RCY  87  89.345   3.407  -3.560
  658    HA   RCY  87           HA       RCY  87  87.295   5.114  -4.898
  659    HN1  RCY  87           HN1      RCY  87  87.992   2.336  -4.915
  Start of MODEL   31
    1    HA   MET   1           HA       MET   1  66.836 -14.244  -2.955
    2    HB2  MET   1           HB2      MET   1  65.549 -15.712  -4.669
    3    HB3  MET   1           HB1      MET   1  65.897 -17.046  -3.569
    4    HG2  MET   1           HG2      MET   1  63.792 -16.236  -2.847
    5    HG3  MET   1           HG1      MET   1  64.941 -15.521  -1.716
    6    HE1  MET   1           HE1      MET   1  63.320 -15.068  -5.179
    7    HE2  MET   1           HE2      MET   1  62.464 -13.540  -4.986
    8    HE3  MET   1           HE3      MET   1  62.030 -14.918  -3.978
    9    H    ASN   2           HN       ASN   2  65.994 -17.076  -1.735
   10    HA   ASN   2           HA       ASN   2  68.335 -18.078  -0.425
   11    HB2  ASN   2           HB2      ASN   2  67.735 -17.141   1.884
   12    HB3  ASN   2           HB1      ASN   2  68.493 -16.013   0.761
   13   HD21  ASN   2          HD21      ASN   2  67.484 -14.056   1.423
   14   HD22  ASN   2          HD22      ASN   2  65.806 -13.808   1.377
   15    H    LEU   3           HN       LEU   3  67.602 -19.379   1.633
   16    HA   LEU   3           HA       LEU   3  65.106 -20.786   0.870
   17    HG   LEU   3           HG       LEU   3  68.375 -21.299   1.064
   18    HB2  LEU   3           HB2      LEU   3  67.033 -21.562   3.067
   19    HB3  LEU   3           HB1      LEU   3  65.888 -22.595   2.212
   20   HD11  LEU   3          HD11      LEU   3  68.569 -23.421   2.458
   21   HD12  LEU   3          HD12      LEU   3  69.178 -23.544   0.808
   22   HD13  LEU   3          HD13      LEU   3  67.602 -24.221   1.219
   23   HD21  LEU   3          HD21      LEU   3  67.641 -22.697  -0.987
   24   HD22  LEU   3          HD22      LEU   3  66.784 -21.185  -0.689
   25   HD23  LEU   3          HD23      LEU   3  66.047 -22.721  -0.232
   26    H    GLU   4           HN       GLU   4  65.119 -18.111   2.240
   27    HA   GLU   4           HA       GLU   4  64.170 -18.701   4.954
   28    HB2  GLU   4           HB2      GLU   4  64.590 -16.220   3.318
   29    HB3  GLU   4           HB1      GLU   4  63.535 -16.138   4.729
   30    HG2  GLU   4           HG2      GLU   4  65.882 -15.567   5.302
   31    HG3  GLU   4           HG1      GLU   4  65.334 -17.012   6.153
   32    HA   PRO   5           HA       PRO   5  59.940 -19.715   4.003
   33    HB2  PRO   5           HB2      PRO   5  59.428 -17.674   6.147
   34    HB3  PRO   5           HB1      PRO   5  58.709 -19.283   5.933
   35    HG2  PRO   5           HG2      PRO   5  60.672 -18.828   7.695
   36    HG3  PRO   5           HG1      PRO   5  60.528 -20.360   6.820
   37    HD2  PRO   5           HD2      PRO   5  62.555 -18.234   6.518
   38    HD3  PRO   5           HD1      PRO   5  62.621 -19.932   6.000
   39    HA   PRO   6           HA       PRO   6  59.271 -15.869   1.597
   40    HB2  PRO   6           HB2      PRO   6  58.528 -17.036  -0.725
   41    HB3  PRO   6           HB1      PRO   6  60.227 -16.953  -0.220
   42    HG2  PRO   6           HG2      PRO   6  58.348 -19.245  -0.140
   43    HG3  PRO   6           HG1      PRO   6  60.090 -19.220  -0.451
   44    HD2  PRO   6           HD2      PRO   6  58.878 -19.885   1.996
   45    HD3  PRO   6           HD1      PRO   6  60.590 -19.471   1.767
   46    H    LYS   7           HN       LYS   7  57.346 -14.739   1.366
   47    HA   LYS   7           HA       LYS   7  54.793 -16.303   1.417
   48    HB2  LYS   7           HB2      LYS   7  55.346 -13.741   2.950
   49    HB3  LYS   7           HB1      LYS   7  53.833 -14.645   2.942
   50    HG2  LYS   7           HG2      LYS   7  54.724 -15.594   4.828
   51    HG3  LYS   7           HG1      LYS   7  55.541 -16.624   3.651
   52    HD2  LYS   7           HD2      LYS   7  57.489 -15.121   3.668
   53    HD3  LYS   7           HD1      LYS   7  56.675 -14.068   4.827
   54    HE2  LYS   7           HE2      LYS   7  57.341 -16.987   5.314
   55    HE3  LYS   7           HE1      LYS   7  58.274 -15.624   5.933
   56    HZ1  LYS   7           HZ1      LYS   7  55.378 -15.934   6.459
   57    HZ2  LYS   7           HZ2      LYS   7  56.485 -14.919   7.251
   58    HZ3  LYS   7           HZ3      LYS   7  56.559 -16.601   7.477
   59    H    ALA   8           HN       ALA   8  53.100 -14.038   1.295
   60    HA   ALA   8           HA       ALA   8  53.192 -13.450  -1.512
   61    HB1  ALA   8           HB1      ALA   8  51.131 -13.399  -0.037
   62    HB2  ALA   8           HB2      ALA   8  51.310 -12.002  -1.099
   63    HB3  ALA   8           HB3      ALA   8  51.719 -11.868   0.611
   64    H    GLU   9           HN       GLU   9  55.575 -12.735  -1.368
   65    HA   GLU   9           HA       GLU   9  56.033 -10.045  -0.294
   66    HB2  GLU   9           HB2      GLU   9  57.753 -11.976  -0.455
   67    HB3  GLU   9           HB1      GLU   9  57.884 -11.535  -2.158
   68    HG2  GLU   9           HG2      GLU   9  59.581 -10.265  -1.107
   69    HG3  GLU   9           HG1      GLU   9  58.253  -9.121  -1.305
   70    H1U  RCY  10           H1U      RCY  10  57.175  -1.957  -0.881
   71    H1S  RCY  10           H1S      RCY  10  53.836  -3.570  -2.539
   72    HB1  RCY  10           HB1      RCY  10  55.766  -5.716  -3.890
   73    HB2  RCY  10           HB2      RCY  10  55.857  -6.176  -2.194
   74    HA   RCY  10           HA       RCY  10  54.394  -8.079  -3.923
   75    HN1  RCY  10           HN1      RCY  10  55.632  -8.206  -1.415
   76    H    ARG  11           HN       ARG  11  55.580  -6.778  -5.842
   77    HA   ARG  11           HA       ARG  11  57.252  -6.786  -7.497
   78    HE   ARG  11           HE       ARG  11  61.216  -4.325  -7.928
   79    HB2  ARG  11           HB2      ARG  11  58.739  -6.813  -5.265
   80    HB3  ARG  11           HB1      ARG  11  59.105  -8.442  -5.826
   81    HG2  ARG  11           HG2      ARG  11  60.760  -6.984  -6.787
   82    HG3  ARG  11           HG1      ARG  11  59.655  -7.432  -8.086
   83    HD2  ARG  11           HD2      ARG  11  59.097  -5.278  -8.418
   84    HD3  ARG  11           HD1      ARG  11  58.655  -5.095  -6.721
   85   HH11  ARG  11          HH21      ARG  11  59.420  -5.149  -5.102
   86   HH12  ARG  11          HH22      ARG  11  60.495  -4.330  -4.019
   87   HH21  ARG  11          HH11      ARG  11  62.629  -3.250  -6.529
   88   HH22  ARG  11          HH12      ARG  11  62.311  -3.254  -4.827
   89    H    SER  12           HN       SER  12  59.141  -9.127  -7.718
   90    HA   SER  12           HA       SER  12  57.417 -11.476  -7.942
   91    HG   SER  12           HG       SER  12  58.889 -10.209 -11.380
   92    HB2  SER  12           HB2      SER  12  57.738 -11.657 -10.433
   93    HB3  SER  12           HB1      SER  12  56.682 -10.335  -9.946
   94    H    ALA  13           HN       ALA  13  59.983 -10.920 -10.246
   95    HA   ALA  13           HA       ALA  13  62.110 -11.962  -8.559
   96    HB1  ALA  13           HB1      ALA  13  62.395 -14.097  -9.794
   97    HB2  ALA  13           HB2      ALA  13  60.896 -13.778 -10.665
   98    HB3  ALA  13           HB3      ALA  13  60.863 -14.047  -8.922
   99    H    THR  14           HN       THR  14  61.853  -9.683 -10.224
  100    HA   THR  14           HA       THR  14  63.463 -10.331 -12.642
  101    HB   THR  14           HB       THR  14  62.954  -8.048 -13.354
  102    HG1  THR  14           HG1      THR  14  62.796  -6.752 -11.698
  103   HG21  THR  14          HG21      THR  14  61.257  -9.852 -13.699
  104   HG22  THR  14          HG22      THR  14  60.540  -8.246 -13.570
  105   HG23  THR  14          HG23      THR  14  60.475  -9.353 -12.198
  106    H    ARG  15           HN       ARG  15  65.307 -10.829 -11.098
  107    HA   ARG  15           HA       ARG  15  66.924  -8.376 -10.745
  108    HE   ARG  15           HE       ARG  15  67.728  -6.158  -6.413
  109    HB2  ARG  15           HB2      ARG  15  65.651  -8.911  -8.571
  110    HB3  ARG  15           HB1      ARG  15  66.673 -10.343  -8.463
  111    HG2  ARG  15           HG2      ARG  15  67.891  -8.758  -7.233
  112    HG3  ARG  15           HG1      ARG  15  68.643  -8.666  -8.826
  113    HD2  ARG  15           HD2      ARG  15  68.201  -6.450  -8.753
  114    HD3  ARG  15           HD1      ARG  15  66.513  -6.890  -9.014
  115   HH11  ARG  15          HH21      ARG  15  65.070  -7.292  -8.293
  116   HH12  ARG  15          HH22      ARG  15  63.889  -6.951  -7.073
  117   HH21  ARG  15          HH11      ARG  15  66.202  -5.706  -4.809
  118   HH22  ARG  15          HH12      ARG  15  64.530  -6.053  -5.100
  119    H    VAL  16           HN       VAL  16  66.651 -11.877 -10.855
  120    HA   VAL  16           HA       VAL  16  69.345 -12.633 -10.550
  121    HB   VAL  16           HB       VAL  16  67.377 -13.795 -12.543
  122   HG11  VAL  16          HG11      VAL  16  69.779 -14.966 -11.106
  123   HG12  VAL  16          HG12      VAL  16  69.682 -14.593 -12.827
  124   HG13  VAL  16          HG13      VAL  16  68.678 -15.871 -12.145
  125   HG21  VAL  16          HG21      VAL  16  66.917 -15.388 -10.607
  126   HG22  VAL  16          HG22      VAL  16  66.292 -13.752 -10.402
  127   HG23  VAL  16          HG23      VAL  16  67.770 -14.241  -9.573
  128    H    MET  17           HN       MET  17  70.658 -10.966 -11.501
  129    HA   MET  17           HA       MET  17  71.891  -9.970 -13.233
  130    HB2  MET  17           HB2      MET  17  72.298 -12.472 -13.621
  131    HB3  MET  17           HB1      MET  17  71.074 -12.367 -14.886
  132    HG2  MET  17           HG2      MET  17  72.391 -10.533 -15.953
  133    HG3  MET  17           HG1      MET  17  73.646 -10.768 -14.736
  134    HE1  MET  17           HE1      MET  17  74.745 -10.644 -16.998
  135    HE2  MET  17           HE2      MET  17  73.813 -11.355 -18.314
  136    HE3  MET  17           HE3      MET  17  75.331 -12.098 -17.816
  137    H    GLY  18           HN       GLY  18  69.979  -8.412 -13.269
  138    HA2  GLY  18           HA2      GLY  18  69.280  -7.701 -15.893
  139    HA3  GLY  18           HA1      GLY  18  67.942  -8.680 -15.289
  140    H    GLY  19           HN       GLY  19  66.569  -6.775 -15.357
  141    HA2  GLY  19           HA2      GLY  19  65.405  -5.143 -14.098
  142    HA3  GLY  19           HA1      GLY  19  66.646  -5.272 -12.850
  143    HA   PRO  20           HA       PRO  20  68.388  -2.453 -16.580
  144    HB2  PRO  20           HB2      PRO  20  65.658  -1.390 -17.216
  145    HB3  PRO  20           HB1      PRO  20  67.050  -1.635 -18.290
  146    HG2  PRO  20           HG2      PRO  20  64.982  -3.314 -18.282
  147    HG3  PRO  20           HG1      PRO  20  66.642  -3.883 -18.525
  148    HD2  PRO  20           HD2      PRO  20  64.882  -4.194 -16.144
  149    HD3  PRO  20           HD1      PRO  20  66.220  -5.221 -16.702
  150    H1U  RCY  21           H1U      RCY  21  64.593   2.182  -8.573
  151    H1S  RCY  21           H1S      RCY  21  67.890   1.688 -10.911
  152    HB1  RCY  21           HB1      RCY  21  69.961   1.611 -12.973
  153    HB2  RCY  21           HB2      RCY  21  70.338   0.032 -13.659
  154    HA   RCY  21           HA       RCY  21  67.491   0.918 -13.769
  155    HN1  RCY  21           HN1      RCY  21  69.217  -0.609 -15.683
  156    H    THR  22           HN       THR  22  66.771   2.522 -15.202
  157    HA   THR  22           HA       THR  22  68.508   3.825 -17.104
  158    HB   THR  22           HB       THR  22  66.299   4.119 -17.724
  159    HG1  THR  22           HG1      THR  22  66.043   6.333 -16.141
  160   HG21  THR  22          HG21      THR  22  65.761   4.319 -14.761
  161   HG22  THR  22          HG22      THR  22  65.195   3.092 -15.895
  162   HG23  THR  22          HG23      THR  22  64.530   4.725 -15.956
  163    HA   PRO  23           HA       PRO  23  70.539   6.701 -14.424
  164    HB2  PRO  23           HB2      PRO  23  70.940   8.815 -16.120
  165    HB3  PRO  23           HB1      PRO  23  71.849   7.296 -16.231
  166    HG2  PRO  23           HG2      PRO  23  69.523   8.221 -17.842
  167    HG3  PRO  23           HG1      PRO  23  70.983   7.357 -18.356
  168    HD2  PRO  23           HD2      PRO  23  68.579   6.105 -17.971
  169    HD3  PRO  23           HD1      PRO  23  70.141   5.289 -17.739
  170    H    ARG  24           HN       ARG  24  68.050   6.780 -13.550
  171    HA   ARG  24           HA       ARG  24  67.472   9.676 -13.259
  172    HE   ARG  24           HE       ARG  24  64.663  12.115 -16.046
  173    HB2  ARG  24           HB2      ARG  24  65.531   7.594 -14.279
  174    HB3  ARG  24           HB1      ARG  24  64.976   9.079 -13.508
  175    HG2  ARG  24           HG2      ARG  24  66.867   9.015 -15.877
  176    HG3  ARG  24           HG1      ARG  24  65.122   9.235 -16.018
  177    HD2  ARG  24           HD2      ARG  24  65.655  11.115 -14.154
  178    HD3  ARG  24           HD1      ARG  24  67.193  11.118 -15.016
  179   HH11  ARG  24          HH21      ARG  24  67.690  10.641 -16.790
  180   HH12  ARG  24          HH22      ARG  24  67.738  11.248 -18.412
  181   HH21  ARG  24          HH11      ARG  24  64.708  12.917 -18.159
  182   HH22  ARG  24          HH12      ARG  24  66.050  12.537 -19.186
  183    H    LYS  25           HN       LYS  25  68.528   8.929 -11.163
  184    HA   LYS  25           HA       LYS  25  66.424   7.841  -9.331
  185    HB2  LYS  25           HB2      LYS  25  68.538   7.009  -8.001
  186    HB3  LYS  25           HB1      LYS  25  67.929   6.055  -9.352
  187    HG2  LYS  25           HG2      LYS  25  70.366   6.316  -9.532
  188    HG3  LYS  25           HG1      LYS  25  69.563   7.163 -10.855
  189    HD2  LYS  25           HD2      LYS  25  69.952   9.279  -9.904
  190    HD3  LYS  25           HD1      LYS  25  70.234   8.607  -8.298
  191    HE2  LYS  25           HE2      LYS  25  72.369   9.278  -9.264
  192    HE3  LYS  25           HE1      LYS  25  72.309   7.518  -9.163
  193    HZ1  LYS  25           HZ1      LYS  25  72.914   8.895 -11.385
  194    HZ2  LYS  25           HZ2      LYS  25  71.253   8.619 -11.614
  195    HZ3  LYS  25           HZ3      LYS  25  72.309   7.310 -11.375
  196    H    GLY  26           HN       GLY  26  67.740  10.592 -10.142
  197    HA2  GLY  26           HA2      GLY  26  68.091  12.614  -9.004
  198    HA3  GLY  26           HA1      GLY  26  67.348  11.849  -7.600
  199    HA   PRO  27           HA       PRO  27  72.141  10.868  -7.565
  200    HB2  PRO  27           HB2      PRO  27  73.166  13.194  -9.083
  201    HB3  PRO  27           HB1      PRO  27  73.599  11.481  -9.226
  202    HG2  PRO  27           HG2      PRO  27  72.165  12.763 -11.092
  203    HG3  PRO  27           HG1      PRO  27  71.928  11.046 -10.723
  204    HD2  PRO  27           HD2      PRO  27  70.246  13.396  -9.913
  205    HD3  PRO  27           HD1      PRO  27  69.742  11.753 -10.371
  206    HA   PRO  28           HA       PRO  28  73.030  13.365  -4.034
  207    HB2  PRO  28           HB2      PRO  28  75.653  14.021  -5.343
  208    HB3  PRO  28           HB1      PRO  28  75.327  13.502  -3.677
  209    HG2  PRO  28           HG2      PRO  28  76.251  11.811  -5.533
  210    HG3  PRO  28           HG1      PRO  28  75.133  11.294  -4.261
  211    HD2  PRO  28           HD2      PRO  28  74.635  11.610  -7.158
  212    HD3  PRO  28           HD1      PRO  28  73.726  10.670  -5.955
  213    H    LYS  29           HN       LYS  29  72.484  15.462  -3.522
  214    HA   LYS  29           HA       LYS  29  73.365  17.742  -5.083
  215    HB2  LYS  29           HB2      LYS  29  71.490  16.715  -6.486
  216    HB3  LYS  29           HB1      LYS  29  70.396  17.169  -5.179
  217    HG2  LYS  29           HG2      LYS  29  71.313  19.532  -5.390
  218    HG3  LYS  29           HG1      LYS  29  72.105  19.002  -6.875
  219    HD2  LYS  29           HD2      LYS  29  69.125  18.833  -6.331
  220    HD3  LYS  29           HD1      LYS  29  69.906  20.051  -7.340
  221    HE2  LYS  29           HE2      LYS  29  70.901  18.022  -8.628
  222    HE3  LYS  29           HE1      LYS  29  69.626  17.093  -7.840
  223    HZ1  LYS  29           HZ1      LYS  29  69.336  18.473 -10.135
  224    HZ2  LYS  29           HZ2      LYS  29  68.732  19.576  -8.993
  225    HZ3  LYS  29           HZ3      LYS  29  68.062  18.019  -9.112
  226    H1U  RCY  30           H1U      RCY  30  72.221  12.160  -4.813
  227    H1S  RCY  30           H1S      RCY  30  69.868  14.585  -2.614
  228    HB1  RCY  30           HB1      RCY  30  68.891  17.342  -1.237
  229    HB2  RCY  30           HB2      RCY  30  69.581  17.578   0.369
  230    HA   RCY  30           HA       RCY  30  70.629  19.009  -1.430
  231    HN1  RCY  30           HN1      RCY  30  71.037  16.444  -2.738
  232    H    LYS  31           HN       LYS  31  73.433  17.987  -1.768
  233    HA   LYS  31           HA       LYS  31  75.406  17.833  -0.502
  234    HB2  LYS  31           HB2      LYS  31  73.734  19.449   1.449
  235    HB3  LYS  31           HB1      LYS  31  75.492  19.321   1.458
  236    HG2  LYS  31           HG2      LYS  31  74.115  20.214  -1.053
  237    HG3  LYS  31           HG1      LYS  31  74.325  21.368   0.264
  238    HD2  LYS  31           HD2      LYS  31  76.674  19.713  -0.590
  239    HD3  LYS  31           HD1      LYS  31  76.203  21.095  -1.579
  240    HE2  LYS  31           HE2      LYS  31  76.284  22.532   0.463
  241    HE3  LYS  31           HE1      LYS  31  76.878  21.145   1.376
  242    HZ1  LYS  31           HZ1      LYS  31  78.795  22.255   0.738
  243    HZ2  LYS  31           HZ2      LYS  31  78.202  22.618  -0.812
  244    HZ3  LYS  31           HZ3      LYS  31  78.663  21.029  -0.427
  245    H    GLN  32           HN       GLN  32  75.887  17.566   2.203
  246    HA   GLN  32           HA       GLN  32  74.507  14.982   2.821
  247    HB2  GLN  32           HB2      GLN  32  76.645  14.811   4.383
  248    HB3  GLN  32           HB1      GLN  32  76.758  14.420   2.667
  249    HG2  GLN  32           HG2      GLN  32  78.580  15.955   3.469
  250    HG3  GLN  32           HG1      GLN  32  77.614  16.631   2.157
  251   HE21  GLN  32          HE21      GLN  32  76.977  16.412   5.704
  252   HE22  GLN  32          HE22      GLN  32  76.715  18.077   5.906
  253    H    ARG  33           HN       ARG  33  73.847  17.930   3.542
  254    HA   ARG  33           HA       ARG  33  74.166  18.018   6.440
  255    HE   ARG  33           HE       ARG  33  71.045  22.134   5.341
  256    HB2  ARG  33           HB2      ARG  33  73.889  19.992   4.761
  257    HB3  ARG  33           HB1      ARG  33  72.164  19.662   4.901
  258    HG2  ARG  33           HG2      ARG  33  72.276  19.949   7.330
  259    HG3  ARG  33           HG1      ARG  33  74.021  20.196   7.241
  260    HD2  ARG  33           HD2      ARG  33  73.211  22.394   7.302
  261    HD3  ARG  33           HD1      ARG  33  73.408  22.115   5.572
  262   HH11  ARG  33          HH21      ARG  33  72.078  21.982   8.626
  263   HH12  ARG  33          HH22      ARG  33  70.498  22.269   9.276
  264   HH21  ARG  33          HH11      ARG  33  68.976  22.510   6.170
  265   HH22  ARG  33          HH12      ARG  33  68.742  22.568   7.885
  266    H    GLN  34           HN       GLN  34  73.058  15.611   5.937
  267    HA   GLN  34           HA       GLN  34  70.164  15.617   5.954
  268    HB2  GLN  34           HB2      GLN  34  70.453  13.221   6.697
  269    HB3  GLN  34           HB1      GLN  34  71.313  13.624   5.210
  270    HG2  GLN  34           HG2      GLN  34  73.396  13.929   6.466
  271    HG3  GLN  34           HG1      GLN  34  72.551  13.599   7.979
  272   HE21  GLN  34          HE21      GLN  34  70.859  11.464   6.672
  273   HE22  GLN  34          HE22      GLN  34  71.893  10.130   6.488
  274    H    THR  35           HN       THR  35  70.806  17.475   7.827
  275    HA   THR  35           HA       THR  35  70.237  18.078  10.021
  276    HB   THR  35           HB       THR  35  69.406  15.257  10.636
  277    HG1  THR  35           HG1      THR  35  67.484  16.774   9.443
  278   HG21  THR  35          HG21      THR  35  69.208  17.113  12.298
  279   HG22  THR  35          HG22      THR  35  67.651  16.400  11.876
  280   HG23  THR  35          HG23      THR  35  68.128  17.950  11.182
  281    H    ARG  36           HN       ARG  36  71.346  14.672  10.221
  282    HA   ARG  36           HA       ARG  36  73.693  15.621  11.799
  283    HE   ARG  36           HE       ARG  36  74.818  13.090  16.499
  284    HB2  ARG  36           HB2      ARG  36  71.913  14.874  13.380
  285    HB3  ARG  36           HB1      ARG  36  71.915  13.295  12.595
  286    HG2  ARG  36           HG2      ARG  36  74.177  12.866  13.262
  287    HG3  ARG  36           HG1      ARG  36  74.406  14.535  13.785
  288    HD2  ARG  36           HD2      ARG  36  72.944  14.259  15.647
  289    HD3  ARG  36           HD1      ARG  36  72.319  12.732  15.023
  290   HH11  ARG  36          HH21      ARG  36  73.003  11.223  14.239
  291   HH12  ARG  36          HH22      ARG  36  73.869   9.756  14.552
  292   HH21  ARG  36          HH11      ARG  36  75.960  11.185  16.921
  293   HH22  ARG  36          HH12      ARG  36  75.543   9.735  16.070
  294    H    GLN  37           HN       GLN  37  74.878  15.158   9.825
  295    HA   GLN  37           HA       GLN  37  74.865  12.817   8.319
  296    HB2  GLN  37           HB2      GLN  37  77.602  13.725   8.950
  297    HB3  GLN  37           HB1      GLN  37  76.775  13.647   7.397
  298    HG2  GLN  37           HG2      GLN  37  75.479  15.695   8.049
  299    HG3  GLN  37           HG1      GLN  37  76.475  15.808   9.500
  300   HE21  GLN  37          HE21      GLN  37  77.017  17.994   8.316
  301   HE22  GLN  37          HE22      GLN  37  78.331  17.955   7.242
  302    H1U  RCY  38           H1U      RCY  38  81.429   6.559   6.442
  303    H1S  RCY  38           H1S      RCY  38  78.984   8.265   9.170
  304    HB1  RCY  38           HB1      RCY  38  76.931   9.417  10.793
  305    HB2  RCY  38           HB2      RCY  38  78.630   9.416  11.263
  306    HA   RCY  38           HA       RCY  38  76.922  11.087  12.414
  307    HN1  RCY  38           HN1      RCY  38  77.496  13.221  10.685
  308    H    LYS  39           HN       LYS  39  79.661  12.222  10.403
  309    HA   LYS  39           HA       LYS  39  81.829  12.861  11.039
  310    HB2  LYS  39           HB2      LYS  39  80.441  14.685  12.067
  311    HB3  LYS  39           HB1      LYS  39  80.401  13.752  13.562
  312    HG2  LYS  39           HG2      LYS  39  82.198  15.337  13.781
  313    HG3  LYS  39           HG1      LYS  39  82.938  13.758  13.513
  314    HD2  LYS  39           HD2      LYS  39  82.377  15.023  10.978
  315    HD3  LYS  39           HD1      LYS  39  83.332  16.105  11.992
  316    HE2  LYS  39           HE2      LYS  39  85.037  14.436  12.306
  317    HE3  LYS  39           HE1      LYS  39  84.037  13.193  11.554
  318    HZ1  LYS  39           HZ1      LYS  39  84.448  13.977   9.485
  319    HZ2  LYS  39           HZ2      LYS  39  85.883  14.505  10.224
  320    HZ3  LYS  39           HZ3      LYS  39  84.598  15.590   9.987
  321    H    SER  40           HN       SER  40  82.576  10.646  11.224
  322    HA   SER  40           HA       SER  40  83.344   9.959  13.995
  323    HG   SER  40           HG       SER  40  81.970   6.771  14.204
  324    HB2  SER  40           HB2      SER  40  81.158   8.792  13.540
  325    HB3  SER  40           HB1      SER  40  81.944   7.945  12.212
  326    H    LYS  41           HN       LYS  41  84.031   7.201  12.921
  327    HA   LYS  41           HA       LYS  41  86.201   7.927  11.015
  328    HB2  LYS  41           HB2      LYS  41  87.664   6.314  12.450
  329    HB3  LYS  41           HB1      LYS  41  87.437   7.971  13.009
  330    HG2  LYS  41           HG2      LYS  41  85.400   5.985  13.884
  331    HG3  LYS  41           HG1      LYS  41  87.004   5.838  14.602
  332    HD2  LYS  41           HD2      LYS  41  85.723   8.546  14.452
  333    HD3  LYS  41           HD1      LYS  41  85.204   7.421  15.708
  334    HE2  LYS  41           HE2      LYS  41  88.081   8.233  15.198
  335    HE3  LYS  41           HE1      LYS  41  87.059   8.894  16.474
  336    HZ1  LYS  41           HZ1      LYS  41  87.724   7.201  17.718
  337    HZ2  LYS  41           HZ2      LYS  41  88.487   6.437  16.406
  338    HZ3  LYS  41           HZ3      LYS  41  86.837   6.168  16.706
  339    HA   PRO  42           HA       PRO  42  84.451   4.106   9.379
  340    HB2  PRO  42           HB2      PRO  42  85.791   4.083   7.011
  341    HB3  PRO  42           HB1      PRO  42  84.435   5.183   7.326
  342    HG2  PRO  42           HG2      PRO  42  87.357   5.731   7.373
  343    HG3  PRO  42           HG1      PRO  42  86.026   6.743   6.789
  344    HD2  PRO  42           HD2      PRO  42  87.258   7.073   9.247
  345    HD3  PRO  42           HD1      PRO  42  85.607   7.617   8.878
  346    HA   PRO  43           HA       PRO  43  87.325   0.897  10.351
  347    HB2  PRO  43           HB2      PRO  43  86.999  -0.803   8.141
  348    HB3  PRO  43           HB1      PRO  43  85.990  -0.797   9.599
  349    HG2  PRO  43           HG2      PRO  43  85.481   0.420   6.945
  350    HG3  PRO  43           HG1      PRO  43  84.349  -0.318   8.091
  351    HD2  PRO  43           HD2      PRO  43  84.526   2.372   7.793
  352    HD3  PRO  43           HD1      PRO  43  84.157   1.625   9.365
  353    H    LYS  44           HN       LYS  44  89.491   0.370   9.970
  354    HA   LYS  44           HA       LYS  44  91.085   2.015   8.351
  355    HB2  LYS  44           HB2      LYS  44  91.536  -0.743   9.491
  356    HB3  LYS  44           HB1      LYS  44  92.778   0.061   8.531
  357    HG2  LYS  44           HG2      LYS  44  92.707   1.997  10.068
  358    HG3  LYS  44           HG1      LYS  44  91.484   1.175  11.039
  359    HD2  LYS  44           HD2      LYS  44  92.988  -0.439  11.809
  360    HD3  LYS  44           HD1      LYS  44  94.090  -0.203  10.452
  361    HE2  LYS  44           HE2      LYS  44  93.574   1.949  12.514
  362    HE3  LYS  44           HE1      LYS  44  94.863   0.758  12.689
  363    HZ1  LYS  44           HZ1      LYS  44  95.853   1.490  10.671
  364    HZ2  LYS  44           HZ2      LYS  44  95.557   2.869  11.618
  365    HZ3  LYS  44           HZ3      LYS  44  94.538   2.500  10.310
  366    H    LYS  45           HN       LYS  45  90.233   2.177   6.236
  367    HA   LYS  45           HA       LYS  45  89.937   1.573   3.992
  368    HB2  LYS  45           HB2      LYS  45  92.129  -0.352   4.810
  369    HB3  LYS  45           HB1      LYS  45  91.586  -0.144   3.145
  370    HG2  LYS  45           HG2      LYS  45  92.340   2.088   3.049
  371    HG3  LYS  45           HG1      LYS  45  92.428   2.228   4.805
  372    HD2  LYS  45           HD2      LYS  45  94.684   2.004   3.859
  373    HD3  LYS  45           HD1      LYS  45  94.285   0.586   4.830
  374    HE2  LYS  45           HE2      LYS  45  93.768   0.638   1.859
  375    HE3  LYS  45           HE1      LYS  45  95.343   0.178   2.505
  376    HZ1  LYS  45           HZ1      LYS  45  92.927  -1.320   2.420
  377    HZ2  LYS  45           HZ2      LYS  45  93.512  -1.204   4.010
  378    HZ3  LYS  45           HZ3      LYS  45  94.501  -1.840   2.783
  379    H    GLY  46           HN       GLY  46  88.142   0.558   3.272
  380    HA2  GLY  46           HA2      GLY  46  87.072  -1.783   4.609
  381    HA3  GLY  46           HA1      GLY  46  86.411  -1.037   3.153
  382    H    VAL  47           HN       VAL  47  89.771  -1.990   3.269
  383    HA   VAL  47           HA       VAL  47  90.941  -3.540   1.949
  384    HB   VAL  47           HB       VAL  47  88.542  -5.347   2.206
  385   HG11  VAL  47          HG11      VAL  47  90.188  -7.076   2.273
  386   HG12  VAL  47          HG12      VAL  47  91.488  -5.924   2.575
  387   HG13  VAL  47          HG13      VAL  47  90.706  -5.976   0.995
  388   HG21  VAL  47          HG21      VAL  47  90.454  -4.446   4.373
  389   HG22  VAL  47          HG22      VAL  47  89.557  -5.961   4.476
  390   HG23  VAL  47          HG23      VAL  47  88.691  -4.427   4.408
  391    H    GLN  48           HN       GLN  48  89.269  -1.624   0.568
  392    HA   GLN  48           HA       GLN  48  89.054  -3.037  -2.006
  393    HB2  GLN  48           HB2      GLN  48  86.734  -2.312  -2.409
  394    HB3  GLN  48           HB1      GLN  48  86.816  -3.367  -0.998
  395    HG2  GLN  48           HG2      GLN  48  87.077  -1.161   0.357
  396    HG3  GLN  48           HG1      GLN  48  86.445  -0.378  -1.092
  397   HE21  GLN  48          HE21      GLN  48  85.581  -3.527   0.445
  398   HE22  GLN  48          HE22      GLN  48  83.931  -3.161   0.605
  399    H    GLY  49           HN       GLY  49  88.339   0.020  -0.294
  400    HA2  GLY  49           HA2      GLY  49  89.925   1.907  -1.017
  401    HA3  GLY  49           HA1      GLY  49  89.439   1.484  -2.660
  402    H1U  RCY  50           H1U      RCY  50  83.541  -0.560  -1.040
  403    H1S  RCY  50           H1S      RCY  50  84.158   2.250   2.307
  404    HB1  RCY  50           HB1      RCY  50  85.866   5.402   1.216
  405    HB2  RCY  50           HB2      RCY  50  87.579   5.038   1.427
  406    HA   RCY  50           HA       RCY  50  85.803   3.670  -0.615
  407    HN1  RCY  50           HN1      RCY  50  88.627   3.321   0.113
  408    H    GLY  51           HN       GLY  51  86.693   4.328  -2.895
  409    HA2  GLY  51           HA2      GLY  51  86.035   6.876  -3.588
  410    HA3  GLY  51           HA1      GLY  51  87.701   7.085  -3.048
  411    H    ASP  52           HN       ASP  52  85.735   5.101  -5.278
  412    HA   ASP  52           HA       ASP  52  88.076   4.323  -6.836
  413    HB2  ASP  52           HB2      ASP  52  86.137   2.839  -6.759
  414    HB3  ASP  52           HB1      ASP  52  85.107   4.108  -7.425
  415    H    ASP  53           HN       ASP  53  85.182   6.268  -7.681
  416    HA   ASP  53           HA       ASP  53  86.675   7.528  -9.884
  417    HB2  ASP  53           HB2      ASP  53  83.847   7.918  -8.856
  418    HB3  ASP  53           HB1      ASP  53  84.512   8.733 -10.273
  419    H    ILE  54           HN       ILE  54  84.585   9.064  -7.431
  420    HA   ILE  54           HA       ILE  54  86.700  11.154  -7.095
  421    HB   ILE  54           HB       ILE  54  83.700  11.374  -6.714
  422   HG12  ILE  54          HG12      ILE  54  84.322  13.141  -8.657
  423   HG13  ILE  54          HG11      ILE  54  85.567  11.930  -8.966
  424   HG21  ILE  54          HG21      ILE  54  84.781  12.876  -5.190
  425   HG22  ILE  54          HG22      ILE  54  84.294  13.847  -6.579
  426   HG23  ILE  54          HG23      ILE  54  85.975  13.345  -6.399
  427   HD11  ILE  54          HD11      ILE  54  83.810  11.103 -10.252
  428   HD12  ILE  54          HD12      ILE  54  82.582  11.655  -9.112
  429   HD13  ILE  54          HD13      ILE  54  83.561  10.237  -8.736
  430    HA   PRO  55           HA       PRO  55  86.595   9.359  -2.932
  431    HB2  PRO  55           HB2      PRO  55  88.899  10.462  -2.020
  432    HB3  PRO  55           HB1      PRO  55  88.888   9.095  -3.151
  433    HG2  PRO  55           HG2      PRO  55  89.367  11.979  -3.686
  434    HG3  PRO  55           HG1      PRO  55  90.140  10.554  -4.397
  435    HD2  PRO  55           HD2      PRO  55  88.123  12.018  -5.624
  436    HD3  PRO  55           HD1      PRO  55  88.520  10.330  -6.013
  437    H    GLY  56           HN       GLY  56  84.931  10.398  -1.820
  438    HA2  GLY  56           HA2      GLY  56  85.530  12.529  -0.036
  439    HA3  GLY  56           HA1      GLY  56  84.700  13.212  -1.436
  440    H    MET  57           HN       MET  57  82.505  13.178  -1.379
  441    HA   MET  57           HA       MET  57  81.071  10.998  -0.025
  442    HB2  MET  57           HB2      MET  57  80.980  13.858   0.978
  443    HB3  MET  57           HB1      MET  57  79.776  12.641   1.401
  444    HG2  MET  57           HG2      MET  57  81.748  11.187   2.170
  445    HG3  MET  57           HG1      MET  57  82.724  12.653   2.065
  446    HE1  MET  57           HE1      MET  57  82.144  11.971   5.828
  447    HE2  MET  57           HE2      MET  57  83.284  12.877   4.835
  448    HE3  MET  57           HE3      MET  57  82.841  11.233   4.380
  449    H    GLU  58           HN       GLU  58  81.273  12.159  -2.742
  450    HA   GLU  58           HA       GLU  58  78.388  12.388  -3.240
  451    HB2  GLU  58           HB2      GLU  58  78.431  14.533  -4.296
  452    HB3  GLU  58           HB1      GLU  58  79.239  14.743  -2.744
  453    HG2  GLU  58           HG2      GLU  58  80.541  14.427  -5.461
  454    HG3  GLU  58           HG1      GLU  58  80.607  15.835  -4.400
  455    H    GLY  59           HN       GLY  59  78.232  12.911  -5.823
  456    HA2  GLY  59           HA2      GLY  59  78.917  12.301  -8.013
  457    HA3  GLY  59           HA1      GLY  59  80.427  11.685  -7.339
  458    H1U  RCY  60           H1U      RCY  60  77.444   3.392  -2.164
  459    H1S  RCY  60           H1S      RCY  60  79.732   6.024  -4.426
  460    HB1  RCY  60           HB1      RCY  60  78.530   6.443  -6.179
  461    HB2  RCY  60           HB2      RCY  60  77.533   7.897  -6.214
  462    HA   RCY  60           HA       RCY  60  80.006   7.263  -7.818
  463    HN1  RCY  60           HN1      RCY  60  80.589   9.531  -7.696
  464    H    GLY  61           HN       GLY  61  78.777   5.967  -9.209
  465    HA2  GLY  61           HA2      GLY  61  76.166   6.828 -10.186
  466    HA3  GLY  61           HA1      GLY  61  77.449   7.026 -11.381
  467    H    THR  62           HN       THR  62  79.022   4.805 -10.894
  468    HA   THR  62           HA       THR  62  77.849   2.760 -12.367
  469    HB   THR  62           HB       THR  62  79.569   1.275 -11.462
  470    HG1  THR  62           HG1      THR  62  80.885   2.345  -9.728
  471   HG21  THR  62          HG21      THR  62  81.526   2.618 -11.958
  472   HG22  THR  62          HG22      THR  62  80.638   4.105 -11.623
  473   HG23  THR  62          HG23      THR  62  80.217   3.124 -13.026
  474    H    ASP  63           HN       ASP  63  76.124   1.497 -11.956
  475    HA   ASP  63           HA       ASP  63  74.589   1.490  -9.620
  476    HB2  ASP  63           HB2      ASP  63  73.619  -0.632 -10.423
  477    HB3  ASP  63           HB1      ASP  63  73.827   0.504 -11.757
  478    H    ILE  64           HN       ILE  64  77.683   0.138 -10.071
  479    HA   ILE  64           HA       ILE  64  77.372  -1.877  -7.930
  480    HB   ILE  64           HB       ILE  64  79.674  -1.044  -9.706
  481   HG12  ILE  64          HG12      ILE  64  78.342  -3.737  -9.318
  482   HG13  ILE  64          HG11      ILE  64  77.814  -2.572 -10.533
  483   HG21  ILE  64          HG21      ILE  64  79.639  -2.809  -7.257
  484   HG22  ILE  64          HG22      ILE  64  80.772  -1.520  -7.664
  485   HG23  ILE  64          HG23      ILE  64  80.823  -3.048  -8.542
  486   HD11  ILE  64          HD11      ILE  64  79.434  -4.284 -11.414
  487   HD12  ILE  64          HD12      ILE  64  80.649  -3.621 -10.321
  488   HD13  ILE  64          HD13      ILE  64  79.983  -2.620 -11.611
  489    H    THR  65           HN       THR  65  78.474   1.399  -8.353
  490    HA   THR  65           HA       THR  65  79.593   2.859  -6.871
  491    HB   THR  65           HB       THR  65  78.422   3.132  -4.845
  492    HG1  THR  65           HG1      THR  65  78.361   0.359  -4.949
  493   HG21  THR  65          HG21      THR  65  76.952   3.229  -6.867
  494   HG22  THR  65          HG22      THR  65  76.084   2.771  -5.401
  495   HG23  THR  65          HG23      THR  65  76.521   1.541  -6.587
  496    H    VAL  66           HN       VAL  66  81.032   0.556  -7.486
  497    HA   VAL  66           HA       VAL  66  83.074  -0.388  -6.798
  498    HB   VAL  66           HB       VAL  66  82.601   0.667  -4.007
  499   HG11  VAL  66          HG11      VAL  66  85.164   0.405  -5.591
  500   HG12  VAL  66          HG12      VAL  66  84.508  -0.926  -4.638
  501   HG13  VAL  66          HG13      VAL  66  84.979   0.578  -3.846
  502   HG21  VAL  66          HG21      VAL  66  84.141   2.590  -5.093
  503   HG22  VAL  66          HG22      VAL  66  82.382   2.704  -5.058
  504   HG23  VAL  66          HG23      VAL  66  83.201   2.155  -6.520
  505    H    ILE  67           HN       ILE  67  80.830  -0.501  -3.993
  506    HA   ILE  67           HA       ILE  67  80.796  -3.470  -4.298
  507    HB   ILE  67           HB       ILE  67  81.321  -1.924  -1.743
  508   HG12  ILE  67          HG12      ILE  67  83.164  -2.639  -3.487
  509   HG13  ILE  67          HG11      ILE  67  83.438  -2.914  -1.766
  510   HG21  ILE  67          HG21      ILE  67  81.409  -4.354  -0.816
  511   HG22  ILE  67          HG22      ILE  67  80.441  -4.765  -2.231
  512   HG23  ILE  67          HG23      ILE  67  79.828  -3.609  -1.049
  513   HD11  ILE  67          HD11      ILE  67  82.091  -5.027  -3.431
  514   HD12  ILE  67          HD12      ILE  67  82.999  -5.210  -1.930
  515   HD13  ILE  67          HD13      ILE  67  83.849  -4.882  -3.440
  516    H1U  RCY  68           H1U      RCY  68  75.983   1.693  -0.486
  517    H1S  RCY  68           H1S      RCY  68  75.048   0.766  -4.483
  518    HB1  RCY  68           HB1      RCY  68  75.077  -2.885  -5.173
  519    HB2  RCY  68           HB2      RCY  68  76.568  -3.144  -6.077
  520    HA   RCY  68           HA       RCY  68  76.612  -2.383  -3.153
  521    HN1  RCY  68           HN1      RCY  68  78.664  -3.650  -4.928
  522    HA   PRO  69           HA       PRO  69  75.183  -6.178  -1.442
  523    HB2  PRO  69           HB2      PRO  69  72.662  -5.666  -2.995
  524    HB3  PRO  69           HB1      PRO  69  72.857  -6.163  -1.302
  525    HG2  PRO  69           HG2      PRO  69  72.334  -3.625  -2.000
  526    HG3  PRO  69           HG1      PRO  69  73.325  -4.038  -0.593
  527    HD2  PRO  69           HD2      PRO  69  74.152  -2.805  -3.138
  528    HD3  PRO  69           HD1      PRO  69  75.018  -2.869  -1.589
  529    H    TRP  70           HN       TRP  70  74.292  -5.726  -4.878
  530    HA   TRP  70           HA       TRP  70  74.306  -8.611  -5.366
  531    HD1  TRP  70           HD1      TRP  70  76.028  -5.593  -7.771
  532    HE1  TRP  70           HE1      TRP  70  75.486  -3.076  -7.866
  533    HE3  TRP  70           HE3      TRP  70  71.144  -5.688  -6.285
  534    HZ2  TRP  70           HZ2      TRP  70  73.269  -1.329  -7.375
  535    HZ3  TRP  70           HZ3      TRP  70  69.844  -3.590  -6.107
  536    HH2  TRP  70           HH2      TRP  70  70.896  -1.412  -6.649
  537    HB2  TRP  70           HB2      TRP  70  74.180  -7.740  -7.827
  538    HB3  TRP  70           HB1      TRP  70  72.799  -7.481  -6.763
  539    H    GLU  71           HN       GLU  71  76.801  -7.578  -4.300
  540    HA   GLU  71           HA       GLU  71  78.583  -8.531  -6.464
  541    HB2  GLU  71           HB2      GLU  71  78.355  -5.755  -5.734
  542    HB3  GLU  71           HB1      GLU  71  79.947  -6.335  -5.250
  543    HG2  GLU  71           HG2      GLU  71  78.747  -6.765  -8.001
  544    HG3  GLU  71           HG1      GLU  71  79.878  -5.470  -7.606
  545    H    ALA  72           HN       ALA  72  79.074  -6.916  -3.305
  546    HA   ALA  72           HA       ALA  72  81.086  -8.824  -2.506
  547    HB1  ALA  72           HB1      ALA  72  81.290  -6.748  -1.436
  548    HB2  ALA  72           HB2      ALA  72  80.565  -7.745  -0.176
  549    HB3  ALA  72           HB3      ALA  72  79.561  -6.637  -1.110
  550    H1U  RCY  73           H1U      RCY  73  78.912  -3.430   2.972
  551    H1S  RCY  73           H1S      RCY  73  75.316  -6.146   1.231
  552    HB1  RCY  73           HB1      RCY  73  77.285  -9.099   1.964
  553    HB2  RCY  73           HB2      RCY  73  75.984 -10.174   1.453
  554    HA   RCY  73           HA       RCY  73  78.324 -10.857   0.710
  555    HN1  RCY  73           HN1      RCY  73  78.536  -8.231  -0.216
  556    H    ASN  74           HN       ASN  74  75.316  -9.781  -0.679
  557    HA   ASN  74           HA       ASN  74  75.387 -11.319  -3.097
  558    HB2  ASN  74           HB2      ASN  74  75.491 -13.246  -1.589
  559    HB3  ASN  74           HB1      ASN  74  74.086 -12.655  -0.702
  560   HD21  ASN  74          HD21      ASN  74  71.982 -12.637  -1.877
  561   HD22  ASN  74          HD22      ASN  74  71.746 -13.666  -3.206
  562    H    HIS  75           HN       HIS  75  73.145 -10.548  -0.410
  563    HA   HIS  75           HA       HIS  75  71.575  -8.853  -2.248
  564    HD1  HIS  75           HD1      HIS  75  67.973 -10.591  -0.230
  565    HD2  HIS  75           HD2      HIS  75  69.314  -8.519  -3.592
  566    HE1  HIS  75           HE1      HIS  75  66.046  -9.132  -0.987
  567    HE2  HIS  75           HE2      HIS  75  66.849  -7.866  -3.033
  568    HB2  HIS  75           HB2      HIS  75  70.617 -11.137  -2.525
  569    HB3  HIS  75           HB1      HIS  75  70.315 -11.198  -0.788
  570    H1U  RCY  76           H1U      RCY  76  73.054  -4.805   0.365
  571    H1S  RCY  76           H1S      RCY  76  69.867  -4.974   3.270
  572    HB1  RCY  76           HB1      RCY  76  67.909  -8.792   2.490
  573    HB2  RCY  76           HB2      RCY  76  68.057  -8.027   0.908
  574    HA   RCY  76           HA       RCY  76  70.524  -7.503   1.936
  575    HN1  RCY  76           HN1      RCY  76  69.682  -9.874   0.320
  576    H    GLU  77           HN       GLU  77  72.023  -8.405   3.350
  577    HA   GLU  77           HA       GLU  77  71.690 -11.005   4.560
  578    HB2  GLU  77           HB2      GLU  77  73.458  -8.635   5.200
  579    HB3  GLU  77           HB1      GLU  77  73.496 -10.123   6.147
  580    HG2  GLU  77           HG2      GLU  77  73.791 -10.151   3.141
  581    HG3  GLU  77           HG1      GLU  77  75.181  -9.938   4.207
  582    H    LEU  78           HN       LEU  78  71.219 -11.428   6.820
  583    HA   LEU  78           HA       LEU  78  68.982  -9.891   7.815
  584    HG   LEU  78           HG       LEU  78  68.698 -10.447  10.368
  585    HB2  LEU  78           HB2      LEU  78  69.386 -12.382   8.167
  586    HB3  LEU  78           HB1      LEU  78  70.610 -11.929   9.352
  587   HD11  LEU  78          HD11      LEU  78  67.060 -10.726   8.611
  588   HD12  LEU  78          HD12      LEU  78  66.463 -11.573  10.038
  589   HD13  LEU  78          HD13      LEU  78  67.184 -12.483   8.710
  590   HD21  LEU  78          HD21      LEU  78  68.830 -13.469  10.557
  591   HD22  LEU  78          HD22      LEU  78  67.893 -12.470  11.667
  592   HD23  LEU  78          HD23      LEU  78  69.646 -12.297  11.591
  593    H    HIS  79           HN       HIS  79  69.140  -8.018   8.942
  594    HA   HIS  79           HA       HIS  79  71.473  -6.708   9.698
  595    HD1  HIS  79           HD1      HIS  79  68.576  -6.641  13.198
  596    HD2  HIS  79           HD2      HIS  79  67.291  -7.525   9.329
  597    HE1  HIS  79           HE1      HIS  79  66.378  -7.877  13.439
  598    HE2  HIS  79           HE2      HIS  79  65.585  -8.421  11.091
  599    HB2  HIS  79           HB2      HIS  79  70.024  -5.550  11.447
  600    HB3  HIS  79           HB1      HIS  79  69.399  -5.511   9.798
  601    H    GLU  80           HN       GLU  80  72.413  -6.371  11.884
  602    HA   GLU  80           HA       GLU  80  71.945  -8.510  13.863
  603    HB2  GLU  80           HB2      GLU  80  73.598  -9.476  12.266
  604    HB3  GLU  80           HB1      GLU  80  74.667  -8.108  12.581
  605    HG2  GLU  80           HG2      GLU  80  74.743  -8.714  14.973
  606    HG3  GLU  80           HG1      GLU  80  73.678 -10.085  14.660
  607    H    LEU  81           HN       LEU  81  73.565  -5.548  12.873
  608    HA   LEU  81           HA       LEU  81  74.236  -4.948  15.707
  609    HG   LEU  81           HG       LEU  81  75.880  -3.141  12.228
  610    HB2  LEU  81           HB2      LEU  81  75.300  -2.855  14.547
  611    HB3  LEU  81           HB1      LEU  81  76.112  -4.411  14.421
  612   HD11  LEU  81          HD11      LEU  81  74.379  -5.509  11.558
  613   HD12  LEU  81          HD12      LEU  81  75.539  -5.888  12.831
  614   HD13  LEU  81          HD13      LEU  81  76.095  -5.185  11.312
  615   HD21  LEU  81          HD21      LEU  81  72.988  -4.016  12.420
  616   HD22  LEU  81          HD22      LEU  81  73.730  -2.997  11.186
  617   HD23  LEU  81          HD23      LEU  81  73.511  -2.381  12.823
  618    H    ALA  82           HN       ALA  82  71.580  -4.701  13.898
  619    HA   ALA  82           HA       ALA  82  70.820  -1.947  14.066
  620    HB1  ALA  82           HB1      ALA  82  69.611  -3.620  12.688
  621    HB2  ALA  82           HB2      ALA  82  68.520  -2.772  13.783
  622    HB3  ALA  82           HB3      ALA  82  69.050  -4.411  14.161
  623    H    GLN  83           HN       GLN  83  70.197  -0.753  15.819
  624    HA   GLN  83           HA       GLN  83  68.886  -1.953  18.117
  625    HB2  GLN  83           HB2      GLN  83  71.357  -2.534  18.418
  626    HB3  GLN  83           HB1      GLN  83  71.637  -0.805  18.625
  627    HG2  GLN  83           HG2      GLN  83  69.975  -0.783  20.476
  628    HG3  GLN  83           HG1      GLN  83  69.790  -2.529  20.301
  629   HE21  GLN  83          HE21      GLN  83  72.552  -0.203  20.569
  630   HE22  GLN  83          HE22      GLN  83  73.423  -1.148  21.678
  631    H    TYR  84           HN       TYR  84  67.672  -0.078  16.890
  632    HA   TYR  84           HA       TYR  84  66.860   2.125  16.952
  633    HD1  TYR  84           HD1      TYR  84  66.704  -0.416  19.599
  634    HD2  TYR  84           HD2      TYR  84  64.844   3.414  19.029
  635    HE1  TYR  84           HE1      TYR  84  64.478  -1.441  19.978
  636    HE2  TYR  84           HE2      TYR  84  62.618   2.389  19.408
  637    HH   TYR  84           HH       TYR  84  61.903  -0.609  19.120
  638    HB2  TYR  84           HB2      TYR  84  67.995   1.739  19.726
  639    HB3  TYR  84           HB1      TYR  84  67.217   3.249  19.252
  640    H    GLY  85           HN       GLY  85  68.221   3.033  15.358
  641    HA2  GLY  85           HA2      GLY  85  69.510   5.144  15.091
  642    HA3  GLY  85           HA1      GLY  85  70.519   4.617  16.439
  643    H    ILE  86           HN       ILE  86  70.259   1.796  15.175
  644    HA   ILE  86           HA       ILE  86  71.893   0.507  14.055
  645    HB   ILE  86           HB       ILE  86  71.749   0.828  11.613
  646   HG12  ILE  86          HG12      ILE  86  70.131   3.310  12.255
  647   HG13  ILE  86          HG11      ILE  86  71.828   3.359  11.774
  648   HG21  ILE  86          HG21      ILE  86  69.906  -0.358  12.556
  649   HG22  ILE  86          HG22      ILE  86  69.190   0.843  11.481
  650   HG23  ILE  86          HG23      ILE  86  69.205   1.117  13.224
  651   HD11  ILE  86          HD11      ILE  86  70.162   3.668   9.879
  652   HD12  ILE  86          HD12      ILE  86  69.693   1.986  10.126
  653   HD13  ILE  86          HD13      ILE  86  71.341   2.378   9.639
  654    H1U  RCY  87           H1U      RCY  87  74.994   1.453   5.378
  655    H1S  RCY  87           H1S      RCY  87  78.120   2.128   8.445
  656    HB1  RCY  87           HB1      RCY  87  75.426   1.012  10.790
  657    HB2  RCY  87           HB2      RCY  87  76.665   0.912  12.038
  658    HA   RCY  87           HA       RCY  87  75.701   2.558  13.318
  659    HN1  RCY  87           HN1      RCY  87  73.552   1.202  11.866
  Start of MODEL   32
    1    HA   MET   1           HA       MET   1  72.165 -10.094  23.036
    2    HB2  MET   1           HB2      MET   1  72.579 -11.950  24.829
    3    HB3  MET   1           HB1      MET   1  73.808 -10.707  24.599
    4    HG2  MET   1           HG2      MET   1  71.603 -10.347  26.623
    5    HG3  MET   1           HG1      MET   1  73.070 -11.238  27.028
    6    HE1  MET   1           HE1      MET   1  74.820  -8.492  28.630
    7    HE2  MET   1           HE2      MET   1  74.838 -10.200  28.197
    8    HE3  MET   1           HE3      MET   1  73.417  -9.511  28.977
    9    H    ASN   2           HN       ASN   2  69.751  -9.260  25.298
   10    HA   ASN   2           HA       ASN   2  68.104 -11.636  24.512
   11    HB2  ASN   2           HB2      ASN   2  66.710 -11.011  26.518
   12    HB3  ASN   2           HB1      ASN   2  68.356 -11.505  26.916
   13   HD21  ASN   2          HD21      ASN   2  69.960  -9.441  26.814
   14   HD22  ASN   2          HD22      ASN   2  69.380  -8.068  27.625
   15    H    LEU   3           HN       LEU   3  68.002  -8.105  25.002
   16    HA   LEU   3           HA       LEU   3  65.345  -7.769  23.975
   17    HG   LEU   3           HG       LEU   3  67.914  -5.565  22.604
   18    HB2  LEU   3           HB2      LEU   3  65.823  -5.422  23.928
   19    HB3  LEU   3           HB1      LEU   3  66.672  -6.073  25.327
   20   HD11  LEU   3          HD11      LEU   3  67.535  -3.452  23.660
   21   HD12  LEU   3          HD12      LEU   3  69.226  -3.850  23.966
   22   HD13  LEU   3          HD13      LEU   3  68.023  -4.075  25.236
   23   HD21  LEU   3          HD21      LEU   3  69.119  -7.357  23.556
   24   HD22  LEU   3          HD22      LEU   3  68.929  -6.731  25.194
   25   HD23  LEU   3          HD23      LEU   3  70.032  -5.938  24.069
   26    H    GLU   4           HN       GLU   4  64.626  -7.357  21.879
   27    HA   GLU   4           HA       GLU   4  66.488  -8.142  19.729
   28    HB2  GLU   4           HB2      GLU   4  64.077  -8.990  19.957
   29    HB3  GLU   4           HB1      GLU   4  63.578  -7.387  19.417
   30    HG2  GLU   4           HG2      GLU   4  64.881  -7.649  17.355
   31    HG3  GLU   4           HG1      GLU   4  65.449  -9.229  17.897
   32    HA   PRO   5           HA       PRO   5  67.698  -3.979  18.667
   33    HB2  PRO   5           HB2      PRO   5  67.231  -5.029  15.893
   34    HB3  PRO   5           HB1      PRO   5  68.606  -4.102  16.527
   35    HG2  PRO   5           HG2      PRO   5  68.732  -6.749  16.158
   36    HG3  PRO   5           HG1      PRO   5  69.575  -5.943  17.490
   37    HD2  PRO   5           HD2      PRO   5  67.211  -7.719  17.588
   38    HD3  PRO   5           HD1      PRO   5  68.358  -7.299  18.878
   39    HA   PRO   6           HA       PRO   6  63.618  -2.232  17.919
   40    HB2  PRO   6           HB2      PRO   6  64.280   0.401  18.000
   41    HB3  PRO   6           HB1      PRO   6  64.241  -0.611  19.459
   42    HG2  PRO   6           HG2      PRO   6  66.580   0.265  17.839
   43    HG3  PRO   6           HG1      PRO   6  66.409   0.136  19.597
   44    HD2  PRO   6           HD2      PRO   6  67.681  -1.758  18.045
   45    HD3  PRO   6           HD1      PRO   6  66.923  -2.114  19.612
   46    H    LYS   7           HN       LYS   7  62.466  -1.321  16.144
   47    HA   LYS   7           HA       LYS   7  63.938  -0.121  13.916
   48    HB2  LYS   7           HB2      LYS   7  62.965  -1.828  12.285
   49    HB3  LYS   7           HB1      LYS   7  64.314  -2.385  13.270
   50    HG2  LYS   7           HG2      LYS   7  61.492  -2.767  14.243
   51    HG3  LYS   7           HG1      LYS   7  62.181  -3.896  13.076
   52    HD2  LYS   7           HD2      LYS   7  64.220  -3.886  14.775
   53    HD3  LYS   7           HD1      LYS   7  62.971  -3.393  15.919
   54    HE2  LYS   7           HE2      LYS   7  63.099  -5.924  14.276
   55    HE3  LYS   7           HE1      LYS   7  62.992  -5.767  16.029
   56    HZ1  LYS   7           HZ1      LYS   7  60.827  -4.416  14.865
   57    HZ2  LYS   7           HZ2      LYS   7  60.801  -5.782  15.875
   58    HZ3  LYS   7           HZ3      LYS   7  60.903  -5.971  14.190
   59    H    ALA   8           HN       ALA   8  60.919  -1.289  15.270
   60    HA   ALA   8           HA       ALA   8  58.692  -0.608  14.868
   61    HB1  ALA   8           HB1      ALA   8  59.366   1.271  16.184
   62    HB2  ALA   8           HB2      ALA   8  58.518   1.940  14.790
   63    HB3  ALA   8           HB3      ALA   8  60.280   1.967  14.846
   64    H    GLU   9           HN       GLU   9  59.466  -1.727  12.582
   65    HA   GLU   9           HA       GLU   9  58.489   0.168  10.486
   66    HB2  GLU   9           HB2      GLU   9  60.860  -1.711  10.314
   67    HB3  GLU   9           HB1      GLU   9  60.100  -0.985   8.899
   68    HG2  GLU   9           HG2      GLU   9  60.700   0.963  11.014
   69    HG3  GLU   9           HG1      GLU   9  62.138   0.167  10.373
   70    H1U  RCY  10           H1U      RCY  10  54.461  -4.765   4.478
   71    H1S  RCY  10           H1S      RCY  10  55.039  -0.879   7.147
   72    HB1  RCY  10           HB1      RCY  10  54.314  -2.039  11.355
   73    HB2  RCY  10           HB2      RCY  10  53.757  -3.321  10.280
   74    HA   RCY  10           HA       RCY  10  56.056  -3.803  10.769
   75    HN1  RCY  10           HN1      RCY  10  56.451  -1.046  11.032
   76    H    ARG  11           HN       ARG  11  56.118  -1.353   8.175
   77    HA   ARG  11           HA       ARG  11  55.611  -3.195   6.038
   78    HE   ARG  11           HE       ARG  11  58.268   0.185   4.236
   79    HB2  ARG  11           HB2      ARG  11  55.460  -0.670   5.907
   80    HB3  ARG  11           HB1      ARG  11  57.223  -0.636   5.863
   81    HG2  ARG  11           HG2      ARG  11  57.181  -2.097   3.854
   82    HG3  ARG  11           HG1      ARG  11  55.418  -2.051   3.879
   83    HD2  ARG  11           HD2      ARG  11  56.151  -0.379   2.306
   84    HD3  ARG  11           HD1      ARG  11  55.575   0.470   3.740
   85   HH11  ARG  11          HH21      ARG  11  56.363   1.317   1.594
   86   HH12  ARG  11          HH22      ARG  11  57.548   2.460   1.057
   87   HH21  ARG  11          HH11      ARG  11  59.826   1.672   3.549
   88   HH22  ARG  11          HH12      ARG  11  59.508   2.661   2.163
   89    H    SER  12           HN       SER  12  57.013  -5.005   6.603
   90    HA   SER  12           HA       SER  12  59.539  -4.941   5.217
   91    HG   SER  12           HG       SER  12  61.966  -4.960   6.857
   92    HB2  SER  12           HB2      SER  12  60.297  -3.768   7.226
   93    HB3  SER  12           HB1      SER  12  59.616  -5.030   8.249
   94    H    ALA  13           HN       ALA  13  58.594  -6.703   8.177
   95    HA   ALA  13           HA       ALA  13  58.345  -9.015   8.518
   96    HB1  ALA  13           HB1      ALA  13  57.026  -8.667   5.811
   97    HB2  ALA  13           HB2      ALA  13  56.235  -8.650   7.387
   98    HB3  ALA  13           HB3      ALA  13  56.931 -10.146   6.767
   99    H    THR  14           HN       THR  14  58.691 -11.247   7.196
  100    HA   THR  14           HA       THR  14  61.447 -11.043   6.134
  101    HB   THR  14           HB       THR  14  59.830 -13.558   6.611
  102    HG1  THR  14           HG1      THR  14  61.536 -12.160   8.394
  103   HG21  THR  14          HG21      THR  14  62.790 -12.936   6.444
  104   HG22  THR  14          HG22      THR  14  61.845 -13.900   5.310
  105   HG23  THR  14          HG23      THR  14  62.136 -14.495   6.944
  106    H    ARG  15           HN       ARG  15  58.796 -13.222   5.160
  107    HA   ARG  15           HA       ARG  15  58.160 -13.920   3.008
  108    HE   ARG  15           HE       ARG  15  57.103  -9.875   2.060
  109    HB2  ARG  15           HB2      ARG  15  57.335 -11.470   3.212
  110    HB3  ARG  15           HB1      ARG  15  58.687 -11.075   2.151
  111    HG2  ARG  15           HG2      ARG  15  57.725 -13.077   0.709
  112    HG3  ARG  15           HG1      ARG  15  56.233 -12.693   1.568
  113    HD2  ARG  15           HD2      ARG  15  57.771 -11.038  -0.394
  114    HD3  ARG  15           HD1      ARG  15  56.028 -11.258  -0.237
  115   HH11  ARG  15          HH21      ARG  15  56.215  -9.577  -1.258
  116   HH12  ARG  15          HH22      ARG  15  55.858  -7.886  -1.148
  117   HH21  ARG  15          HH11      ARG  15  56.642  -7.668   2.222
  118   HH22  ARG  15          HH12      ARG  15  56.099  -6.805   0.822
  119    H    VAL  16           HN       VAL  16  59.348 -12.099   0.706
  120    HA   VAL  16           HA       VAL  16  62.157 -12.910   0.695
  121    HB   VAL  16           HB       VAL  16  61.296 -15.045   0.058
  122   HG11  VAL  16          HG11      VAL  16  59.732 -14.737  -2.202
  123   HG12  VAL  16          HG12      VAL  16  59.215 -13.391  -1.187
  124   HG13  VAL  16          HG13      VAL  16  59.121 -15.043  -0.576
  125   HG21  VAL  16          HG21      VAL  16  62.951 -13.652  -1.569
  126   HG22  VAL  16          HG22      VAL  16  61.637 -13.982  -2.699
  127   HG23  VAL  16          HG23      VAL  16  62.467 -15.316  -1.897
  128    H    MET  17           HN       MET  17  60.389 -12.781  -2.317
  129    HA   MET  17           HA       MET  17  60.609  -9.906  -2.645
  130    HB2  MET  17           HB2      MET  17  62.669  -9.714  -3.559
  131    HB3  MET  17           HB1      MET  17  62.971 -11.369  -3.045
  132    HG2  MET  17           HG2      MET  17  61.720 -10.571  -5.696
  133    HG3  MET  17           HG1      MET  17  63.394 -11.080  -5.478
  134    HE1  MET  17           HE1      MET  17  62.381 -14.239  -7.160
  135    HE2  MET  17           HE2      MET  17  63.352 -12.769  -7.110
  136    HE3  MET  17           HE3      MET  17  61.662 -12.686  -7.603
  137    H    GLY  18           HN       GLY  18  60.030  -9.291  -4.959
  138    HA2  GLY  18           HA2      GLY  18  59.159 -10.217  -7.141
  139    HA3  GLY  18           HA1      GLY  18  58.291 -11.408  -6.171
  140    H    GLY  19           HN       GLY  19  56.158 -10.914  -6.112
  141    HA2  GLY  19           HA2      GLY  19  54.187  -9.637  -6.044
  142    HA3  GLY  19           HA1      GLY  19  55.084  -8.594  -4.939
  143    HA   PRO  20           HA       PRO  20  53.998  -6.187  -8.809
  144    HB2  PRO  20           HB2      PRO  20  53.570  -4.069  -6.775
  145    HB3  PRO  20           HB1      PRO  20  52.508  -4.593  -8.095
  146    HG2  PRO  20           HG2      PRO  20  51.980  -5.148  -5.531
  147    HG3  PRO  20           HG1      PRO  20  51.556  -6.256  -6.846
  148    HD2  PRO  20           HD2      PRO  20  53.809  -6.444  -4.878
  149    HD3  PRO  20           HD1      PRO  20  52.828  -7.741  -5.597
  150    H1U  RCY  21           H1U      RCY  21  62.027  -0.207 -10.345
  151    H1S  RCY  21           H1S      RCY  21  60.340  -3.906  -8.445
  152    HB1  RCY  21           HB1      RCY  21  58.493  -5.915  -5.709
  153    HB2  RCY  21           HB2      RCY  21  58.032  -4.217  -5.594
  154    HA   RCY  21           HA       RCY  21  57.877  -4.003  -7.971
  155    HN1  RCY  21           HN1      RCY  21  56.630  -6.637  -7.280
  156    H    THR  22           HN       THR  22  59.482  -4.124  -9.466
  157    HA   THR  22           HA       THR  22  60.928  -6.688  -9.850
  158    HB   THR  22           HB       THR  22  59.278  -6.994 -11.502
  159    HG1  THR  22           HG1      THR  22  61.564  -6.832 -12.258
  160   HG21  THR  22          HG21      THR  22  58.806  -4.959 -13.094
  161   HG22  THR  22          HG22      THR  22  59.436  -4.006 -11.751
  162   HG23  THR  22          HG23      THR  22  58.019  -5.030 -11.517
  163    HA   PRO  23           HA       PRO  23  63.882  -3.166  -9.596
  164    HB2  PRO  23           HB2      PRO  23  65.711  -5.530  -9.748
  165    HB3  PRO  23           HB1      PRO  23  65.758  -4.133  -8.653
  166    HG2  PRO  23           HG2      PRO  23  64.893  -6.506  -7.828
  167    HG3  PRO  23           HG1      PRO  23  64.139  -5.005  -7.265
  168    HD2  PRO  23           HD2      PRO  23  63.106  -7.008  -9.231
  169    HD3  PRO  23           HD1      PRO  23  62.210  -5.978  -8.092
  170    H    ARG  24           HN       ARG  24  63.904  -5.865 -11.894
  171    HA   ARG  24           HA       ARG  24  64.620  -5.970 -14.128
  172    HE   ARG  24           HE       ARG  24  59.942  -4.374 -14.668
  173    HB2  ARG  24           HB2      ARG  24  64.103  -2.987 -13.907
  174    HB3  ARG  24           HB1      ARG  24  64.372  -3.848 -15.423
  175    HG2  ARG  24           HG2      ARG  24  62.351  -5.012 -15.275
  176    HG3  ARG  24           HG1      ARG  24  62.246  -4.806 -13.527
  177    HD2  ARG  24           HD2      ARG  24  61.901  -2.353 -13.887
  178    HD3  ARG  24           HD1      ARG  24  61.862  -2.652 -15.625
  179   HH11  ARG  24          HH21      ARG  24  60.664  -1.030 -14.242
  180   HH12  ARG  24          HH22      ARG  24  59.013  -0.567 -14.000
  181   HH21  ARG  24          HH11      ARG  24  57.781  -3.789 -14.355
  182   HH22  ARG  24          HH12      ARG  24  57.380  -2.130 -14.064
  183    H    LYS  25           HN       LYS  25  66.752  -6.528 -14.272
  184    HA   LYS  25           HA       LYS  25  68.795  -4.391 -13.778
  185    HB2  LYS  25           HB2      LYS  25  68.881  -7.394 -13.463
  186    HB3  LYS  25           HB1      LYS  25  70.359  -6.439 -13.591
  187    HG2  LYS  25           HG2      LYS  25  69.866  -5.214 -11.614
  188    HG3  LYS  25           HG1      LYS  25  68.190  -5.765 -11.599
  189    HD2  LYS  25           HD2      LYS  25  69.438  -7.012  -9.922
  190    HD3  LYS  25           HD1      LYS  25  69.016  -8.102 -11.243
  191    HE2  LYS  25           HE2      LYS  25  71.432  -8.231 -10.408
  192    HE3  LYS  25           HE1      LYS  25  71.221  -8.022 -12.147
  193    HZ1  LYS  25           HZ1      LYS  25  72.096  -5.978 -12.091
  194    HZ2  LYS  25           HZ2      LYS  25  72.765  -6.464 -10.606
  195    HZ3  LYS  25           HZ3      LYS  25  71.326  -5.562 -10.638
  196    H    GLY  26           HN       GLY  26  68.170  -7.263 -15.832
  197    HA2  GLY  26           HA2      GLY  26  68.940  -7.741 -18.005
  198    HA3  GLY  26           HA1      GLY  26  68.525  -6.056 -18.315
  199    HA   PRO  27           HA       PRO  27  73.119  -6.804 -19.092
  200    HB2  PRO  27           HB2      PRO  27  72.414  -4.740 -21.137
  201    HB3  PRO  27           HB1      PRO  27  73.421  -6.192 -21.302
  202    HG2  PRO  27           HG2      PRO  27  70.954  -6.087 -22.294
  203    HG3  PRO  27           HG1      PRO  27  71.612  -7.575 -21.593
  204    HD2  PRO  27           HD2      PRO  27  69.592  -5.691 -20.453
  205    HD3  PRO  27           HD1      PRO  27  69.747  -7.448 -20.235
  206    HA   PRO  28           HA       PRO  28  74.789  -3.429 -16.773
  207    HB2  PRO  28           HB2      PRO  28  76.386  -2.742 -19.218
  208    HB3  PRO  28           HB1      PRO  28  76.925  -2.930 -17.538
  209    HG2  PRO  28           HG2      PRO  28  77.321  -4.833 -19.376
  210    HG3  PRO  28           HG1      PRO  28  77.003  -5.214 -17.677
  211    HD2  PRO  28           HD2      PRO  28  75.246  -5.589 -20.031
  212    HD3  PRO  28           HD1      PRO  28  75.198  -6.396 -18.449
  213    H    LYS  29           HN       LYS  29  73.993  -1.398 -16.391
  214    HA   LYS  29           HA       LYS  29  72.839   0.110 -18.708
  215    HB2  LYS  29           HB2      LYS  29  72.156   0.308 -15.758
  216    HB3  LYS  29           HB1      LYS  29  71.354   1.171 -17.069
  217    HG2  LYS  29           HG2      LYS  29  70.080  -0.622 -17.600
  218    HG3  LYS  29           HG1      LYS  29  71.465  -1.713 -17.547
  219    HD2  LYS  29           HD2      LYS  29  70.216  -0.645 -15.017
  220    HD3  LYS  29           HD1      LYS  29  69.590  -2.091 -15.808
  221    HE2  LYS  29           HE2      LYS  29  71.451  -3.343 -15.304
  222    HE3  LYS  29           HE1      LYS  29  72.535  -1.955 -15.384
  223    HZ1  LYS  29           HZ1      LYS  29  70.639  -1.678 -13.281
  224    HZ2  LYS  29           HZ2      LYS  29  72.336  -1.628 -13.215
  225    HZ3  LYS  29           HZ3      LYS  29  71.523  -3.116 -13.113
  226    H1U  RCY  30           H1U      RCY  30  73.791   7.432  -9.844
  227    H1S  RCY  30           H1S      RCY  30  73.837   3.769 -12.538
  228    HB1  RCY  30           HB1      RCY  30  73.009   4.806 -16.773
  229    HB2  RCY  30           HB2      RCY  30  74.329   5.457 -15.800
  230    HA   RCY  30           HA       RCY  30  75.162   3.602 -17.158
  231    HN1  RCY  30           HN1      RCY  30  72.751   2.187 -16.234
  232    H    LYS  31           HN       LYS  31  74.977   1.101 -15.231
  233    HA   LYS  31           HA       LYS  31  76.346   2.168 -12.858
  234    HB2  LYS  31           HB2      LYS  31  74.975   0.405 -12.225
  235    HB3  LYS  31           HB1      LYS  31  75.245  -0.477 -13.724
  236    HG2  LYS  31           HG2      LYS  31  77.618  -0.065 -11.964
  237    HG3  LYS  31           HG1      LYS  31  76.403  -1.215 -11.405
  238    HD2  LYS  31           HD2      LYS  31  76.660  -2.594 -13.300
  239    HD3  LYS  31           HD1      LYS  31  77.447  -1.320 -14.232
  240    HE2  LYS  31           HE2      LYS  31  79.457  -1.494 -12.960
  241    HE3  LYS  31           HE1      LYS  31  78.673  -2.471 -11.719
  242    HZ1  LYS  31           HZ1      LYS  31  78.908  -4.325 -12.919
  243    HZ2  LYS  31           HZ2      LYS  31  80.088  -3.458 -13.780
  244    HZ3  LYS  31           HZ3      LYS  31  78.503  -3.567 -14.381
  245    H    GLN  32           HN       GLN  32  77.134   0.668 -15.889
  246    HA   GLN  32           HA       GLN  32  80.006   0.498 -15.053
  247    HB2  GLN  32           HB2      GLN  32  78.878  -1.621 -15.886
  248    HB3  GLN  32           HB1      GLN  32  78.727  -0.833 -17.456
  249    HG2  GLN  32           HG2      GLN  32  81.073  -0.715 -17.751
  250    HG3  GLN  32           HG1      GLN  32  81.387  -1.023 -16.043
  251   HE21  GLN  32          HE21      GLN  32  82.103  -3.120 -15.684
  252   HE22  GLN  32          HE22      GLN  32  81.644  -4.481 -16.589
  253    H    ARG  33           HN       ARG  33  79.461   3.027 -15.539
  254    HA   ARG  33           HA       ARG  33  80.937   3.634 -17.937
  255    HE   ARG  33           HE       ARG  33  81.144   2.684 -19.605
  256    HB2  ARG  33           HB2      ARG  33  78.717   3.111 -18.939
  257    HB3  ARG  33           HB1      ARG  33  77.995   4.368 -17.938
  258    HG2  ARG  33           HG2      ARG  33  78.483   5.225 -20.199
  259    HG3  ARG  33           HG1      ARG  33  79.465   6.052 -18.989
  260    HD2  ARG  33           HD2      ARG  33  80.554   5.060 -21.215
  261    HD3  ARG  33           HD1      ARG  33  81.421   5.038 -19.679
  262   HH11  ARG  33          HH21      ARG  33  79.188   4.190 -22.012
  263   HH12  ARG  33          HH22      ARG  33  78.708   2.697 -22.746
  264   HH21  ARG  33          HH11      ARG  33  80.528   0.725 -20.550
  265   HH22  ARG  33          HH12      ARG  33  79.467   0.735 -21.919
  266    H    GLN  34           HN       GLN  34  79.130   4.589 -15.130
  267    HA   GLN  34           HA       GLN  34  80.362   7.319 -15.288
  268    HB2  GLN  34           HB2      GLN  34  78.557   8.066 -13.788
  269    HB3  GLN  34           HB1      GLN  34  77.897   7.365 -15.264
  270    HG2  GLN  34           HG2      GLN  34  76.641   6.075 -13.882
  271    HG3  GLN  34           HG1      GLN  34  78.126   5.160 -13.615
  272   HE21  GLN  34          HE21      GLN  34  78.495   4.871 -11.418
  273   HE22  GLN  34          HE22      GLN  34  78.146   6.009 -10.208
  274    H    THR  35           HN       THR  35  81.806   5.024 -14.332
  275    HA   THR  35           HA       THR  35  82.289   5.945 -11.545
  276    HB   THR  35           HB       THR  35  82.104   3.006 -12.265
  277    HG1  THR  35           HG1      THR  35  80.207   3.330 -10.746
  278   HG21  THR  35          HG21      THR  35  82.187   2.709  -9.828
  279   HG22  THR  35          HG22      THR  35  82.276   4.456  -9.608
  280   HG23  THR  35          HG23      THR  35  83.604   3.597 -10.388
  281    H    ARG  36           HN       ARG  36  84.231   6.886 -12.317
  282    HA   ARG  36           HA       ARG  36  86.252   5.006 -13.464
  283    HE   ARG  36           HE       ARG  36  86.838   4.731 -15.111
  284    HB2  ARG  36           HB2      ARG  36  86.196   8.039 -13.359
  285    HB3  ARG  36           HB1      ARG  36  87.485   7.076 -14.081
  286    HG2  ARG  36           HG2      ARG  36  84.805   6.338 -15.037
  287    HG3  ARG  36           HG1      ARG  36  85.256   7.998 -15.429
  288    HD2  ARG  36           HD2      ARG  36  85.954   6.316 -17.170
  289    HD3  ARG  36           HD1      ARG  36  87.290   7.259 -16.510
  290   HH11  ARG  36          HH21      ARG  36  88.352   6.395 -17.723
  291   HH12  ARG  36          HH22      ARG  36  89.635   5.244 -17.888
  292   HH21  ARG  36          HH11      ARG  36  88.506   3.218 -15.311
  293   HH22  ARG  36          HH12      ARG  36  89.723   3.445 -16.522
  294    H    GLN  37           HN       GLN  37  85.494   5.109 -10.600
  295    HA   GLN  37           HA       GLN  37  88.184   5.240  -9.506
  296    HB2  GLN  37           HB2      GLN  37  87.395   7.668  -9.563
  297    HB3  GLN  37           HB1      GLN  37  86.186   7.204  -8.365
  298    HG2  GLN  37           HG2      GLN  37  88.133   6.251  -6.994
  299    HG3  GLN  37           HG1      GLN  37  89.195   7.130  -8.095
  300   HE21  GLN  37          HE21      GLN  37  89.352   7.983  -5.505
  301   HE22  GLN  37          HE22      GLN  37  88.524   9.448  -5.284
  302    H1U  RCY  38           H1U      RCY  38  83.703  -1.820  -1.784
  303    H1S  RCY  38           H1S      RCY  38  85.048   1.308  -4.816
  304    HB1  RCY  38           HB1      RCY  38  85.010   2.168  -8.574
  305    HB2  RCY  38           HB2      RCY  38  84.437   2.865  -7.063
  306    HA   RCY  38           HA       RCY  38  86.564   2.931  -6.130
  307    HN1  RCY  38           HN1      RCY  38  87.918   3.222  -8.604
  308    H    LYS  39           HN       LYS  39  88.514   1.886  -5.607
  309    HA   LYS  39           HA       LYS  39  89.179  -0.604  -7.106
  310    HB2  LYS  39           HB2      LYS  39  90.765   0.986  -5.067
  311    HB3  LYS  39           HB1      LYS  39  91.341  -0.464  -5.890
  312    HG2  LYS  39           HG2      LYS  39  91.470   0.602  -7.966
  313    HG3  LYS  39           HG1      LYS  39  90.314   1.853  -7.506
  314    HD2  LYS  39           HD2      LYS  39  91.970   2.797  -5.929
  315    HD3  LYS  39           HD1      LYS  39  93.131   1.562  -6.420
  316    HE2  LYS  39           HE2      LYS  39  93.398   2.474  -8.557
  317    HE3  LYS  39           HE1      LYS  39  91.848   3.313  -8.500
  318    HZ1  LYS  39           HZ1      LYS  39  94.221   4.471  -8.031
  319    HZ2  LYS  39           HZ2      LYS  39  93.723   4.099  -6.450
  320    HZ3  LYS  39           HZ3      LYS  39  92.739   5.058  -7.449
  321    H    SER  40           HN       SER  40  90.356  -0.347  -3.900
  322    HA   SER  40           HA       SER  40  88.153  -1.820  -2.651
  323    HG   SER  40           HG       SER  40  89.189  -4.458  -1.637
  324    HB2  SER  40           HB2      SER  40  89.035  -3.762  -3.610
  325    HB3  SER  40           HB1      SER  40  90.689  -3.157  -3.554
  326    H    LYS  41           HN       LYS  41  90.238   0.514  -2.401
  327    HA   LYS  41           HA       LYS  41  90.919  -0.038   0.464
  328    HB2  LYS  41           HB2      LYS  41  92.843   0.151  -1.306
  329    HB3  LYS  41           HB1      LYS  41  92.486   1.876  -1.261
  330    HG2  LYS  41           HG2      LYS  41  94.082   1.729   0.423
  331    HG3  LYS  41           HG1      LYS  41  92.602   1.512   1.358
  332    HD2  LYS  41           HD2      LYS  41  92.932  -1.022   0.867
  333    HD3  LYS  41           HD1      LYS  41  94.592  -0.571   0.476
  334    HE2  LYS  41           HE2      LYS  41  94.619  -1.142   2.792
  335    HE3  LYS  41           HE1      LYS  41  94.647   0.621   2.740
  336    HZ1  LYS  41           HZ1      LYS  41  92.508  -1.182   3.571
  337    HZ2  LYS  41           HZ2      LYS  41  92.050   0.245   2.770
  338    HZ3  LYS  41           HZ3      LYS  41  92.961   0.326   4.202
  339    HA   PRO  42           HA       PRO  42  88.287   3.730   0.267
  340    HB2  PRO  42           HB2      PRO  42  86.382   2.955   2.019
  341    HB3  PRO  42           HB1      PRO  42  86.384   2.404   0.333
  342    HG2  PRO  42           HG2      PRO  42  87.172   0.953   2.791
  343    HG3  PRO  42           HG1      PRO  42  86.412   0.346   1.313
  344    HD2  PRO  42           HD2      PRO  42  89.152   0.162   1.959
  345    HD3  PRO  42           HD1      PRO  42  88.433  -0.128   0.360
  346    HA   PRO  43           HA       PRO  43  89.950   5.582   3.940
  347    HB2  PRO  43           HB2      PRO  43  88.113   7.552   4.445
  348    HB3  PRO  43           HB1      PRO  43  89.275   7.630   3.106
  349    HG2  PRO  43           HG2      PRO  43  86.397   6.872   3.063
  350    HG3  PRO  43           HG1      PRO  43  87.330   7.837   1.906
  351    HD2  PRO  43           HD2      PRO  43  86.698   5.207   1.476
  352    HD3  PRO  43           HD1      PRO  43  88.159   5.971   0.812
  353    H    LYS  44           HN       LYS  44  89.905   4.703   5.969
  354    HA   LYS  44           HA       LYS  44  87.311   3.757   7.060
  355    HB2  LYS  44           HB2      LYS  44  89.300   2.242   7.053
  356    HB3  LYS  44           HB1      LYS  44  90.120   3.364   8.136
  357    HG2  LYS  44           HG2      LYS  44  87.415   2.602   9.025
  358    HG3  LYS  44           HG1      LYS  44  88.560   1.262   8.973
  359    HD2  LYS  44           HD2      LYS  44  89.381   3.872  10.215
  360    HD3  LYS  44           HD1      LYS  44  88.408   2.730  11.142
  361    HE2  LYS  44           HE2      LYS  44  90.981   1.962   9.743
  362    HE3  LYS  44           HE1      LYS  44  90.910   2.463  11.432
  363    HZ1  LYS  44           HZ1      LYS  44  90.514  -0.066  10.472
  364    HZ2  LYS  44           HZ2      LYS  44  88.946   0.488  10.819
  365    HZ3  LYS  44           HZ3      LYS  44  90.136   0.486  12.031
  366    H    LYS  45           HN       LYS  45  89.624   6.301   7.456
  367    HA   LYS  45           HA       LYS  45  88.716   6.982  10.171
  368    HB2  LYS  45           HB2      LYS  45  91.086   7.365   9.166
  369    HB3  LYS  45           HB1      LYS  45  90.364   8.763   8.375
  370    HG2  LYS  45           HG2      LYS  45  90.830   9.876  10.297
  371    HG3  LYS  45           HG1      LYS  45  89.449   9.011  10.973
  372    HD2  LYS  45           HD2      LYS  45  92.283   7.937  10.986
  373    HD3  LYS  45           HD1      LYS  45  91.548   8.791  12.343
  374    HE2  LYS  45           HE2      LYS  45  89.679   7.074  12.271
  375    HE3  LYS  45           HE1      LYS  45  90.664   6.164  11.127
  376    HZ1  LYS  45           HZ1      LYS  45  90.904   6.349  13.951
  377    HZ2  LYS  45           HZ2      LYS  45  92.352   6.813  13.195
  378    HZ3  LYS  45           HZ3      LYS  45  91.676   5.288  12.877
  379    H    GLY  46           HN       GLY  46  86.443   6.959   8.870
  380    HA2  GLY  46           HA2      GLY  46  85.612   9.061   7.235
  381    HA3  GLY  46           HA1      GLY  46  84.568   8.317   8.447
  382    H    VAL  47           HN       VAL  47  85.970  11.207   7.528
  383    HA   VAL  47           HA       VAL  47  86.362  12.313  10.212
  384    HB   VAL  47           HB       VAL  47  86.335  14.513   8.683
  385   HG11  VAL  47          HG11      VAL  47  88.765  14.033   8.188
  386   HG12  VAL  47          HG12      VAL  47  88.498  12.392   8.778
  387   HG13  VAL  47          HG13      VAL  47  88.302  13.765   9.868
  388   HG21  VAL  47          HG21      VAL  47  86.900  14.093   6.403
  389   HG22  VAL  47          HG22      VAL  47  85.510  13.060   6.735
  390   HG23  VAL  47          HG23      VAL  47  87.133  12.370   6.702
  391    H    GLN  48           HN       GLN  48  84.023  12.928   7.558
  392    HA   GLN  48           HA       GLN  48  81.777  13.030   9.328
  393    HB2  GLN  48           HB2      GLN  48  81.334  15.518   9.103
  394    HB3  GLN  48           HB1      GLN  48  82.664  15.095  10.179
  395    HG2  GLN  48           HG2      GLN  48  84.153  15.351   8.050
  396    HG3  GLN  48           HG1      GLN  48  82.784  16.255   7.401
  397   HE21  GLN  48          HE21      GLN  48  85.009  16.170  10.225
  398   HE22  GLN  48          HE22      GLN  48  84.904  17.833  10.550
  399    H    GLY  49           HN       GLY  49  80.885  11.788   7.616
  400    HA2  GLY  49           HA2      GLY  49  79.317  11.779   5.812
  401    HA3  GLY  49           HA1      GLY  49  79.818  13.419   5.400
  402    H1U  RCY  50           H1U      RCY  50  81.633   6.863   3.745
  403    H1S  RCY  50           H1S      RCY  50  81.498  10.931   3.336
  404    HB1  RCY  50           HB1      RCY  50  82.859  11.897   0.990
  405    HB2  RCY  50           HB2      RCY  50  82.625  13.566   1.508
  406    HA   RCY  50           HA       RCY  50  83.101  11.116   3.198
  407    HN1  RCY  50           HN1      RCY  50  82.151  13.566   4.547
  408    H    GLY  51           HN       GLY  51  85.313  11.144   3.075
  409    HA2  GLY  51           HA2      GLY  51  86.678  13.759   3.597
  410    HA3  GLY  51           HA1      GLY  51  87.273  12.221   4.223
  411    H    ASP  52           HN       ASP  52  86.394  11.028   1.501
  412    HA   ASP  52           HA       ASP  52  88.260  12.258  -0.388
  413    HB2  ASP  52           HB2      ASP  52  89.117  10.088   1.359
  414    HB3  ASP  52           HB1      ASP  52  89.219   9.611  -0.335
  415    H    ASP  53           HN       ASP  53  88.305  10.933  -2.463
  416    HA   ASP  53           HA       ASP  53  87.005  10.052  -4.216
  417    HB2  ASP  53           HB2      ASP  53  87.696   8.017  -2.828
  418    HB3  ASP  53           HB1      ASP  53  86.081   8.075  -2.121
  419    H    ILE  54           HN       ILE  54  85.736  12.218  -3.013
  420    HA   ILE  54           HA       ILE  54  83.152  11.809  -1.984
  421    HB   ILE  54           HB       ILE  54  82.622  14.034  -3.155
  422   HG12  ILE  54          HG12      ILE  54  85.577  13.899  -3.815
  423   HG13  ILE  54          HG11      ILE  54  84.309  13.583  -5.000
  424   HG21  ILE  54          HG21      ILE  54  84.251  15.276  -1.705
  425   HG22  ILE  54          HG22      ILE  54  85.074  13.748  -1.394
  426   HG23  ILE  54          HG23      ILE  54  83.410  13.978  -0.856
  427   HD11  ILE  54          HD11      ILE  54  83.412  15.812  -4.736
  428   HD12  ILE  54          HD12      ILE  54  85.149  15.961  -5.007
  429   HD13  ILE  54          HD13      ILE  54  84.492  16.136  -3.379
  430    HA   PRO  55           HA       PRO  55  80.955   9.987  -5.375
  431    HB2  PRO  55           HB2      PRO  55  78.404  10.811  -4.826
  432    HB3  PRO  55           HB1      PRO  55  79.242   9.561  -3.886
  433    HG2  PRO  55           HG2      PRO  55  78.835  12.440  -3.250
  434    HG3  PRO  55           HG1      PRO  55  78.755  11.025  -2.187
  435    HD2  PRO  55           HD2      PRO  55  80.934  12.684  -2.292
  436    HD3  PRO  55           HD1      PRO  55  81.050  10.959  -1.878
  437    H    GLY  56           HN       GLY  56  80.265  13.427  -4.746
  438    HA2  GLY  56           HA2      GLY  56  80.706  14.149  -7.500
  439    HA3  GLY  56           HA1      GLY  56  78.979  14.108  -7.145
  440    H    MET  57           HN       MET  57  79.367  14.943  -4.338
  441    HA   MET  57           HA       MET  57  80.764  17.447  -4.225
  442    HB2  MET  57           HB2      MET  57  78.674  18.904  -4.195
  443    HB3  MET  57           HB1      MET  57  79.152  18.303  -5.783
  444    HG2  MET  57           HG2      MET  57  77.393  16.793  -5.895
  445    HG3  MET  57           HG1      MET  57  77.259  16.661  -4.141
  446    HE1  MET  57           HE1      MET  57  74.780  16.698  -4.372
  447    HE2  MET  57           HE2      MET  57  73.975  18.209  -3.957
  448    HE3  MET  57           HE3      MET  57  75.289  17.612  -2.947
  449    H    GLU  58           HN       GLU  58  79.700  14.936  -2.727
  450    HA   GLU  58           HA       GLU  58  78.872  14.388  -0.612
  451    HB2  GLU  58           HB2      GLU  58  80.021  15.573   1.196
  452    HB3  GLU  58           HB1      GLU  58  81.140  15.242  -0.123
  453    HG2  GLU  58           HG2      GLU  58  81.013  17.506  -0.917
  454    HG3  GLU  58           HG1      GLU  58  79.652  17.867   0.145
  455    H    GLY  59           HN       GLY  59  77.949  15.593   1.509
  456    HA2  GLY  59           HA2      GLY  59  75.935  16.531   2.306
  457    HA3  GLY  59           HA1      GLY  59  76.477  17.955   1.417
  458    H1U  RCY  60           H1U      RCY  60  75.928   8.682  -1.874
  459    H1S  RCY  60           H1S      RCY  60  71.852  11.296  -2.359
  460    HB1  RCY  60           HB1      RCY  60  73.838  13.137  -0.665
  461    HB2  RCY  60           HB2      RCY  60  74.623  13.956  -2.014
  462    HA   RCY  60           HA       RCY  60  73.465  16.033  -1.481
  463    HN1  RCY  60           HN1      RCY  60  74.929  14.790   0.798
  464    H    GLY  61           HN       GLY  61  71.954  13.267  -0.297
  465    HA2  GLY  61           HA2      GLY  61  69.880  14.933   1.072
  466    HA3  GLY  61           HA1      GLY  61  69.519  13.460   0.169
  467    H    THR  62           HN       THR  62  71.554  14.526   2.904
  468    HA   THR  62           HA       THR  62  72.238  12.228   4.175
  469    HB   THR  62           HB       THR  62  71.663  13.388   6.374
  470    HG1  THR  62           HG1      THR  62  70.245  14.903   6.214
  471   HG21  THR  62          HG21      THR  62  73.109  15.095   4.333
  472   HG22  THR  62          HG22      THR  62  73.814  13.671   5.099
  473   HG23  THR  62          HG23      THR  62  73.372  15.071   6.076
  474    H    ASP  63           HN       ASP  63  71.022  10.379   4.131
  475    HA   ASP  63           HA       ASP  63  68.232  10.136   4.156
  476    HB2  ASP  63           HB2      ASP  63  70.090   8.319   3.902
  477    HB3  ASP  63           HB1      ASP  63  69.962   8.181   5.655
  478    H    ILE  64           HN       ILE  64  70.415   9.957   6.991
  479    HA   ILE  64           HA       ILE  64  68.058  10.557   8.721
  480    HB   ILE  64           HB       ILE  64  70.590   9.005   9.140
  481   HG12  ILE  64          HG12      ILE  64  68.416   7.894   8.648
  482   HG13  ILE  64          HG11      ILE  64  69.034   7.459  10.242
  483   HG21  ILE  64          HG21      ILE  64  69.109  10.611  11.222
  484   HG22  ILE  64          HG22      ILE  64  70.847  10.519  10.940
  485   HG23  ILE  64          HG23      ILE  64  69.996   9.150  11.655
  486   HD11  ILE  64          HD11      ILE  64  66.610   8.962   9.520
  487   HD12  ILE  64          HD12      ILE  64  67.565   9.721  10.794
  488   HD13  ILE  64          HD13      ILE  64  66.982   8.068  10.994
  489    H    THR  65           HN       THR  65  71.536  11.202   8.493
  490    HA   THR  65           HA       THR  65  71.190  14.070   8.802
  491    HB   THR  65           HB       THR  65  72.533  12.539  11.062
  492    HG1  THR  65           HG1      THR  65  70.230  12.406  11.061
  493   HG21  THR  65          HG21      THR  65  71.788  15.458  11.016
  494   HG22  THR  65          HG22      THR  65  73.322  14.904  10.344
  495   HG23  THR  65          HG23      THR  65  72.958  14.635  12.048
  496    H    VAL  66           HN       VAL  66  73.030  11.176   8.567
  497    HA   VAL  66           HA       VAL  66  74.895  12.207   6.685
  498    HB   VAL  66           HB       VAL  66  76.905  11.716   8.415
  499   HG11  VAL  66          HG11      VAL  66  75.829  13.955   7.168
  500   HG12  VAL  66          HG12      VAL  66  77.367  13.897   8.029
  501   HG13  VAL  66          HG13      VAL  66  75.909  14.430   8.865
  502   HG21  VAL  66          HG21      VAL  66  76.444  12.226  10.638
  503   HG22  VAL  66          HG22      VAL  66  74.944  11.423  10.174
  504   HG23  VAL  66          HG23      VAL  66  75.021  13.184  10.230
  505    H    ILE  67           HN       ILE  67  74.639   9.884   9.390
  506    HA   ILE  67           HA       ILE  67  75.033   7.688   7.412
  507    HB   ILE  67           HB       ILE  67  76.580   8.199   9.953
  508   HG12  ILE  67          HG12      ILE  67  78.339   7.110   8.321
  509   HG13  ILE  67          HG11      ILE  67  77.152   7.517   7.081
  510   HG21  ILE  67          HG21      ILE  67  75.911   6.046  10.511
  511   HG22  ILE  67          HG22      ILE  67  77.320   5.692   9.512
  512   HG23  ILE  67          HG23      ILE  67  75.699   5.564   8.828
  513   HD11  ILE  67          HD11      ILE  67  77.714   9.674   9.023
  514   HD12  ILE  67          HD12      ILE  67  77.530   9.756   7.271
  515   HD13  ILE  67          HD13      ILE  67  79.065   9.245   7.974
  516    H1U  RCY  68           H1U      RCY  68  71.901   3.201   1.824
  517    H1S  RCY  68           H1S      RCY  68  70.094   5.235   5.193
  518    HB1  RCY  68           HB1      RCY  68  70.510   6.881   7.455
  519    HB2  RCY  68           HB2      RCY  68  69.632   5.907   8.633
  520    HA   RCY  68           HA       RCY  68  71.313   6.903   9.946
  521    HN1  RCY  68           HN1      RCY  68  72.805   7.127   7.518
  522    HA   PRO  69           HA       PRO  69  72.754   3.310  12.082
  523    HB2  PRO  69           HB2      PRO  69  69.989   2.235  11.608
  524    HB3  PRO  69           HB1      PRO  69  70.946   2.255  13.103
  525    HG2  PRO  69           HG2      PRO  69  68.985   4.020  12.648
  526    HG3  PRO  69           HG1      PRO  69  70.446   4.447  13.551
  527    HD2  PRO  69           HD2      PRO  69  69.610   5.314  10.851
  528    HD3  PRO  69           HD1      PRO  69  70.791   6.053  11.955
  529    H    TRP  70           HN       TRP  70  70.869   2.815   9.114
  530    HA   TRP  70           HA       TRP  70  71.940   0.137   8.665
  531    HD1  TRP  70           HD1      TRP  70  70.548  -1.458   5.875
  532    HE1  TRP  70           HE1      TRP  70  68.875  -3.136   6.886
  533    HE3  TRP  70           HE3      TRP  70  68.674   1.361   9.698
  534    HZ2  TRP  70           HZ2      TRP  70  66.987  -3.268   9.037
  535    HZ3  TRP  70           HZ3      TRP  70  66.944   0.438  11.209
  536    HH2  TRP  70           HH2      TRP  70  66.098  -1.869  10.886
  537    HB2  TRP  70           HB2      TRP  70  70.009   1.934   7.374
  538    HB3  TRP  70           HB1      TRP  70  71.000   1.062   6.207
  539    H    GLU  71           HN       GLU  71  72.806   3.422   7.769
  540    HA   GLU  71           HA       GLU  71  74.803   2.527   5.805
  541    HB2  GLU  71           HB2      GLU  71  73.507   4.995   6.462
  542    HB3  GLU  71           HB1      GLU  71  75.240   5.246   6.642
  543    HG2  GLU  71           HG2      GLU  71  74.087   3.878   4.209
  544    HG3  GLU  71           HG1      GLU  71  74.243   5.633   4.297
  545    H    ALA  72           HN       ALA  72  74.662   2.341   9.055
  546    HA   ALA  72           HA       ALA  72  77.210   3.395   9.878
  547    HB1  ALA  72           HB1      ALA  72  75.726   1.065  11.119
  548    HB2  ALA  72           HB2      ALA  72  75.282   2.749  11.398
  549    HB3  ALA  72           HB3      ALA  72  76.862   2.156  11.912
  550    H1U  RCY  73           H1U      RCY  73  78.748   0.069   3.645
  551    H1S  RCY  73           H1S      RCY  73  81.964  -1.380   6.897
  552    HB1  RCY  73           HB1      RCY  73  81.610   0.449  10.569
  553    HB2  RCY  73           HB2      RCY  73  81.267   1.944   9.700
  554    HA   RCY  73           HA       RCY  73  79.740   0.189   8.279
  555    HN1  RCY  73           HN1      RCY  73  79.146   2.134  10.363
  556    H    ASN  74           HN       ASN  74  77.609  -0.681   9.971
  557    HA   ASN  74           HA       ASN  74  78.527  -3.332  10.613
  558    HB2  ASN  74           HB2      ASN  74  78.137  -3.215  13.078
  559    HB3  ASN  74           HB1      ASN  74  79.513  -2.242  12.560
  560   HD21  ASN  74          HD21      ASN  74  76.890  -2.094  14.577
  561   HD22  ASN  74          HD22      ASN  74  76.610  -0.420  14.563
  562    H    HIS  75           HN       HIS  75  76.478  -3.613  12.787
  563    HA   HIS  75           HA       HIS  75  74.176  -4.018  12.975
  564    HD1  HIS  75           HD1      HIS  75  72.449  -0.425  13.334
  565    HD2  HIS  75           HD2      HIS  75  71.420  -4.276  12.107
  566    HE1  HIS  75           HE1      HIS  75  70.204  -0.935  14.390
  567    HE2  HIS  75           HE2      HIS  75  69.566  -3.277  13.650
  568    HB2  HIS  75           HB2      HIS  75  74.286  -1.494  12.015
  569    HB3  HIS  75           HB1      HIS  75  73.502  -2.277  10.644
  570    H1U  RCY  76           H1U      RCY  76  75.258  -2.002   2.162
  571    H1S  RCY  76           H1S      RCY  76  73.296  -4.602   5.754
  572    HB1  RCY  76           HB1      RCY  76  72.515  -5.642   8.682
  573    HB2  RCY  76           HB2      RCY  76  73.299  -5.864   7.118
  574    HA   RCY  76           HA       RCY  76  74.607  -6.654   9.191
  575    HN1  RCY  76           HN1      RCY  76  75.610  -4.002   9.755
  576    H    GLU  77           HN       GLU  77  76.838  -4.334   8.898
  577    HA   GLU  77           HA       GLU  77  77.650  -4.272   6.192
  578    HB2  GLU  77           HB2      GLU  77  78.722  -2.853   7.860
  579    HB3  GLU  77           HB1      GLU  77  79.350  -4.270   8.703
  580    HG2  GLU  77           HG2      GLU  77  80.799  -4.827   6.884
  581    HG3  GLU  77           HG1      GLU  77  80.005  -3.674   5.811
  582    H    LEU  78           HN       LEU  78  78.439  -6.651   8.729
  583    HA   LEU  78           HA       LEU  78  80.314  -8.239   7.466
  584    HG   LEU  78           HG       LEU  78  80.093 -10.683   7.818
  585    HB2  LEU  78           HB2      LEU  78  79.089  -8.599   9.727
  586    HB3  LEU  78           HB1      LEU  78  77.914  -9.511   8.780
  587   HD11  LEU  78          HD11      LEU  78  81.910 -10.801   9.371
  588   HD12  LEU  78          HD12      LEU  78  80.986  -9.963  10.618
  589   HD13  LEU  78          HD13      LEU  78  81.538  -9.086   9.191
  590   HD21  LEU  78          HD21      LEU  78  78.888 -11.230  10.549
  591   HD22  LEU  78          HD22      LEU  78  79.877 -12.379   9.648
  592   HD23  LEU  78          HD23      LEU  78  78.317 -11.863   9.005
  593    H    HIS  79           HN       HIS  79  80.352  -9.644   5.733
  594    HA   HIS  79           HA       HIS  79  78.188  -9.493   3.810
  595    HD1  HIS  79           HD1      HIS  79  80.367 -13.222   4.333
  596    HD2  HIS  79           HD2      HIS  79  82.570  -9.688   4.580
  597    HE1  HIS  79           HE1      HIS  79  82.452 -13.771   5.662
  598    HE2  HIS  79           HE2      HIS  79  83.802 -11.628   5.819
  599    HB2  HIS  79           HB2      HIS  79  79.599 -11.328   2.654
  600    HB3  HIS  79           HB1      HIS  79  80.340  -9.741   2.859
  601    H    GLU  80           HN       GLU  80  76.619 -10.319   5.573
  602    HA   GLU  80           HA       GLU  80  76.637 -13.296   5.739
  603    HB2  GLU  80           HB2      GLU  80  76.355 -11.806   7.816
  604    HB3  GLU  80           HB1      GLU  80  74.750 -11.432   7.187
  605    HG2  GLU  80           HG2      GLU  80  74.421 -13.281   8.646
  606    HG3  GLU  80           HG1      GLU  80  74.398 -13.970   7.023
  607    H    LEU  81           HN       LEU  81  74.236 -10.672   5.221
  608    HA   LEU  81           HA       LEU  81  72.384 -12.509   3.931
  609    HG   LEU  81           HG       LEU  81  70.429  -9.957   5.590
  610    HB2  LEU  81           HB2      LEU  81  72.482  -9.531   4.370
  611    HB3  LEU  81           HB1      LEU  81  71.308 -10.208   3.244
  612   HD11  LEU  81          HD11      LEU  81  69.921 -11.889   3.786
  613   HD12  LEU  81          HD12      LEU  81  69.139 -11.846   5.366
  614   HD13  LEU  81          HD13      LEU  81  70.532 -12.893   5.100
  615   HD21  LEU  81          HD21      LEU  81  72.672 -10.567   6.630
  616   HD22  LEU  81          HD22      LEU  81  72.315 -12.244   6.216
  617   HD23  LEU  81          HD23      LEU  81  71.273 -11.371   7.340
  618    H    ALA  82           HN       ALA  82  75.214 -11.962   2.831
  619    HA   ALA  82           HA       ALA  82  74.885 -10.634   0.298
  620    HB1  ALA  82           HB1      ALA  82  77.041 -11.711  -0.284
  621    HB2  ALA  82           HB2      ALA  82  76.922 -12.710   1.165
  622    HB3  ALA  82           HB3      ALA  82  77.101 -10.962   1.312
  623    H    GLN  83           HN       GLN  83  72.765 -11.786  -0.214
  624    HA   GLN  83           HA       GLN  83  72.798 -14.587  -0.924
  625    HB2  GLN  83           HB2      GLN  83  70.731 -13.186  -0.442
  626    HB3  GLN  83           HB1      GLN  83  70.952 -12.455  -2.032
  627    HG2  GLN  83           HG2      GLN  83  69.472 -14.216  -2.492
  628    HG3  GLN  83           HG1      GLN  83  71.039 -14.927  -2.881
  629   HE21  GLN  83          HE21      GLN  83  68.829 -16.578  -2.123
  630   HE22  GLN  83          HE22      GLN  83  69.170 -17.273  -0.612
  631    H    TYR  84           HN       TYR  84  72.281 -11.864  -3.177
  632    HA   TYR  84           HA       TYR  84  73.363 -13.397  -5.395
  633    HD1  TYR  84           HD1      TYR  84  70.936 -13.439  -6.138
  634    HD2  TYR  84           HD2      TYR  84  71.148  -9.503  -4.432
  635    HE1  TYR  84           HE1      TYR  84  68.531 -13.567  -5.544
  636    HE2  TYR  84           HE2      TYR  84  68.744  -9.631  -3.837
  637    HH   TYR  84           HH       TYR  84  66.661 -11.101  -4.916
  638    HB2  TYR  84           HB2      TYR  84  73.044 -10.402  -5.441
  639    HB3  TYR  84           HB1      TYR  84  72.782 -11.564  -6.743
  640    H    GLY  85           HN       GLY  85  74.466 -10.481  -3.651
  641    HA2  GLY  85           HA2      GLY  85  76.858 -10.383  -2.948
  642    HA3  GLY  85           HA1      GLY  85  77.260 -11.160  -4.484
  643    H    ILE  86           HN       ILE  86  78.456  -8.736  -3.899
  644    HA   ILE  86           HA       ILE  86  78.723  -6.546  -4.721
  645    HB   ILE  86           HB       ILE  86  77.288  -7.983  -6.963
  646   HG12  ILE  86          HG12      ILE  86  79.528  -7.745  -8.031
  647   HG13  ILE  86          HG11      ILE  86  80.117  -6.954  -6.568
  648   HG21  ILE  86          HG21      ILE  86  78.321  -5.808  -8.194
  649   HG22  ILE  86          HG22      ILE  86  77.889  -5.090  -6.642
  650   HG23  ILE  86          HG23      ILE  86  76.654  -5.881  -7.622
  651   HD11  ILE  86          HD11      ILE  86  80.510  -9.519  -6.841
  652   HD12  ILE  86          HD12      ILE  86  78.806  -9.659  -6.407
  653   HD13  ILE  86          HD13      ILE  86  79.943  -8.912  -5.285
  654    H1U  RCY  87           H1U      RCY  87  76.972  -0.298   1.321
  655    H1S  RCY  87           H1S      RCY  87  76.929  -4.313   1.034
  656    HB1  RCY  87           HB1      RCY  87  74.551  -4.431  -1.235
  657    HB2  RCY  87           HB2      RCY  87  75.910  -3.463  -1.800
  658    HA   RCY  87           HA       RCY  87  74.429  -5.643  -3.187
  659    HN1  RCY  87           HN1      RCY  87  77.214  -5.961  -2.921
  Start of MODEL   33
    1    HA   MET   1           HA       MET   1  63.758  12.939  19.592
    2    HB2  MET   1           HB2      MET   1  61.855  14.258  21.555
    3    HB3  MET   1           HB1      MET   1  62.173  12.527  21.432
    4    HG2  MET   1           HG2      MET   1  64.496  12.851  22.053
    5    HG3  MET   1           HG1      MET   1  64.303  14.604  22.014
    6    HE1  MET   1           HE1      MET   1  62.686  11.553  24.967
    7    HE2  MET   1           HE2      MET   1  63.211  11.338  23.299
    8    HE3  MET   1           HE3      MET   1  61.595  11.954  23.635
    9    H    ASN   2           HN       ASN   2  60.561  13.610  20.469
   10    HA   ASN   2           HA       ASN   2  58.588  13.073  19.283
   11    HB2  ASN   2           HB2      ASN   2  58.154  14.702  17.469
   12    HB3  ASN   2           HB1      ASN   2  58.837  15.485  18.893
   13   HD21  ASN   2          HD21      ASN   2  59.401  14.735  15.521
   14   HD22  ASN   2          HD22      ASN   2  60.905  15.511  15.397
   15    H    LEU   3           HN       LEU   3  59.123  10.887  18.660
   16    HA   LEU   3           HA       LEU   3  60.560  10.350  16.192
   17    HG   LEU   3           HG       LEU   3  61.789   8.496  17.179
   18    HB2  LEU   3           HB2      LEU   3  58.898   8.679  18.078
   19    HB3  LEU   3           HB1      LEU   3  59.487   8.015  16.554
   20   HD11  LEU   3          HD11      LEU   3  62.154   9.332  19.592
   21   HD12  LEU   3          HD12      LEU   3  60.468   9.848  19.536
   22   HD13  LEU   3          HD13      LEU   3  61.636  10.525  18.400
   23   HD21  LEU   3          HD21      LEU   3  60.829   6.377  17.988
   24   HD22  LEU   3          HD22      LEU   3  60.255   7.184  19.447
   25   HD23  LEU   3          HD23      LEU   3  61.986   7.013  19.157
   26    H    GLU   4           HN       GLU   4  59.643   9.675  14.190
   27    HA   GLU   4           HA       GLU   4  57.001  10.833  13.648
   28    HB2  GLU   4           HB2      GLU   4  59.141   9.557  11.941
   29    HB3  GLU   4           HB1      GLU   4  57.558   9.964  11.279
   30    HG2  GLU   4           HG2      GLU   4  59.084  11.822  10.880
   31    HG3  GLU   4           HG1      GLU   4  57.880  12.313  12.072
   32    HA   PRO   5           HA       PRO   5  54.301   7.360  14.023
   33    HB2  PRO   5           HB2      PRO   5  53.895   7.688  11.067
   34    HB3  PRO   5           HB1      PRO   5  52.687   7.470  12.349
   35    HG2  PRO   5           HG2      PRO   5  53.220   9.871  11.280
   36    HG3  PRO   5           HG1      PRO   5  52.759   9.670  12.977
   37    HD2  PRO   5           HD2      PRO   5  55.371  10.440  11.847
   38    HD3  PRO   5           HD1      PRO   5  54.765  10.630  13.506
   39    HA   PRO   6           HA       PRO   6  57.305   4.361  12.313
   40    HB2  PRO   6           HB2      PRO   6  57.173   2.562  14.338
   41    HB3  PRO   6           HB1      PRO   6  58.101   4.069  14.469
   42    HG2  PRO   6           HG2      PRO   6  55.444   3.384  15.601
   43    HG3  PRO   6           HG1      PRO   6  56.743   4.376  16.282
   44    HD2  PRO   6           HD2      PRO   6  54.453   5.376  15.032
   45    HD3  PRO   6           HD1      PRO   6  55.957   6.286  15.290
   46    H    LYS   7           HN       LYS   7  56.755   2.804  10.846
   47    HA   LYS   7           HA       LYS   7  54.990   0.634  11.301
   48    HB2  LYS   7           HB2      LYS   7  53.151   1.478   9.657
   49    HB3  LYS   7           HB1      LYS   7  53.088   2.024  11.331
   50    HG2  LYS   7           HG2      LYS   7  53.892   4.162  10.804
   51    HG3  LYS   7           HG1      LYS   7  54.613   3.622   9.288
   52    HD2  LYS   7           HD2      LYS   7  51.646   3.383   9.619
   53    HD3  LYS   7           HD1      LYS   7  52.331   4.976   9.290
   54    HE2  LYS   7           HE2      LYS   7  53.271   4.269   7.230
   55    HE3  LYS   7           HE1      LYS   7  53.070   2.563   7.631
   56    HZ1  LYS   7           HZ1      LYS   7  51.187   4.413   6.495
   57    HZ2  LYS   7           HZ2      LYS   7  50.553   3.537   7.806
   58    HZ3  LYS   7           HZ3      LYS   7  51.194   2.717   6.463
   59    H    ALA   8           HN       ALA   8  55.657  -0.846   9.814
   60    HA   ALA   8           HA       ALA   8  55.931  -0.226   7.007
   61    HB1  ALA   8           HB1      ALA   8  58.503  -0.688   8.548
   62    HB2  ALA   8           HB2      ALA   8  57.996   0.861   7.875
   63    HB3  ALA   8           HB3      ALA   8  58.356  -0.491   6.802
   64    H    GLU   9           HN       GLU   9  58.300  -2.316   7.165
   65    HA   GLU   9           HA       GLU   9  56.816  -4.719   8.016
   66    HB2  GLU   9           HB2      GLU   9  56.117  -4.163   5.621
   67    HB3  GLU   9           HB1      GLU   9  57.785  -4.499   5.155
   68    HG2  GLU   9           HG2      GLU   9  57.632  -6.772   5.884
   69    HG3  GLU   9           HG1      GLU   9  56.104  -6.473   6.715
   70    H1U  RCY  10           H1U      RCY  10  58.500 -10.229   5.002
   71    H1S  RCY  10           H1S      RCY  10  60.376  -9.400   9.245
   72    HB1  RCY  10           HB1      RCY  10  60.609  -5.449   9.677
   73    HB2  RCY  10           HB2      RCY  10  61.841  -6.702   9.529
   74    HA   RCY  10           HA       RCY  10  61.120  -6.187   7.296
   75    HN1  RCY  10           HN1      RCY  10  58.265  -6.708   7.678
   76    H    ARG  11           HN       ARG  11  58.549  -8.100   6.892
   77    HA   ARG  11           HA       ARG  11  59.091 -10.700   7.659
   78    HE   ARG  11           HE       ARG  11  57.089 -12.049   3.383
   79    HB2  ARG  11           HB2      ARG  11  58.118 -11.411   5.443
   80    HB3  ARG  11           HB1      ARG  11  57.145 -10.228   6.315
   81    HG2  ARG  11           HG2      ARG  11  57.294  -8.798   4.581
   82    HG3  ARG  11           HG1      ARG  11  59.054  -8.819   4.699
   83    HD2  ARG  11           HD2      ARG  11  58.301  -9.559   2.463
   84    HD3  ARG  11           HD1      ARG  11  59.131 -10.859   3.320
   85   HH11  ARG  11          HH21      ARG  11  56.649  -8.721   2.598
   86   HH12  ARG  11          HH22      ARG  11  54.969  -8.896   2.214
   87   HH21  ARG  11          HH11      ARG  11  54.898 -12.297   2.887
   88   HH22  ARG  11          HH12      ARG  11  53.978 -10.921   2.378
   89    H    SER  12           HN       SER  12  61.247 -11.328   7.795
   90    HA   SER  12           HA       SER  12  62.531 -12.329   5.452
   91    HG   SER  12           HG       SER  12  62.474  -9.345   4.484
   92    HB2  SER  12           HB2      SER  12  63.344  -9.585   6.371
   93    HB3  SER  12           HB1      SER  12  64.559 -10.668   5.696
   94    H    ALA  13           HN       ALA  13  63.174 -14.134   6.576
   95    HA   ALA  13           HA       ALA  13  65.421 -13.976   8.361
   96    HB1  ALA  13           HB1      ALA  13  63.824 -13.212  10.012
   97    HB2  ALA  13           HB2      ALA  13  64.236 -14.884  10.394
   98    HB3  ALA  13           HB3      ALA  13  62.707 -14.512   9.598
   99    H    THR  14           HN       THR  14  63.895 -15.498   6.078
  100    HA   THR  14           HA       THR  14  63.988 -18.257   7.126
  101    HB   THR  14           HB       THR  14  63.236 -18.876   4.845
  102    HG1  THR  14           HG1      THR  14  62.750 -16.339   4.033
  103   HG21  THR  14          HG21      THR  14  61.045 -17.944   5.023
  104   HG22  THR  14          HG22      THR  14  61.650 -16.499   5.834
  105   HG23  THR  14          HG23      THR  14  61.657 -18.051   6.673
  106    H    ARG  15           HN       ARG  15  65.176 -17.261   3.947
  107    HA   ARG  15           HA       ARG  15  67.962 -17.879   4.707
  108    HE   ARG  15           HE       ARG  15  71.195 -20.499   4.998
  109    HB2  ARG  15           HB2      ARG  15  66.663 -20.043   4.037
  110    HB3  ARG  15           HB1      ARG  15  66.757 -19.401   2.399
  111    HG2  ARG  15           HG2      ARG  15  68.728 -20.618   2.459
  112    HG3  ARG  15           HG1      ARG  15  69.315 -19.063   3.047
  113    HD2  ARG  15           HD2      ARG  15  68.969 -19.841   5.383
  114    HD3  ARG  15           HD1      ARG  15  68.462 -21.412   4.765
  115   HH11  ARG  15          HH21      ARG  15  68.972 -22.328   3.102
  116   HH12  ARG  15          HH22      ARG  15  70.185 -23.383   2.457
  117   HH21  ARG  15          HH11      ARG  15  72.792 -21.866   4.168
  118   HH22  ARG  15          HH12      ARG  15  72.347 -23.122   3.060
  119    H    VAL  16           HN       VAL  16  68.348 -18.384   1.686
  120    HA   VAL  16           HA       VAL  16  67.674 -15.756   0.538
  121    HB   VAL  16           HB       VAL  16  70.534 -16.615   1.068
  122   HG11  VAL  16          HG11      VAL  16  70.539 -15.742  -1.147
  123   HG12  VAL  16          HG12      VAL  16  71.019 -14.390  -0.120
  124   HG13  VAL  16          HG13      VAL  16  69.369 -14.488  -0.736
  125   HG21  VAL  16          HG21      VAL  16  70.555 -14.264   2.090
  126   HG22  VAL  16          HG22      VAL  16  69.638 -15.484   2.973
  127   HG23  VAL  16          HG23      VAL  16  68.796 -14.306   1.967
  128    H    MET  17           HN       MET  17  67.273 -16.047  -1.604
  129    HA   MET  17           HA       MET  17  68.825 -17.958  -3.189
  130    HB2  MET  17           HB2      MET  17  67.022 -19.323  -1.995
  131    HB3  MET  17           HB1      MET  17  65.847 -18.437  -2.969
  132    HG2  MET  17           HG2      MET  17  66.310 -20.427  -4.197
  133    HG3  MET  17           HG1      MET  17  67.219 -19.153  -5.009
  134    HE1  MET  17           HE1      MET  17  67.297 -22.576  -4.174
  135    HE2  MET  17           HE2      MET  17  68.982 -22.893  -4.579
  136    HE3  MET  17           HE3      MET  17  67.975 -21.965  -5.688
  137    H    GLY  18           HN       GLY  18  66.200 -15.631  -2.917
  138    HA2  GLY  18           HA2      GLY  18  65.778 -13.844  -4.437
  139    HA3  GLY  18           HA1      GLY  18  66.883 -14.597  -5.588
  140    H    GLY  19           HN       GLY  19  65.996 -16.890  -6.322
  141    HA2  GLY  19           HA2      GLY  19  64.309 -18.092  -7.430
  142    HA3  GLY  19           HA1      GLY  19  63.141 -17.266  -6.397
  143    HA   PRO  20           HA       PRO  20  62.372 -15.933 -10.814
  144    HB2  PRO  20           HB2      PRO  20  59.774 -15.389  -9.428
  145    HB3  PRO  20           HB1      PRO  20  60.073 -16.117 -11.019
  146    HG2  PRO  20           HG2      PRO  20  59.372 -17.599  -8.925
  147    HG3  PRO  20           HG1      PRO  20  60.529 -18.189 -10.130
  148    HD2  PRO  20           HD2      PRO  20  61.035 -17.239  -7.344
  149    HD3  PRO  20           HD1      PRO  20  61.914 -18.451  -8.302
  150    H1U  RCY  21           H1U      RCY  21  62.273  -8.165  -1.181
  151    H1S  RCY  21           H1S      RCY  21  61.405  -9.501  -5.629
  152    HB1  RCY  21           HB1      RCY  21  64.213 -12.532  -6.812
  153    HB2  RCY  21           HB2      RCY  21  62.587 -12.580  -6.131
  154    HA   RCY  21           HA       RCY  21  61.675 -11.817  -8.314
  155    HN1  RCY  21           HN1      RCY  21  62.801 -14.404  -7.877
  156    H    THR  22           HN       THR  22  62.080 -10.719 -10.188
  157    HA   THR  22           HA       THR  22  64.670 -10.933 -11.536
  158    HB   THR  22           HB       THR  22  63.526  -9.072 -12.993
  159    HG1  THR  22           HG1      THR  22  61.657  -8.496 -12.283
  160   HG21  THR  22          HG21      THR  22  63.794 -11.341 -13.787
  161   HG22  THR  22          HG22      THR  22  62.132 -10.845 -14.108
  162   HG23  THR  22          HG23      THR  22  62.487 -11.907 -12.746
  163    HA   PRO  23           HA       PRO  23  66.962  -7.585  -9.786
  164    HB2  PRO  23           HB2      PRO  23  66.939  -6.368 -12.527
  165    HB3  PRO  23           HB1      PRO  23  68.305  -6.641 -11.428
  166    HG2  PRO  23           HG2      PRO  23  67.845  -8.229 -13.527
  167    HG3  PRO  23           HG1      PRO  23  68.502  -8.851 -12.005
  168    HD2  PRO  23           HD2      PRO  23  65.800  -9.233 -13.168
  169    HD3  PRO  23           HD1      PRO  23  66.675 -10.239 -11.995
  170    H    ARG  24           HN       ARG  24  66.978  -4.986  -9.944
  171    HA   ARG  24           HA       ARG  24  64.618  -3.972  -8.898
  172    HE   ARG  24           HE       ARG  24  67.348  -0.687  -7.928
  173    HB2  ARG  24           HB2      ARG  24  66.889  -2.801  -9.133
  174    HB3  ARG  24           HB1      ARG  24  66.361  -2.337 -10.750
  175    HG2  ARG  24           HG2      ARG  24  65.604  -0.505  -9.551
  176    HG3  ARG  24           HG1      ARG  24  64.185  -1.547  -9.435
  177    HD2  ARG  24           HD2      ARG  24  64.552  -0.878  -7.205
  178    HD3  ARG  24           HD1      ARG  24  65.304  -2.471  -7.283
  179   HH11  ARG  24          HH21      ARG  24  65.105  -1.181  -5.357
  180   HH12  ARG  24          HH22      ARG  24  66.161  -0.550  -4.137
  181   HH21  ARG  24          HH11      ARG  24  68.740   0.140  -6.350
  182   HH22  ARG  24          HH12      ARG  24  68.219   0.198  -4.699
  183    H    LYS  25           HN       LYS  25  62.600  -3.791  -9.730
  184    HA   LYS  25           HA       LYS  25  62.005  -4.312 -12.489
  185    HB2  LYS  25           HB2      LYS  25  59.714  -3.703 -11.914
  186    HB3  LYS  25           HB1      LYS  25  60.400  -4.662 -10.601
  187    HG2  LYS  25           HG2      LYS  25  61.049  -2.435  -9.513
  188    HG3  LYS  25           HG1      LYS  25  59.991  -1.668 -10.698
  189    HD2  LYS  25           HD2      LYS  25  58.102  -3.035  -9.918
  190    HD3  LYS  25           HD1      LYS  25  59.153  -3.837  -8.751
  191    HE2  LYS  25           HE2      LYS  25  57.957  -2.092  -7.581
  192    HE3  LYS  25           HE1      LYS  25  59.634  -1.574  -7.749
  193    HZ1  LYS  25           HZ1      LYS  25  57.237  -0.591  -9.120
  194    HZ2  LYS  25           HZ2      LYS  25  58.720  -0.540  -9.947
  195    HZ3  LYS  25           HZ3      LYS  25  58.541   0.277  -8.468
  196    H    GLY  26           HN       GLY  26  62.956  -1.447 -10.810
  197    HA2  GLY  26           HA2      GLY  26  61.805   0.414 -12.749
  198    HA3  GLY  26           HA1      GLY  26  62.947   0.827 -11.469
  199    HA   PRO  27           HA       PRO  27  65.009  -0.376 -15.793
  200    HB2  PRO  27           HB2      PRO  27  64.185   2.260 -16.890
  201    HB3  PRO  27           HB1      PRO  27  64.209   0.670 -17.676
  202    HG2  PRO  27           HG2      PRO  27  61.931   1.876 -16.933
  203    HG3  PRO  27           HG1      PRO  27  62.128   0.116 -16.928
  204    HD2  PRO  27           HD2      PRO  27  62.088   2.013 -14.618
  205    HD3  PRO  27           HD1      PRO  27  61.536   0.325 -14.704
  206    HA   PRO  28           HA       PRO  28  68.618   2.031 -14.918
  207    HB2  PRO  28           HB2      PRO  28  68.605   3.345 -17.601
  208    HB3  PRO  28           HB1      PRO  28  69.886   2.403 -16.812
  209    HG2  PRO  28           HG2      PRO  28  68.438   1.391 -18.802
  210    HG3  PRO  28           HG1      PRO  28  68.970   0.389 -17.442
  211    HD2  PRO  28           HD2      PRO  28  66.244   1.486 -18.019
  212    HD3  PRO  28           HD1      PRO  28  66.704  -0.048 -17.244
  213    H    LYS  29           HN       LYS  29  69.450   4.275 -14.566
  214    HA   LYS  29           HA       LYS  29  67.433   6.428 -14.940
  215    HB2  LYS  29           HB2      LYS  29  68.720   5.804 -12.265
  216    HB3  LYS  29           HB1      LYS  29  67.559   7.089 -12.597
  217    HG2  LYS  29           HG2      LYS  29  65.891   5.358 -13.268
  218    HG3  LYS  29           HG1      LYS  29  67.046   4.108 -12.805
  219    HD2  LYS  29           HD2      LYS  29  67.094   5.031 -10.501
  220    HD3  LYS  29           HD1      LYS  29  65.888   6.229 -10.972
  221    HE2  LYS  29           HE2      LYS  29  64.233   4.553 -11.361
  222    HE3  LYS  29           HE1      LYS  29  65.427   3.257 -11.291
  223    HZ1  LYS  29           HZ1      LYS  29  65.751   3.637  -8.983
  224    HZ2  LYS  29           HZ2      LYS  29  64.076   3.525  -9.242
  225    HZ3  LYS  29           HZ3      LYS  29  64.803   5.043  -9.007
  226    H1U  RCY  30           H1U      RCY  30  74.392  10.622  -7.524
  227    H1S  RCY  30           H1S      RCY  30  72.279   8.609 -11.419
  228    HB1  RCY  30           HB1      RCY  30  71.187   8.297 -12.957
  229    HB2  RCY  30           HB2      RCY  30  71.357   9.234 -14.440
  230    HA   RCY  30           HA       RCY  30  72.008   7.397 -15.686
  231    HN1  RCY  30           HN1      RCY  30  70.717   5.416 -14.197
  232    H    LYS  31           HN       LYS  31  74.091   6.700 -15.856
  233    HA   LYS  31           HA       LYS  31  75.237   5.128 -13.577
  234    HB2  LYS  31           HB2      LYS  31  76.518   3.936 -15.525
  235    HB3  LYS  31           HB1      LYS  31  74.855   3.462 -15.183
  236    HG2  LYS  31           HG2      LYS  31  75.203   5.726 -17.077
  237    HG3  LYS  31           HG1      LYS  31  75.702   4.139 -17.662
  238    HD2  LYS  31           HD2      LYS  31  73.510   3.210 -17.141
  239    HD3  LYS  31           HD1      LYS  31  73.000   4.739 -16.424
  240    HE2  LYS  31           HE2      LYS  31  72.258   4.289 -18.848
  241    HE3  LYS  31           HE1      LYS  31  73.007   5.851 -18.520
  242    HZ1  LYS  31           HZ1      LYS  31  74.501   3.484 -19.500
  243    HZ2  LYS  31           HZ2      LYS  31  75.068   5.080 -19.372
  244    HZ3  LYS  31           HZ3      LYS  31  73.877   4.688 -20.519
  245    H    GLN  32           HN       GLN  32  75.560   7.770 -15.675
  246    HA   GLN  32           HA       GLN  32  78.507   7.931 -15.167
  247    HB2  GLN  32           HB2      GLN  32  76.733   9.125 -17.301
  248    HB3  GLN  32           HB1      GLN  32  78.348   9.756 -16.980
  249    HG2  GLN  32           HG2      GLN  32  77.847   6.820 -17.495
  250    HG3  GLN  32           HG1      GLN  32  78.174   7.960 -18.801
  251   HE21  GLN  32          HE21      GLN  32  79.596   6.397 -15.948
  252   HE22  GLN  32          HE22      GLN  32  81.199   6.832 -16.295
  253    H    ARG  33           HN       ARG  33  78.312   8.793 -13.041
  254    HA   ARG  33           HA       ARG  33  76.860  11.374 -12.755
  255    HE   ARG  33           HE       ARG  33  76.241   8.927  -9.298
  256    HB2  ARG  33           HB2      ARG  33  76.819   9.337 -11.068
  257    HB3  ARG  33           HB1      ARG  33  78.337  10.035 -10.505
  258    HG2  ARG  33           HG2      ARG  33  77.079  12.271 -10.380
  259    HG3  ARG  33           HG1      ARG  33  75.603  11.322 -10.557
  260    HD2  ARG  33           HD2      ARG  33  77.598  11.302  -8.305
  261    HD3  ARG  33           HD1      ARG  33  75.842  11.447  -8.228
  262   HH11  ARG  33          HH21      ARG  33  77.358  10.671  -6.542
  263   HH12  ARG  33          HH22      ARG  33  77.523   9.260  -5.550
  264   HH21  ARG  33          HH11      ARG  33  76.450   7.075  -8.019
  265   HH22  ARG  33          HH12      ARG  33  77.009   7.224  -6.387
  266    H    GLN  34           HN       GLN  34  78.825  11.959 -10.473
  267    HA   GLN  34           HA       GLN  34  81.413  12.386 -11.663
  268    HB2  GLN  34           HB2      GLN  34  79.908  14.035 -12.929
  269    HB3  GLN  34           HB1      GLN  34  79.755  14.902 -11.400
  270    HG2  GLN  34           HG2      GLN  34  81.575  15.921 -12.594
  271    HG3  GLN  34           HG1      GLN  34  82.290  14.958 -11.301
  272   HE21  GLN  34          HE21      GLN  34  81.455  14.767 -14.798
  273   HE22  GLN  34          HE22      GLN  34  82.703  13.685 -15.190
  274    H    THR  35           HN       THR  35  81.206  11.327  -9.330
  275    HA   THR  35           HA       THR  35  81.112  13.415  -7.218
  276    HB   THR  35           HB       THR  35  81.566  10.453  -6.820
  277    HG1  THR  35           HG1      THR  35  79.649  10.827  -8.027
  278   HG21  THR  35          HG21      THR  35  80.515  10.969  -4.624
  279   HG22  THR  35          HG22      THR  35  80.429  12.667  -5.090
  280   HG23  THR  35          HG23      THR  35  81.998  11.886  -4.889
  281    H    ARG  36           HN       ARG  36  82.958  14.207  -6.321
  282    HA   ARG  36           HA       ARG  36  85.549  13.052  -7.228
  283    HE   ARG  36           HE       ARG  36  86.991  16.189 -10.297
  284    HB2  ARG  36           HB2      ARG  36  85.047  15.655  -5.759
  285    HB3  ARG  36           HB1      ARG  36  86.529  15.169  -6.582
  286    HG2  ARG  36           HG2      ARG  36  83.858  15.501  -7.977
  287    HG3  ARG  36           HG1      ARG  36  85.101  16.752  -7.922
  288    HD2  ARG  36           HD2      ARG  36  86.512  14.509  -8.731
  289    HD3  ARG  36           HD1      ARG  36  84.970  14.332  -9.568
  290   HH11  ARG  36          HH21      ARG  36  83.612  16.004  -9.639
  291   HH12  ARG  36          HH22      ARG  36  83.197  17.299 -10.711
  292   HH21  ARG  36          HH11      ARG  36  86.469  17.882 -11.700
  293   HH22  ARG  36          HH12      ARG  36  84.815  18.363 -11.878
  294    H    GLN  37           HN       GLN  37  83.810  11.913  -5.052
  295    HA   GLN  37           HA       GLN  37  85.928  11.838  -2.957
  296    HB2  GLN  37           HB2      GLN  37  82.977  12.340  -2.472
  297    HB3  GLN  37           HB1      GLN  37  84.132  11.929  -1.204
  298    HG2  GLN  37           HG2      GLN  37  85.461  13.923  -1.737
  299    HG3  GLN  37           HG1      GLN  37  84.350  14.328  -3.045
  300   HE21  GLN  37          HE21      GLN  37  82.375  13.014  -0.754
  301   HE22  GLN  37          HE22      GLN  37  81.950  14.414   0.107
  302    H1U  RCY  38           H1U      RCY  38  80.754   9.283   1.353
  303    H1S  RCY  38           H1S      RCY  38  79.471   7.695  -2.970
  304    HB1  RCY  38           HB1      RCY  38  81.721   8.196  -5.389
  305    HB2  RCY  38           HB2      RCY  38  81.151   8.875  -3.864
  306    HA   RCY  38           HA       RCY  38  83.336   7.906  -2.856
  307    HN1  RCY  38           HN1      RCY  38  83.014  10.385  -4.368
  308    H    LYS  39           HN       LYS  39  85.284   9.180  -5.073
  309    HA   LYS  39           HA       LYS  39  85.572   6.883  -6.875
  310    HB2  LYS  39           HB2      LYS  39  87.586   8.165  -7.691
  311    HB3  LYS  39           HB1      LYS  39  86.073   9.064  -7.788
  312    HG2  LYS  39           HG2      LYS  39  86.599  10.384  -5.895
  313    HG3  LYS  39           HG1      LYS  39  87.866   9.275  -5.369
  314    HD2  LYS  39           HD2      LYS  39  89.204   9.864  -7.364
  315    HD3  LYS  39           HD1      LYS  39  87.944  10.990  -7.870
  316    HE2  LYS  39           HE2      LYS  39  89.210  11.203  -5.142
  317    HE3  LYS  39           HE1      LYS  39  89.958  11.952  -6.553
  318    HZ1  LYS  39           HZ1      LYS  39  88.330  13.479  -6.723
  319    HZ2  LYS  39           HZ2      LYS  39  88.133  13.162  -5.065
  320    HZ3  LYS  39           HZ3      LYS  39  87.111  12.421  -6.202
  321    H    SER  40           HN       SER  40  88.663   7.575  -6.485
  322    HA   SER  40           HA       SER  40  90.419   6.332  -5.525
  323    HG   SER  40           HG       SER  40  90.353   6.195  -1.926
  324    HB2  SER  40           HB2      SER  40  89.960   7.876  -3.685
  325    HB3  SER  40           HB1      SER  40  88.662   6.838  -3.104
  326    H    LYS  41           HN       LYS  41  90.121   4.282  -6.502
  327    HA   LYS  41           HA       LYS  41  88.728   2.275  -4.774
  328    HB2  LYS  41           HB2      LYS  41  87.601   2.983  -7.045
  329    HB3  LYS  41           HB1      LYS  41  88.841   1.958  -7.763
  330    HG2  LYS  41           HG2      LYS  41  87.142   0.406  -7.417
  331    HG3  LYS  41           HG1      LYS  41  88.055   0.237  -5.917
  332    HD2  LYS  41           HD2      LYS  41  86.478   2.118  -5.030
  333    HD3  LYS  41           HD1      LYS  41  85.444   1.660  -6.384
  334    HE2  LYS  41           HE2      LYS  41  86.370  -0.083  -4.092
  335    HE3  LYS  41           HE1      LYS  41  84.715   0.343  -4.524
  336    HZ1  LYS  41           HZ1      LYS  41  84.838  -1.682  -5.500
  337    HZ2  LYS  41           HZ2      LYS  41  86.517  -1.602  -5.746
  338    HZ3  LYS  41           HZ3      LYS  41  85.463  -0.764  -6.782
  339    HA   PRO  42           HA       PRO  42  93.162   1.061  -5.411
  340    HB2  PRO  42           HB2      PRO  42  92.817  -0.053  -2.696
  341    HB3  PRO  42           HB1      PRO  42  94.030   1.095  -3.289
  342    HG2  PRO  42           HG2      PRO  42  92.042   1.806  -1.626
  343    HG3  PRO  42           HG1      PRO  42  92.731   2.910  -2.828
  344    HD2  PRO  42           HD2      PRO  42  90.132   1.414  -2.914
  345    HD3  PRO  42           HD1      PRO  42  90.516   3.045  -3.512
  346    HA   PRO  43           HA       PRO  43  92.312  -3.170  -6.382
  347    HB2  PRO  43           HB2      PRO  43  94.683  -4.426  -5.786
  348    HB3  PRO  43           HB1      PRO  43  94.454  -3.386  -7.205
  349    HG2  PRO  43           HG2      PRO  43  95.745  -2.768  -4.598
  350    HG3  PRO  43           HG1      PRO  43  96.203  -2.267  -6.235
  351    HD2  PRO  43           HD2      PRO  43  94.888  -0.618  -4.482
  352    HD3  PRO  43           HD1      PRO  43  94.727  -0.485  -6.248
  353    H    LYS  44           HN       LYS  44  91.029  -4.533  -5.227
  354    HA   LYS  44           HA       LYS  44  90.155  -5.742  -3.426
  355    HB2  LYS  44           HB2      LYS  44  92.450  -6.878  -4.003
  356    HB3  LYS  44           HB1      LYS  44  92.980  -6.184  -2.475
  357    HG2  LYS  44           HG2      LYS  44  90.454  -7.833  -2.717
  358    HG3  LYS  44           HG1      LYS  44  92.022  -8.548  -2.340
  359    HD2  LYS  44           HD2      LYS  44  91.550  -8.079  -0.179
  360    HD3  LYS  44           HD1      LYS  44  91.876  -6.396  -0.596
  361    HE2  LYS  44           HE2      LYS  44  89.715  -6.370   0.396
  362    HE3  LYS  44           HE1      LYS  44  89.420  -6.275  -1.340
  363    HZ1  LYS  44           HZ1      LYS  44  88.530  -8.220   0.461
  364    HZ2  LYS  44           HZ2      LYS  44  89.605  -8.972  -0.619
  365    HZ3  LYS  44           HZ3      LYS  44  88.252  -8.133  -1.211
  366    H    LYS  45           HN       LYS  45  93.071  -4.631  -1.712
  367    HA   LYS  45           HA       LYS  45  91.783  -3.920   0.665
  368    HB2  LYS  45           HB2      LYS  45  94.315  -3.973   0.098
  369    HB3  LYS  45           HB1      LYS  45  94.093  -2.296  -0.401
  370    HG2  LYS  45           HG2      LYS  45  93.041  -1.869   1.867
  371    HG3  LYS  45           HG1      LYS  45  93.577  -3.483   2.336
  372    HD2  LYS  45           HD2      LYS  45  95.403  -1.289   1.311
  373    HD3  LYS  45           HD1      LYS  45  95.198  -1.713   3.011
  374    HE2  LYS  45           HE2      LYS  45  95.811  -4.122   2.261
  375    HE3  LYS  45           HE1      LYS  45  96.432  -3.350   0.802
  376    HZ1  LYS  45           HZ1      LYS  45  97.204  -2.360   3.470
  377    HZ2  LYS  45           HZ2      LYS  45  98.017  -2.187   1.988
  378    HZ3  LYS  45           HZ3      LYS  45  98.005  -3.689   2.783
  379    H    GLY  46           HN       GLY  46  90.985  -1.905   1.486
  380    HA2  GLY  46           HA2      GLY  46  90.566   0.280  -0.480
  381    HA3  GLY  46           HA1      GLY  46  89.136  -0.439   0.261
  382    H    VAL  47           HN       VAL  47  91.210   2.104   0.543
  383    HA   VAL  47           HA       VAL  47  91.644   2.220   3.388
  384    HB   VAL  47           HB       VAL  47  91.895   4.736   2.880
  385   HG11  VAL  47          HG11      VAL  47  93.536   2.753   1.272
  386   HG12  VAL  47          HG12      VAL  47  93.782   3.122   2.979
  387   HG13  VAL  47          HG13      VAL  47  94.047   4.369   1.760
  388   HG21  VAL  47          HG21      VAL  47  91.793   3.749   0.021
  389   HG22  VAL  47          HG22      VAL  47  91.901   5.415   0.590
  390   HG23  VAL  47          HG23      VAL  47  90.405   4.505   0.804
  391    H    GLN  48           HN       GLN  48  90.196   5.126   2.649
  392    HA   GLN  48           HA       GLN  48  87.448   4.320   3.363
  393    HB2  GLN  48           HB2      GLN  48  89.149   6.092   5.146
  394    HB3  GLN  48           HB1      GLN  48  87.409   5.863   5.324
  395    HG2  GLN  48           HG2      GLN  48  87.893   3.358   5.470
  396    HG3  GLN  48           HG1      GLN  48  89.593   3.796   5.645
  397   HE21  GLN  48          HE21      GLN  48  88.673   2.528   7.835
  398   HE22  GLN  48          HE22      GLN  48  88.315   3.601   9.099
  399    H    GLY  49           HN       GLY  49  88.928   7.471   3.948
  400    HA2  GLY  49           HA2      GLY  49  88.757   9.486   2.731
  401    HA3  GLY  49           HA1      GLY  49  88.147   8.558   1.360
  402    H1U  RCY  50           H1U      RCY  50  80.894   7.073  -2.240
  403    H1S  RCY  50           H1S      RCY  50  80.941   9.721   1.588
  404    HB1  RCY  50           HB1      RCY  50  83.791   9.349   2.134
  405    HB2  RCY  50           HB2      RCY  50  84.446  10.455   0.927
  406    HA   RCY  50           HA       RCY  50  84.977  12.012   2.917
  407    HN1  RCY  50           HN1      RCY  50  87.055  11.068   2.362
  408    H    GLY  51           HN       GLY  51  86.452  10.075   4.857
  409    HA2  GLY  51           HA2      GLY  51  84.384   8.855   6.464
  410    HA3  GLY  51           HA1      GLY  51  86.047   9.144   6.979
  411    H    ASP  52           HN       ASP  52  84.939  12.041   5.864
  412    HA   ASP  52           HA       ASP  52  83.473  12.852   8.287
  413    HB2  ASP  52           HB2      ASP  52  85.908  12.964   8.907
  414    HB3  ASP  52           HB1      ASP  52  86.136  14.135   7.608
  415    H    ASP  53           HN       ASP  53  81.791  13.682   7.056
  416    HA   ASP  53           HA       ASP  53  82.174  16.242   5.784
  417    HB2  ASP  53           HB2      ASP  53  83.082  14.812   3.982
  418    HB3  ASP  53           HB1      ASP  53  81.577  13.892   3.959
  419    H    ILE  54           HN       ILE  54  79.834  14.788   3.971
  420    HA   ILE  54           HA       ILE  54  77.725  15.548   5.940
  421    HB   ILE  54           HB       ILE  54  78.025  16.680   3.574
  422   HG12  ILE  54          HG12      ILE  54  76.128  16.947   5.251
  423   HG13  ILE  54          HG11      ILE  54  75.676  17.191   3.564
  424   HG21  ILE  54          HG21      ILE  54  76.910  15.565   1.770
  425   HG22  ILE  54          HG22      ILE  54  76.306  14.299   2.839
  426   HG23  ILE  54          HG23      ILE  54  78.026  14.386   2.460
  427   HD11  ILE  54          HD11      ILE  54  74.839  14.883   3.437
  428   HD12  ILE  54          HD12      ILE  54  74.035  15.757   4.741
  429   HD13  ILE  54          HD13      ILE  54  75.319  14.607   5.112
  430    HA   PRO  55           HA       PRO  55  76.979  11.095   5.794
  431    HB2  PRO  55           HB2      PRO  55  75.312  10.939   7.923
  432    HB3  PRO  55           HB1      PRO  55  77.060  11.184   8.110
  433    HG2  PRO  55           HG2      PRO  55  74.852  13.170   8.287
  434    HG3  PRO  55           HG1      PRO  55  76.324  13.028   9.260
  435    HD2  PRO  55           HD2      PRO  55  76.011  14.815   7.161
  436    HD3  PRO  55           HD1      PRO  55  77.582  14.238   7.760
  437    H    GLY  56           HN       GLY  56  75.703  12.034   3.716
  438    HA2  GLY  56           HA2      GLY  56  73.791  11.323   2.470
  439    HA3  GLY  56           HA1      GLY  56  72.966  10.963   3.984
  440    H    MET  57           HN       MET  57  73.628  13.415   1.607
  441    HA   MET  57           HA       MET  57  72.684  15.732   2.942
  442    HB2  MET  57           HB2      MET  57  72.857  14.848   0.093
  443    HB3  MET  57           HB1      MET  57  71.837  16.241   0.447
  444    HG2  MET  57           HG2      MET  57  74.699  15.999   1.408
  445    HG3  MET  57           HG1      MET  57  74.249  16.804  -0.096
  446    HE1  MET  57           HE1      MET  57  74.872  20.002   1.651
  447    HE2  MET  57           HE2      MET  57  74.374  19.422   0.064
  448    HE3  MET  57           HE3      MET  57  75.664  18.593   0.933
  449    H    GLU  58           HN       GLU  58  71.028  12.898   2.556
  450    HA   GLU  58           HA       GLU  58  68.395  14.320   2.684
  451    HB2  GLU  58           HB2      GLU  58  68.773  13.102   0.501
  452    HB3  GLU  58           HB1      GLU  58  68.856  11.603   1.426
  453    HG2  GLU  58           HG2      GLU  58  66.591  12.060   2.335
  454    HG3  GLU  58           HG1      GLU  58  66.505  13.517   1.344
  455    H    GLY  59           HN       GLY  59  70.328  11.510   3.653
  456    HA2  GLY  59           HA2      GLY  59  70.286  10.541   5.847
  457    HA3  GLY  59           HA1      GLY  59  68.765  11.380   6.162
  458    H1U  RCY  60           H1U      RCY  60  68.206   7.107  -2.050
  459    H1S  RCY  60           H1S      RCY  60  70.051   8.803   2.122
  460    HB1  RCY  60           HB1      RCY  60  68.017   6.110   3.128
  461    HB2  RCY  60           HB2      RCY  60  67.952   6.649   4.807
  462    HA   RCY  60           HA       RCY  60  67.383   8.182   2.295
  463    HN1  RCY  60           HN1      RCY  60  68.512  10.058   3.138
  464    H    GLY  61           HN       GLY  61  65.952   6.209   3.914
  465    HA2  GLY  61           HA2      GLY  61  63.626   7.902   4.615
  466    HA3  GLY  61           HA1      GLY  61  63.598   6.151   4.397
  467    H    THR  62           HN       THR  62  64.318   4.807   6.142
  468    HA   THR  62           HA       THR  62  64.967   6.146   8.708
  469    HB   THR  62           HB       THR  62  63.146   5.269   9.907
  470    HG1  THR  62           HG1      THR  62  62.212   3.724   7.779
  471   HG21  THR  62          HG21      THR  62  62.009   5.821   7.152
  472   HG22  THR  62          HG22      THR  62  62.460   7.063   8.320
  473   HG23  THR  62          HG23      THR  62  61.145   5.945   8.684
  474    H    ASP  63           HN       ASP  63  63.993   2.878   7.587
  475    HA   ASP  63           HA       ASP  63  65.882   1.521   9.252
  476    HB2  ASP  63           HB2      ASP  63  65.472  -0.419   7.703
  477    HB3  ASP  63           HB1      ASP  63  63.992   0.311   8.326
  478    H    ILE  64           HN       ILE  64  66.523   3.616   6.826
  479    HA   ILE  64           HA       ILE  64  69.134   2.294   6.214
  480    HB   ILE  64           HB       ILE  64  67.562   3.967   4.231
  481   HG12  ILE  64          HG12      ILE  64  67.834   0.949   4.254
  482   HG13  ILE  64          HG11      ILE  64  66.417   1.790   4.883
  483   HG21  ILE  64          HG21      ILE  64  69.807   3.985   3.571
  484   HG22  ILE  64          HG22      ILE  64  69.184   2.582   2.703
  485   HG23  ILE  64          HG23      ILE  64  70.104   2.361   4.191
  486   HD11  ILE  64          HD11      ILE  64  65.981   1.154   2.577
  487   HD12  ILE  64          HD12      ILE  64  67.481   1.914   2.047
  488   HD13  ILE  64          HD13      ILE  64  66.157   2.907   2.656
  489    H    THR  65           HN       THR  65  68.535   4.256   8.256
  490    HA   THR  65           HA       THR  65  69.354   6.864   7.245
  491    HB   THR  65           HB       THR  65  69.474   6.089  10.152
  492    HG1  THR  65           HG1      THR  65  67.368   5.743   8.547
  493   HG21  THR  65          HG21      THR  65  68.981   8.353  10.521
  494   HG22  THR  65          HG22      THR  65  68.261   8.554   8.923
  495   HG23  THR  65          HG23      THR  65  70.011   8.409   9.090
  496    H    VAL  66           HN       VAL  66  71.339   6.029   6.189
  497    HA   VAL  66           HA       VAL  66  73.683   5.946   6.151
  498    HB   VAL  66           HB       VAL  66  73.841   6.344   9.120
  499   HG11  VAL  66          HG11      VAL  66  75.768   7.629   8.549
  500   HG12  VAL  66          HG12      VAL  66  75.261   7.777   6.866
  501   HG13  VAL  66          HG13      VAL  66  75.813   6.221   7.487
  502   HG21  VAL  66          HG21      VAL  66  72.279   8.009   8.940
  503   HG22  VAL  66          HG22      VAL  66  72.462   8.127   7.190
  504   HG23  VAL  66          HG23      VAL  66  73.629   8.912   8.253
  505    H    ILE  67           HN       ILE  67  71.756   4.064   8.290
  506    HA   ILE  67           HA       ILE  67  73.795   1.885   8.166
  507    HB   ILE  67           HB       ILE  67  72.103   2.551  10.595
  508   HG12  ILE  67          HG12      ILE  67  75.100   2.817  10.199
  509   HG13  ILE  67          HG11      ILE  67  73.971   4.171  10.139
  510   HG21  ILE  67          HG21      ILE  67  74.276   0.489  10.108
  511   HG22  ILE  67          HG22      ILE  67  72.561   0.155  10.351
  512   HG23  ILE  67          HG23      ILE  67  73.526   0.816  11.671
  513   HD11  ILE  67          HD11      ILE  67  74.933   4.027  12.378
  514   HD12  ILE  67          HD12      ILE  67  74.451   2.336  12.505
  515   HD13  ILE  67          HD13      ILE  67  73.223   3.601  12.451
  516    H1U  RCY  68           H1U      RCY  68  71.208  -2.389  -1.501
  517    H1S  RCY  68           H1S      RCY  68  71.120  -0.788   2.867
  518    HB1  RCY  68           HB1      RCY  68  71.653   0.071   4.906
  519    HB2  RCY  68           HB2      RCY  68  69.899   0.196   4.993
  520    HA   RCY  68           HA       RCY  68  69.895  -0.081   7.245
  521    HN1  RCY  68           HN1      RCY  68  72.824   0.398   6.885
  522    HA   PRO  69           HA       PRO  69  70.528  -4.069   8.975
  523    HB2  PRO  69           HB2      PRO  69  68.889  -5.612   7.266
  524    HB3  PRO  69           HB1      PRO  69  68.378  -4.792   8.752
  525    HG2  PRO  69           HG2      PRO  69  68.075  -3.950   5.933
  526    HG3  PRO  69           HG1      PRO  69  67.022  -3.654   7.326
  527    HD2  PRO  69           HD2      PRO  69  68.607  -1.709   6.298
  528    HD3  PRO  69           HD1      PRO  69  68.257  -1.809   8.040
  529    H    TRP  70           HN       TRP  70  70.625  -4.028   5.410
  530    HA   TRP  70           HA       TRP  70  72.281  -6.417   5.264
  531    HD1  TRP  70           HD1      TRP  70  69.966  -6.667   5.244
  532    HE1  TRP  70           HE1      TRP  70  67.518  -6.658   4.439
  533    HE3  TRP  70           HE3      TRP  70  70.482  -4.048   0.891
  534    HZ2  TRP  70           HZ2      TRP  70  65.979  -5.668   2.235
  535    HZ3  TRP  70           HZ3      TRP  70  68.515  -3.587  -0.538
  536    HH2  TRP  70           HH2      TRP  70  66.266  -4.391   0.124
  537    HB2  TRP  70           HB2      TRP  70  72.008  -4.340   3.090
  538    HB3  TRP  70           HB1      TRP  70  72.290  -6.071   2.919
  539    H    GLU  71           HN       GLU  71  73.051  -3.590   6.590
  540    HA   GLU  71           HA       GLU  71  75.906  -3.935   6.020
  541    HB2  GLU  71           HB2      GLU  71  76.136  -1.462   5.410
  542    HB3  GLU  71           HB1      GLU  71  75.446  -2.503   4.165
  543    HG2  GLU  71           HG2      GLU  71  73.246  -1.734   4.578
  544    HG3  GLU  71           HG1      GLU  71  73.691  -1.041   6.138
  545    H    ALA  72           HN       ALA  72  75.215  -4.416   8.422
  546    HA   ALA  72           HA       ALA  72  74.735  -2.094  10.108
  547    HB1  ALA  72           HB1      ALA  72  75.898  -4.644  11.182
  548    HB2  ALA  72           HB2      ALA  72  74.256  -4.663  10.542
  549    HB3  ALA  72           HB3      ALA  72  74.666  -3.596  11.884
  550    H1U  RCY  73           H1U      RCY  73  80.767  -1.569   6.244
  551    H1S  RCY  73           H1S      RCY  73  81.235   0.766   9.631
  552    HB1  RCY  73           HB1      RCY  73  78.286   0.442  12.902
  553    HB2  RCY  73           HB2      RCY  73  77.475   0.938  11.418
  554    HA   RCY  73           HA       RCY  73  78.992  -1.016  10.390
  555    HN1  RCY  73           HN1      RCY  73  76.264  -1.037  11.449
  556    H    ASN  74           HN       ASN  74  78.653  -3.545  11.334
  557    HA   ASN  74           HA       ASN  74  80.622  -3.646  13.496
  558    HB2  ASN  74           HB2      ASN  74  77.753  -4.484  13.945
  559    HB3  ASN  74           HB1      ASN  74  79.080  -5.134  14.908
  560   HD21  ASN  74          HD21      ASN  74  80.696  -3.066  15.509
  561   HD22  ASN  74          HD22      ASN  74  79.859  -1.788  16.250
  562    H    HIS  75           HN       HIS  75  80.269  -4.653  10.695
  563    HA   HIS  75           HA       HIS  75  81.350  -7.292  11.133
  564    HD1  HIS  75           HD1      HIS  75  79.387  -6.640   7.914
  565    HD2  HIS  75           HD2      HIS  75  76.435  -6.866  10.852
  566    HE1  HIS  75           HE1      HIS  75  77.307  -5.589   6.920
  567    HE2  HIS  75           HE2      HIS  75  75.503  -5.720   8.699
  568    HB2  HIS  75           HB2      HIS  75  79.566  -8.620  10.113
  569    HB3  HIS  75           HB1      HIS  75  78.946  -7.783  11.536
  570    H1U  RCY  76           H1U      RCY  76  80.958  -3.479   1.412
  571    H1S  RCY  76           H1S      RCY  76  80.300  -1.062   5.314
  572    HB1  RCY  76           HB1      RCY  76  79.289  -4.441   6.781
  573    HB2  RCY  76           HB2      RCY  76  80.413  -4.228   5.445
  574    HA   RCY  76           HA       RCY  76  81.325  -6.043   6.641
  575    HN1  RCY  76           HN1      RCY  76  80.323  -4.713   9.084
  576    H    GLU  77           HN       GLU  77  82.292  -3.562   8.953
  577    HA   GLU  77           HA       GLU  77  84.562  -2.631   7.406
  578    HB2  GLU  77           HB2      GLU  77  85.255  -1.544   9.512
  579    HB3  GLU  77           HB1      GLU  77  83.545  -1.254   9.189
  580    HG2  GLU  77           HG2      GLU  77  83.070  -3.301  10.650
  581    HG3  GLU  77           HG1      GLU  77  84.758  -3.206  11.154
  582    H    LEU  78           HN       LEU  78  84.036  -5.615   8.450
  583    HA   LEU  78           HA       LEU  78  86.929  -6.141   8.835
  584    HG   LEU  78           HG       LEU  78  87.020  -7.642  12.067
  585    HB2  LEU  78           HB2      LEU  78  85.295  -6.031  11.032
  586    HB3  LEU  78           HB1      LEU  78  85.146  -7.730  10.604
  587   HD11  LEU  78          HD11      LEU  78  88.673  -8.583  10.737
  588   HD12  LEU  78          HD12      LEU  78  88.486  -7.372   9.468
  589   HD13  LEU  78          HD13      LEU  78  87.298  -8.665   9.635
  590   HD21  LEU  78          HD21      LEU  78  88.940  -5.974  11.345
  591   HD22  LEU  78          HD22      LEU  78  87.583  -5.393  12.310
  592   HD23  LEU  78          HD23      LEU  78  87.613  -5.108  10.570
  593    H    HIS  79           HN       HIS  79  86.957  -7.139   6.786
  594    HA   HIS  79           HA       HIS  79  86.377  -9.890   6.625
  595    HD1  HIS  79           HD1      HIS  79  82.317  -9.005   7.485
  596    HD2  HIS  79           HD2      HIS  79  85.054 -11.979   6.451
  597    HE1  HIS  79           HE1      HIS  79  81.628 -11.085   8.756
  598    HE2  HIS  79           HE2      HIS  79  83.286 -12.902   8.136
  599    HB2  HIS  79           HB2      HIS  79  84.088  -8.126   5.971
  600    HB3  HIS  79           HB1      HIS  79  84.440  -9.352   4.755
  601    H    GLU  80           HN       GLU  80  86.806 -10.742   4.438
  602    HA   GLU  80           HA       GLU  80  88.704  -9.038   3.008
  603    HB2  GLU  80           HB2      GLU  80  87.725 -11.873   2.592
  604    HB3  GLU  80           HB1      GLU  80  88.875 -11.093   1.505
  605    HG2  GLU  80           HG2      GLU  80  89.317 -11.256   4.493
  606    HG3  GLU  80           HG1      GLU  80  89.900 -12.492   3.378
  607    H    LEU  81           HN       LEU  81  87.204 -10.965   0.732
  608    HA   LEU  81           HA       LEU  81  85.909  -8.592  -0.471
  609    HG   LEU  81           HG       LEU  81  84.906 -11.880  -1.654
  610    HB2  LEU  81           HB2      LEU  81  85.908  -9.793  -2.519
  611    HB3  LEU  81           HB1      LEU  81  87.438 -10.209  -1.754
  612   HD11  LEU  81          HD11      LEU  81  87.513 -12.165  -3.170
  613   HD12  LEU  81          HD12      LEU  81  85.888 -12.042  -3.844
  614   HD13  LEU  81          HD13      LEU  81  86.368 -13.491  -2.961
  615   HD21  LEU  81          HD21      LEU  81  87.646 -12.167  -0.415
  616   HD22  LEU  81          HD22      LEU  81  86.614 -13.569  -0.700
  617   HD23  LEU  81          HD23      LEU  81  86.072 -12.278   0.373
  618    H    ALA  82           HN       ALA  82  85.016 -11.079   1.563
  619    HA   ALA  82           HA       ALA  82  82.479 -11.871   0.517
  620    HB1  ALA  82           HB1      ALA  82  81.970 -12.590   2.790
  621    HB2  ALA  82           HB2      ALA  82  83.275 -11.591   3.430
  622    HB3  ALA  82           HB3      ALA  82  83.648 -12.990   2.423
  623    H    GLN  83           HN       GLN  83  81.555 -10.754   3.437
  624    HA   GLN  83           HA       GLN  83  79.685  -9.281   3.753
  625    HB2  GLN  83           HB2      GLN  83  80.681  -6.943   4.032
  626    HB3  GLN  83           HB1      GLN  83  81.427  -8.229   4.975
  627    HG2  GLN  83           HG2      GLN  83  83.243  -7.014   4.005
  628    HG3  GLN  83           HG1      GLN  83  83.092  -8.486   3.045
  629   HE21  GLN  83          HE21      GLN  83  83.469  -7.916   0.895
  630   HE22  GLN  83          HE22      GLN  83  82.794  -6.567   0.117
  631    H    TYR  84           HN       TYR  84  79.474 -10.002   1.089
  632    HA   TYR  84           HA       TYR  84  78.447  -7.475  -0.050
  633    HD1  TYR  84           HD2      TYR  84  79.290 -10.718  -0.283
  634    HD2  TYR  84           HD1      TYR  84  81.964  -8.859  -3.083
  635    HE1  TYR  84           HE2      TYR  84  80.313 -12.924  -0.770
  636    HE2  TYR  84           HE1      TYR  84  82.987 -11.065  -3.571
  637    HH   TYR  84           HH       TYR  84  82.541 -13.375  -3.398
  638    HB2  TYR  84           HB2      TYR  84  79.490  -7.898  -2.248
  639    HB3  TYR  84           HB1      TYR  84  80.694  -7.617  -1.000
  640    H    GLY  85           HN       GLY  85  78.668  -9.684  -2.506
  641    HA2  GLY  85           HA2      GLY  85  76.901 -11.748  -2.125
  642    HA3  GLY  85           HA1      GLY  85  75.827 -10.356  -2.279
  643    H    ILE  86           HN       ILE  86  78.694 -11.718  -3.930
  644    HA   ILE  86           HA       ILE  86  79.287 -11.555  -6.212
  645    HB   ILE  86           HB       ILE  86  77.672 -12.745  -7.650
  646   HG12  ILE  86          HG12      ILE  86  75.814 -12.718  -5.259
  647   HG13  ILE  86          HG11      ILE  86  75.666 -11.572  -6.592
  648   HG21  ILE  86          HG21      ILE  86  77.884 -13.882  -4.844
  649   HG22  ILE  86          HG22      ILE  86  79.093 -14.048  -6.118
  650   HG23  ILE  86          HG23      ILE  86  77.513 -14.812  -6.296
  651   HD11  ILE  86          HD11      ILE  86  75.595 -14.592  -6.867
  652   HD12  ILE  86          HD12      ILE  86  75.412 -13.431  -8.182
  653   HD13  ILE  86          HD13      ILE  86  74.187 -13.532  -6.918
  654    H1U  RCY  87           H1U      RCY  87  77.576  -1.476  -3.861
  655    H1S  RCY  87           H1S      RCY  87  76.349  -5.314  -4.274
  656    HB1  RCY  87           HB1      RCY  87  77.265  -5.752  -6.023
  657    HB2  RCY  87           HB2      RCY  87  78.937  -6.315  -6.011
  658    HA   RCY  87           HA       RCY  87  76.452  -7.788  -6.852
  659    HN1  RCY  87           HN1      RCY  87  78.496  -9.028  -5.286
  Start of MODEL   34
    1    HA   MET   1           HA       MET   1  69.203   2.852  23.087
    2    HB2  MET   1           HB2      MET   1  68.785   5.044  24.322
    3    HB3  MET   1           HB1      MET   1  67.138   4.473  24.593
    4    HG2  MET   1           HG2      MET   1  68.364   3.817  26.532
    5    HG3  MET   1           HG1      MET   1  68.187   2.351  25.568
    6    HE1  MET   1           HE1      MET   1  70.081   5.414  26.269
    7    HE2  MET   1           HE2      MET   1  71.798   5.058  26.099
    8    HE3  MET   1           HE3      MET   1  70.914   4.454  27.498
    9    H    ASN   2           HN       ASN   2  65.723   3.636  23.457
   10    HA   ASN   2           HA       ASN   2  64.957   0.983  24.154
   11    HB2  ASN   2           HB2      ASN   2  62.649   1.737  23.488
   12    HB3  ASN   2           HB1      ASN   2  63.463   2.839  24.599
   13   HD21  ASN   2          HD21      ASN   2  61.721   2.777  21.721
   14   HD22  ASN   2          HD22      ASN   2  62.249   4.251  21.064
   15    H    LEU   3           HN       LEU   3  63.194  -0.147  22.609
   16    HA   LEU   3           HA       LEU   3  63.951  -0.046  19.770
   17    HG   LEU   3           HG       LEU   3  65.625  -3.193  19.196
   18    HB2  LEU   3           HB2      LEU   3  65.565  -1.614  21.158
   19    HB3  LEU   3           HB1      LEU   3  64.205  -2.730  21.105
   20   HD11  LEU   3          HD11      LEU   3  63.331  -1.541  18.125
   21   HD12  LEU   3          HD12      LEU   3  63.072  -3.085  18.937
   22   HD13  LEU   3          HD13      LEU   3  64.016  -3.019  17.449
   23   HD21  LEU   3          HD21      LEU   3  65.219  -0.489  18.011
   24   HD22  LEU   3          HD22      LEU   3  66.593  -1.586  17.864
   25   HD23  LEU   3          HD23      LEU   3  66.393  -0.614  19.322
   26    H    GLU   4           HN       GLU   4  61.724   0.440  19.456
   27    HA   GLU   4           HA       GLU   4  59.755  -1.611  20.324
   28    HB2  GLU   4           HB2      GLU   4  59.396   1.123  19.059
   29    HB3  GLU   4           HB1      GLU   4  58.072   0.054  19.522
   30    HG2  GLU   4           HG2      GLU   4  60.199   0.949  21.478
   31    HG3  GLU   4           HG1      GLU   4  58.697   1.841  21.233
   32    HA   PRO   5           HA       PRO   5  59.685  -3.398  16.263
   33    HB2  PRO   5           HB2      PRO   5  57.145  -4.418  16.215
   34    HB3  PRO   5           HB1      PRO   5  58.463  -5.134  17.163
   35    HG2  PRO   5           HG2      PRO   5  56.254  -3.349  18.058
   36    HG3  PRO   5           HG1      PRO   5  56.954  -4.768  18.856
   37    HD2  PRO   5           HD2      PRO   5  57.590  -2.206  19.574
   38    HD3  PRO   5           HD1      PRO   5  58.725  -3.564  19.743
   39    HA   PRO   6           HA       PRO   6  57.522  -0.002  14.118
   40    HB2  PRO   6           HB2      PRO   6  59.099   0.093  11.927
   41    HB3  PRO   6           HB1      PRO   6  59.640   0.730  13.493
   42    HG2  PRO   6           HG2      PRO   6  60.339  -1.833  12.160
   43    HG3  PRO   6           HG1      PRO   6  61.352  -0.748  13.125
   44    HD2  PRO   6           HD2      PRO   6  60.173  -3.091  14.078
   45    HD3  PRO   6           HD1      PRO   6  60.754  -1.757  15.098
   46    H    LYS   7           HN       LYS   7  56.350   0.149  12.009
   47    HA   LYS   7           HA       LYS   7  54.955  -2.261  11.359
   48    HB2  LYS   7           HB2      LYS   7  54.544  -0.659   9.160
   49    HB3  LYS   7           HB1      LYS   7  53.637  -0.527  10.667
   50    HG2  LYS   7           HG2      LYS   7  55.029   1.232  11.471
   51    HG3  LYS   7           HG1      LYS   7  56.243   0.940  10.224
   52    HD2  LYS   7           HD2      LYS   7  54.858   1.818   8.512
   53    HD3  LYS   7           HD1      LYS   7  53.415   1.731   9.522
   54    HE2  LYS   7           HE2      LYS   7  55.741   3.440  10.367
   55    HE3  LYS   7           HE1      LYS   7  54.580   4.048   9.187
   56    HZ1  LYS   7           HZ1      LYS   7  54.151   3.315  12.005
   57    HZ2  LYS   7           HZ2      LYS   7  52.856   3.240  10.908
   58    HZ3  LYS   7           HZ3      LYS   7  53.663   4.711  11.174
   59    H    ALA   8           HN       ALA   8  54.966  -3.317   9.169
   60    HA   ALA   8           HA       ALA   8  57.480  -3.046   7.637
   61    HB1  ALA   8           HB1      ALA   8  58.158  -4.646   9.319
   62    HB2  ALA   8           HB2      ALA   8  57.897  -5.527   7.813
   63    HB3  ALA   8           HB3      ALA   8  56.682  -5.583   9.091
   64    H    GLU   9           HN       GLU   9  54.576  -5.093   8.066
   65    HA   GLU   9           HA       GLU   9  53.474  -6.324   6.308
   66    HB2  GLU   9           HB2      GLU   9  52.231  -4.384   4.965
   67    HB3  GLU   9           HB1      GLU   9  51.859  -4.709   6.656
   68    HG2  GLU   9           HG2      GLU   9  52.198  -2.330   6.446
   69    HG3  GLU   9           HG1      GLU   9  53.607  -2.987   7.279
   70    H1U  RCY  10           H1U      RCY  10  59.684   0.160   3.434
   71    H1S  RCY  10           H1S      RCY  10  59.816  -3.967   0.874
   72    HB1  RCY  10           HB1      RCY  10  58.076  -5.362   4.227
   73    HB2  RCY  10           HB2      RCY  10  57.088  -4.255   3.274
   74    HA   RCY  10           HA       RCY  10  55.682  -6.067   2.506
   75    HN1  RCY  10           HN1      RCY  10  55.898  -6.675   5.398
   76    H    ARG  11           HN       ARG  11  55.110  -8.500   3.281
   77    HA   ARG  11           HA       ARG  11  57.531 -10.166   3.523
   78    HE   ARG  11           HE       ARG  11  56.214 -13.525   6.819
   79    HB2  ARG  11           HB2      ARG  11  55.179 -10.558   4.636
   80    HB3  ARG  11           HB1      ARG  11  54.759 -11.256   3.074
   81    HG2  ARG  11           HG2      ARG  11  55.564 -13.114   4.268
   82    HG3  ARG  11           HG1      ARG  11  56.977 -12.603   3.345
   83    HD2  ARG  11           HD2      ARG  11  57.986 -12.682   5.399
   84    HD3  ARG  11           HD1      ARG  11  57.296 -11.066   5.548
   85   HH11  ARG  11          HH21      ARG  11  56.143 -10.135   6.192
   86   HH12  ARG  11          HH22      ARG  11  55.062  -9.781   7.497
   87   HH21  ARG  11          HH11      ARG  11  54.802 -13.082   8.528
   88   HH22  ARG  11          HH12      ARG  11  54.302 -11.449   8.820
   89    H    SER  12           HN       SER  12  58.186 -11.677   1.906
   90    HA   SER  12           HA       SER  12  56.813 -11.568  -0.719
   91    HG   SER  12           HG       SER  12  59.755 -10.978  -2.539
   92    HB2  SER  12           HB2      SER  12  58.521  -9.727  -0.705
   93    HB3  SER  12           HB1      SER  12  59.766 -10.940  -0.420
   94    H    ALA  13           HN       ALA  13  57.682 -13.498   1.572
   95    HA   ALA  13           HA       ALA  13  58.366 -15.738   1.704
   96    HB1  ALA  13           HB1      ALA  13  58.096 -15.840  -1.301
   97    HB2  ALA  13           HB2      ALA  13  56.676 -15.760  -0.258
   98    HB3  ALA  13           HB3      ALA  13  57.791 -17.121  -0.127
   99    H    THR  14           HN       THR  14  60.503 -14.201   1.912
  100    HA   THR  14           HA       THR  14  62.528 -15.496   0.132
  101    HB   THR  14           HB       THR  14  63.810 -13.353   0.178
  102    HG1  THR  14           HG1      THR  14  62.976 -11.617   1.127
  103   HG21  THR  14          HG21      THR  14  62.441 -12.205  -1.471
  104   HG22  THR  14          HG22      THR  14  60.995 -13.035  -0.897
  105   HG23  THR  14          HG23      THR  14  62.272 -13.945  -1.703
  106    H    ARG  15           HN       ARG  15  63.987 -16.589   1.348
  107    HA   ARG  15           HA       ARG  15  64.770 -15.499   3.997
  108    HE   ARG  15           HE       ARG  15  63.735 -14.944   5.332
  109    HB2  ARG  15           HB2      ARG  15  62.829 -17.261   4.112
  110    HB3  ARG  15           HB1      ARG  15  64.102 -18.428   3.760
  111    HG2  ARG  15           HG2      ARG  15  64.450 -18.434   6.007
  112    HG3  ARG  15           HG1      ARG  15  65.267 -16.895   5.729
  113    HD2  ARG  15           HD2      ARG  15  62.328 -17.233   6.400
  114    HD3  ARG  15           HD1      ARG  15  63.578 -16.681   7.515
  115   HH11  ARG  15          HH21      ARG  15  61.366 -16.009   7.600
  116   HH12  ARG  15          HH22      ARG  15  60.489 -14.515   7.587
  117   HH21  ARG  15          HH11      ARG  15  62.603 -12.987   5.302
  118   HH22  ARG  15          HH12      ARG  15  61.190 -12.805   6.286
  119    H    VAL  16           HN       VAL  16  65.798 -16.372   1.104
  120    HA   VAL  16           HA       VAL  16  68.464 -17.091   2.079
  121    HB   VAL  16           HB       VAL  16  67.388 -19.303   2.008
  122   HG11  VAL  16          HG11      VAL  16  66.929 -18.760  -0.938
  123   HG12  VAL  16          HG12      VAL  16  65.669 -18.610   0.287
  124   HG13  VAL  16          HG13      VAL  16  66.418 -20.177  -0.021
  125   HG21  VAL  16          HG21      VAL  16  69.162 -19.026  -0.428
  126   HG22  VAL  16          HG22      VAL  16  69.035 -20.401   0.670
  127   HG23  VAL  16          HG23      VAL  16  69.793 -18.904   1.214
  128    H    MET  17           HN       MET  17  66.246 -16.301  -0.505
  129    HA   MET  17           HA       MET  17  66.602 -15.304  -2.599
  130    HB2  MET  17           HB2      MET  17  69.116 -14.341  -1.196
  131    HB3  MET  17           HB1      MET  17  68.453 -13.667  -2.685
  132    HG2  MET  17           HG2      MET  17  66.493 -12.882  -1.575
  133    HG3  MET  17           HG1      MET  17  66.840 -13.837  -0.134
  134    HE1  MET  17           HE1      MET  17  68.790  -9.979  -1.591
  135    HE2  MET  17           HE2      MET  17  67.587 -10.993  -2.384
  136    HE3  MET  17           HE3      MET  17  69.277 -11.493  -2.364
  137    H    GLY  18           HN       GLY  18  68.225 -15.231  -4.487
  138    HA2  GLY  18           HA2      GLY  18  70.558 -16.500  -4.903
  139    HA3  GLY  18           HA1      GLY  18  69.501 -17.892  -4.664
  140    H    GLY  19           HN       GLY  19  69.652 -18.630  -6.821
  141    HA2  GLY  19           HA2      GLY  19  68.799 -18.797  -9.011
  142    HA3  GLY  19           HA1      GLY  19  67.829 -17.358  -8.691
  143    HA   PRO  20           HA       PRO  20  72.302 -16.764 -10.926
  144    HB2  PRO  20           HB2      PRO  20  70.546 -17.114 -13.336
  145    HB3  PRO  20           HB1      PRO  20  72.273 -17.475 -13.140
  146    HG2  PRO  20           HG2      PRO  20  70.416 -19.396 -13.073
  147    HG3  PRO  20           HG1      PRO  20  71.870 -19.464 -12.066
  148    HD2  PRO  20           HD2      PRO  20  69.061 -18.965 -11.257
  149    HD3  PRO  20           HD1      PRO  20  70.425 -19.563 -10.287
  150    H1U  RCY  21           H1U      RCY  21  73.228  -4.968 -10.788
  151    H1S  RCY  21           H1S      RCY  21  72.144  -9.488  -9.399
  152    HB1  RCY  21           HB1      RCY  21  72.896 -11.906 -10.920
  153    HB2  RCY  21           HB2      RCY  21  71.637 -12.731 -10.000
  154    HA   RCY  21           HA       RCY  21  70.422 -12.890 -12.321
  155    HN1  RCY  21           HN1      RCY  21  72.756 -14.708 -11.954
  156    H    THR  22           HN       THR  22  70.613 -12.288 -14.426
  157    HA   THR  22           HA       THR  22  73.308 -12.013 -15.630
  158    HB   THR  22           HB       THR  22  71.928 -11.650 -17.746
  159    HG1  THR  22           HG1      THR  22  70.021 -11.053 -16.573
  160   HG21  THR  22          HG21      THR  22  71.251 -14.074 -17.846
  161   HG22  THR  22          HG22      THR  22  71.642 -14.196 -16.130
  162   HG23  THR  22          HG23      THR  22  72.907 -13.814 -17.298
  163    HA   PRO  23           HA       PRO  23  73.107  -7.606 -14.516
  164    HB2  PRO  23           HB2      PRO  23  75.201  -7.570 -16.661
  165    HB3  PRO  23           HB1      PRO  23  75.217  -6.809 -15.058
  166    HG2  PRO  23           HG2      PRO  23  76.582  -9.042 -15.552
  167    HG3  PRO  23           HG1      PRO  23  75.791  -8.766 -13.991
  168    HD2  PRO  23           HD2      PRO  23  75.011 -10.621 -16.189
  169    HD3  PRO  23           HD1      PRO  23  74.706 -10.747 -14.442
  170    H    ARG  24           HN       ARG  24  72.092  -5.829 -15.466
  171    HA   ARG  24           HA       ARG  24  71.470  -5.981 -18.389
  172    HE   ARG  24           HE       ARG  24  67.830  -6.557 -18.806
  173    HB2  ARG  24           HB2      ARG  24  69.502  -5.061 -16.274
  174    HB3  ARG  24           HB1      ARG  24  69.187  -5.319 -17.988
  175    HG2  ARG  24           HG2      ARG  24  70.143  -7.554 -16.193
  176    HG3  ARG  24           HG1      ARG  24  68.429  -7.185 -16.386
  177    HD2  ARG  24           HD2      ARG  24  70.373  -7.933 -18.591
  178    HD3  ARG  24           HD1      ARG  24  69.046  -8.921 -17.980
  179   HH11  ARG  24          HH21      ARG  24  69.899  -8.957 -20.164
  180   HH12  ARG  24          HH22      ARG  24  69.277  -8.775 -21.770
  181   HH21  ARG  24          HH11      ARG  24  67.006  -6.305 -20.896
  182   HH22  ARG  24          HH12      ARG  24  67.639  -7.273 -22.184
  183    H    LYS  25           HN       LYS  25  69.742  -3.491 -17.221
  184    HA   LYS  25           HA       LYS  25  72.002  -1.558 -17.086
  185    HB2  LYS  25           HB2      LYS  25  69.655  -1.364 -19.004
  186    HB3  LYS  25           HB1      LYS  25  70.824  -0.077 -18.713
  187    HG2  LYS  25           HG2      LYS  25  71.870  -1.049 -20.513
  188    HG3  LYS  25           HG1      LYS  25  72.534  -2.091 -19.254
  189    HD2  LYS  25           HD2      LYS  25  71.713  -3.679 -20.740
  190    HD3  LYS  25           HD1      LYS  25  70.324  -3.479 -19.672
  191    HE2  LYS  25           HE2      LYS  25  69.466  -1.717 -21.275
  192    HE3  LYS  25           HE1      LYS  25  70.752  -2.197 -22.382
  193    HZ1  LYS  25           HZ1      LYS  25  68.435  -3.297 -22.562
  194    HZ2  LYS  25           HZ2      LYS  25  68.963  -4.238 -21.250
  195    HZ3  LYS  25           HZ3      LYS  25  69.826  -4.257 -22.713
  196    H    GLY  26           HN       GLY  26  68.436  -1.375 -17.368
  197    HA2  GLY  26           HA2      GLY  26  66.869  -0.687 -15.731
  198    HA3  GLY  26           HA1      GLY  26  68.190  -0.542 -14.572
  199    HA   PRO  27           HA       PRO  27  66.381   3.643 -16.272
  200    HB2  PRO  27           HB2      PRO  27  66.447   3.962 -13.291
  201    HB3  PRO  27           HB1      PRO  27  65.280   4.602 -14.465
  202    HG2  PRO  27           HG2      PRO  27  64.730   2.472 -12.952
  203    HG3  PRO  27           HG1      PRO  27  64.138   2.620 -14.614
  204    HD2  PRO  27           HD2      PRO  27  66.238   0.828 -13.532
  205    HD3  PRO  27           HD1      PRO  27  65.248   0.651 -14.997
  206    HA   PRO  28           HA       PRO  28  70.685   5.020 -16.292
  207    HB2  PRO  28           HB2      PRO  28  69.304   7.676 -16.490
  208    HB3  PRO  28           HB1      PRO  28  70.652   7.034 -17.450
  209    HG2  PRO  28           HG2      PRO  28  68.158   7.105 -18.400
  210    HG3  PRO  28           HG1      PRO  28  69.274   5.788 -18.798
  211    HD2  PRO  28           HD2      PRO  28  66.887   5.748 -17.032
  212    HD3  PRO  28           HD1      PRO  28  67.672   4.410 -17.899
  213    H    LYS  29           HN       LYS  29  72.060   6.503 -14.959
  214    HA   LYS  29           HA       LYS  29  71.071   6.604 -12.191
  215    HB2  LYS  29           HB2      LYS  29  73.742   7.484 -13.330
  216    HB3  LYS  29           HB1      LYS  29  73.362   7.250 -11.624
  217    HG2  LYS  29           HG2      LYS  29  72.704   4.838 -12.316
  218    HG3  LYS  29           HG1      LYS  29  73.608   5.172 -13.794
  219    HD2  LYS  29           HD2      LYS  29  74.660   5.281 -10.954
  220    HD3  LYS  29           HD1      LYS  29  75.121   4.134 -12.213
  221    HE2  LYS  29           HE2      LYS  29  75.871   6.155 -13.586
  222    HE3  LYS  29           HE1      LYS  29  75.696   7.101 -12.108
  223    HZ1  LYS  29           HZ1      LYS  29  77.920   6.406 -12.164
  224    HZ2  LYS  29           HZ2      LYS  29  77.512   4.819 -12.611
  225    HZ3  LYS  29           HZ3      LYS  29  77.171   5.377 -11.043
  226    H1U  RCY  30           H1U      RCY  30  69.589   6.345  -7.021
  227    H1S  RCY  30           H1S      RCY  30  67.143   8.401  -9.611
  228    HB1  RCY  30           HB1      RCY  30  68.758  11.699 -10.804
  229    HB2  RCY  30           HB2      RCY  30  69.341  10.295  -9.911
  230    HA   RCY  30           HA       RCY  30  69.813  10.824 -12.861
  231    HN1  RCY  30           HN1      RCY  30  70.089   8.381 -11.368
  232    H    LYS  31           HN       LYS  31  70.258  12.593 -10.475
  233    HA   LYS  31           HA       LYS  31  73.171  12.489 -10.061
  234    HB2  LYS  31           HB2      LYS  31  73.455  14.837 -10.931
  235    HB3  LYS  31           HB1      LYS  31  73.123  13.643 -12.184
  236    HG2  LYS  31           HG2      LYS  31  70.744  14.933 -10.959
  237    HG3  LYS  31           HG1      LYS  31  71.750  15.971 -11.969
  238    HD2  LYS  31           HD2      LYS  31  71.619  14.279 -13.791
  239    HD3  LYS  31           HD1      LYS  31  70.537  13.314 -12.786
  240    HE2  LYS  31           HE2      LYS  31  70.015  16.151 -13.723
  241    HE3  LYS  31           HE1      LYS  31  69.251  14.698 -14.368
  242    HZ1  LYS  31           HZ1      LYS  31  69.064  15.663 -11.565
  243    HZ2  LYS  31           HZ2      LYS  31  68.344  14.248 -12.172
  244    HZ3  LYS  31           HZ3      LYS  31  67.840  15.770 -12.735
  245    H    GLN  32           HN       GLN  32  71.423  12.186  -8.064
  246    HA   GLN  32           HA       GLN  32  70.657  13.095  -6.037
  247    HB2  GLN  32           HB2      GLN  32  72.796  15.166  -6.619
  248    HB3  GLN  32           HB1      GLN  32  72.120  14.769  -5.039
  249    HG2  GLN  32           HG2      GLN  32  73.005  12.480  -5.219
  250    HG3  GLN  32           HG1      GLN  32  73.662  12.852  -6.814
  251   HE21  GLN  32          HE21      GLN  32  73.818  14.100  -3.427
  252   HE22  GLN  32          HE22      GLN  32  75.451  14.554  -3.518
  253    H    ARG  33           HN       ARG  33  68.579  13.756  -6.814
  254    HA   ARG  33           HA       ARG  33  68.169  16.289  -8.145
  255    HE   ARG  33           HE       ARG  33  63.795  17.029  -9.801
  256    HB2  ARG  33           HB2      ARG  33  66.603  14.243  -8.120
  257    HB3  ARG  33           HB1      ARG  33  66.085  14.811  -6.533
  258    HG2  ARG  33           HG2      ARG  33  65.500  17.008  -7.527
  259    HG3  ARG  33           HG1      ARG  33  65.966  16.398  -9.115
  260    HD2  ARG  33           HD2      ARG  33  64.275  14.532  -8.768
  261    HD3  ARG  33           HD1      ARG  33  63.703  15.423  -7.357
  262   HH11  ARG  33          HH21      ARG  33  62.029  14.843  -7.804
  263   HH12  ARG  33          HH22      ARG  33  60.479  15.356  -8.384
  264   HH21  ARG  33          HH11      ARG  33  61.782  17.711 -10.570
  265   HH22  ARG  33          HH12      ARG  33  60.340  16.980  -9.950
  266    H    GLN  34           HN       GLN  34  68.500  15.316  -4.828
  267    HA   GLN  34           HA       GLN  34  68.559  18.091  -3.962
  268    HB2  GLN  34           HB2      GLN  34  66.063  16.616  -3.806
  269    HB3  GLN  34           HB1      GLN  34  66.625  17.028  -2.187
  270    HG2  GLN  34           HG2      GLN  34  66.511  19.046  -4.441
  271    HG3  GLN  34           HG1      GLN  34  65.173  18.789  -3.320
  272   HE21  GLN  34          HE21      GLN  34  65.265  19.950  -1.382
  273   HE22  GLN  34          HE22      GLN  34  66.652  20.723  -0.783
  274    H    THR  35           HN       THR  35  69.924  18.212  -2.227
  275    HA   THR  35           HA       THR  35  70.999  15.712  -1.132
  276    HB   THR  35           HB       THR  35  72.628  17.114  -0.035
  277    HG1  THR  35           HG1      THR  35  70.596  18.935  -0.253
  278   HG21  THR  35          HG21      THR  35  72.702  16.861  -2.569
  279   HG22  THR  35          HG22      THR  35  73.588  18.238  -1.914
  280   HG23  THR  35          HG23      THR  35  72.009  18.480  -2.661
  281    H    ARG  36           HN       ARG  36  69.135  14.909   0.019
  282    HA   ARG  36           HA       ARG  36  67.856  16.508   2.082
  283    HE   ARG  36           HE       ARG  36  64.190  17.147   3.009
  284    HB2  ARG  36           HB2      ARG  36  67.044  14.332   0.750
  285    HB3  ARG  36           HB1      ARG  36  67.750  13.515   2.142
  286    HG2  ARG  36           HG2      ARG  36  65.586  13.873   2.914
  287    HG3  ARG  36           HG1      ARG  36  66.384  15.332   3.501
  288    HD2  ARG  36           HD2      ARG  36  65.687  16.438   1.310
  289    HD3  ARG  36           HD1      ARG  36  64.660  15.031   1.034
  290   HH11  ARG  36          HH21      ARG  36  63.610  13.912   1.969
  291   HH12  ARG  36          HH22      ARG  36  62.109  13.766   2.820
  292   HH21  ARG  36          HH11      ARG  36  62.232  16.975   4.127
  293   HH22  ARG  36          HH12      ARG  36  61.329  15.500   4.042
  294    H    GLN  37           HN       GLN  37  70.875  15.159   1.904
  295    HA   GLN  37           HA       GLN  37  72.499  14.607   3.500
  296    HB2  GLN  37           HB2      GLN  37  70.643  16.386   5.095
  297    HB3  GLN  37           HB1      GLN  37  72.150  15.753   5.757
  298    HG2  GLN  37           HG2      GLN  37  72.054  17.247   3.132
  299    HG3  GLN  37           HG1      GLN  37  72.274  18.074   4.675
  300   HE21  GLN  37          HE21      GLN  37  74.068  16.982   2.157
  301   HE22  GLN  37          HE22      GLN  37  75.495  16.545   2.965
  302    H1U  RCY  38           H1U      RCY  38  75.660   8.942   4.190
  303    H1S  RCY  38           H1S      RCY  38  71.516   8.742   3.703
  304    HB1  RCY  38           HB1      RCY  38  69.719   9.706   4.994
  305    HB2  RCY  38           HB2      RCY  38  71.212  10.623   5.194
  306    HA   RCY  38           HA       RCY  38  68.399  11.672   4.858
  307    HN1  RCY  38           HN1      RCY  38  69.446  13.369   3.595
  308    H    LYS  39           HN       LYS  39  68.813  13.893   6.477
  309    HA   LYS  39           HA       LYS  39  70.270  13.193   8.889
  310    HB2  LYS  39           HB2      LYS  39  68.347  15.379   8.120
  311    HB3  LYS  39           HB1      LYS  39  68.801  15.162   9.809
  312    HG2  LYS  39           HG2      LYS  39  70.962  15.236   7.731
  313    HG3  LYS  39           HG1      LYS  39  70.224  16.753   8.247
  314    HD2  LYS  39           HD2      LYS  39  71.331  14.707  10.185
  315    HD3  LYS  39           HD1      LYS  39  72.272  16.068   9.574
  316    HE2  LYS  39           HE2      LYS  39  71.418  17.171  11.372
  317    HE3  LYS  39           HE1      LYS  39  69.978  17.328  10.365
  318    HZ1  LYS  39           HZ1      LYS  39  70.131  16.081  12.794
  319    HZ2  LYS  39           HZ2      LYS  39  70.093  14.800  11.679
  320    HZ3  LYS  39           HZ3      LYS  39  68.854  15.962  11.683
  321    H    SER  40           HN       SER  40  69.578  11.735  10.358
  322    HA   SER  40           HA       SER  40  67.039  11.721  11.585
  323    HG   SER  40           HG       SER  40  68.232  10.481   8.802
  324    HB2  SER  40           HB2      SER  40  66.300   9.440  10.465
  325    HB3  SER  40           HB1      SER  40  65.886  10.973   9.703
  326    H    LYS  41           HN       LYS  41  70.098  10.433  10.962
  327    HA   LYS  41           HA       LYS  41  69.759   8.291  13.020
  328    HB2  LYS  41           HB2      LYS  41  71.981   8.743  11.000
  329    HB3  LYS  41           HB1      LYS  41  71.917   7.416  12.156
  330    HG2  LYS  41           HG2      LYS  41  70.927   6.339  10.384
  331    HG3  LYS  41           HG1      LYS  41  69.484   7.117  11.036
  332    HD2  LYS  41           HD2      LYS  41  69.756   8.992   9.487
  333    HD3  LYS  41           HD1      LYS  41  71.252   8.291   8.870
  334    HE2  LYS  41           HE2      LYS  41  69.380   7.773   7.362
  335    HE3  LYS  41           HE1      LYS  41  69.995   6.298   8.108
  336    HZ1  LYS  41           HZ1      LYS  41  67.848   7.724   9.485
  337    HZ2  LYS  41           HZ2      LYS  41  68.152   6.056   9.382
  338    HZ3  LYS  41           HZ3      LYS  41  67.440   6.875   8.075
  339    HA   PRO  42           HA       PRO  42  72.008  10.799  15.895
  340    HB2  PRO  42           HB2      PRO  42  73.270   8.837  17.372
  341    HB3  PRO  42           HB1      PRO  42  71.558   9.268  17.553
  342    HG2  PRO  42           HG2      PRO  42  72.787   6.995  16.082
  343    HG3  PRO  42           HG1      PRO  42  71.304   7.047  17.049
  344    HD2  PRO  42           HD2      PRO  42  71.278   7.094  14.319
  345    HD3  PRO  42           HD1      PRO  42  70.034   7.897  15.303
  346    HA   PRO  43           HA       PRO  43  76.151  11.324  14.448
  347    HB2  PRO  43           HB2      PRO  43  77.465  12.136  16.730
  348    HB3  PRO  43           HB1      PRO  43  76.375  13.177  15.795
  349    HG2  PRO  43           HG2      PRO  43  75.859  11.676  18.308
  350    HG3  PRO  43           HG1      PRO  43  75.307  13.286  17.818
  351    HD2  PRO  43           HD2      PRO  43  73.696  11.081  17.714
  352    HD3  PRO  43           HD1      PRO  43  73.522  12.453  16.597
  353    H    LYS  44           HN       LYS  44  77.573   9.719  13.937
  354    HA   LYS  44           HA       LYS  44  79.220   8.383  15.836
  355    HB2  LYS  44           HB2      LYS  44  76.583   7.278  15.590
  356    HB3  LYS  44           HB1      LYS  44  77.716   6.134  14.874
  357    HG2  LYS  44           HG2      LYS  44  79.135   6.392  16.963
  358    HG3  LYS  44           HG1      LYS  44  77.793   7.291  17.673
  359    HD2  LYS  44           HD2      LYS  44  77.692   4.439  16.645
  360    HD3  LYS  44           HD1      LYS  44  77.644   4.941  18.336
  361    HE2  LYS  44           HE2      LYS  44  75.550   5.321  16.202
  362    HE3  LYS  44           HE1      LYS  44  75.372   4.613  17.807
  363    HZ1  LYS  44           HZ1      LYS  44  75.682   6.752  18.799
  364    HZ2  LYS  44           HZ2      LYS  44  74.460   6.881  17.626
  365    HZ3  LYS  44           HZ3      LYS  44  76.022   7.464  17.297
  366    H    LYS  45           HN       LYS  45  80.880   8.662  14.351
  367    HA   LYS  45           HA       LYS  45  81.075   6.755  12.186
  368    HB2  LYS  45           HB2      LYS  45  79.615   8.913  11.442
  369    HB3  LYS  45           HB1      LYS  45  81.231   9.526  11.097
  370    HG2  LYS  45           HG2      LYS  45  81.625   7.280   9.889
  371    HG3  LYS  45           HG1      LYS  45  79.874   7.083   9.954
  372    HD2  LYS  45           HD2      LYS  45  81.387   9.375   8.669
  373    HD3  LYS  45           HD1      LYS  45  80.463   8.125   7.835
  374    HE2  LYS  45           HE2      LYS  45  78.453   8.929   9.235
  375    HE3  LYS  45           HE1      LYS  45  79.431  10.354   9.590
  376    HZ1  LYS  45           HZ1      LYS  45  78.822  11.173   7.643
  377    HZ2  LYS  45           HZ2      LYS  45  77.971   9.754   7.256
  378    HZ3  LYS  45           HZ3      LYS  45  79.617   9.896   6.858
  379    H    GLY  46           HN       GLY  46  83.127   7.565  10.747
  380    HA2  GLY  46           HA2      GLY  46  85.100   9.267  11.637
  381    HA3  GLY  46           HA1      GLY  46  85.284   7.862  12.689
  382    H    VAL  47           HN       VAL  47  86.355   6.090  11.890
  383    HA   VAL  47           HA       VAL  47  87.312   6.264   9.072
  384    HB   VAL  47           HB       VAL  47  88.767   4.241  10.116
  385   HG11  VAL  47          HG11      VAL  47  89.199   7.222  10.435
  386   HG12  VAL  47          HG12      VAL  47  89.774   6.190   9.125
  387   HG13  VAL  47          HG13      VAL  47  90.457   6.025  10.742
  388   HG21  VAL  47          HG21      VAL  47  88.356   6.075  12.484
  389   HG22  VAL  47          HG22      VAL  47  89.197   4.526  12.439
  390   HG23  VAL  47          HG23      VAL  47  87.440   4.580  12.297
  391    H    GLN  48           HN       GLN  48  86.252   3.709  11.366
  392    HA   GLN  48           HA       GLN  48  85.133   1.688  10.936
  393    HB2  GLN  48           HB2      GLN  48  83.872   3.163   8.617
  394    HB3  GLN  48           HB1      GLN  48  83.170   1.877   9.598
  395    HG2  GLN  48           HG2      GLN  48  83.224   3.379  11.575
  396    HG3  GLN  48           HG1      GLN  48  83.861   4.671  10.555
  397   HE21  GLN  48          HE21      GLN  48  81.969   3.252   8.381
  398   HE22  GLN  48          HE22      GLN  48  80.476   3.998   8.692
  399    H    GLY  49           HN       GLY  49  87.519   2.762   9.065
  400    HA2  GLY  49           HA2      GLY  49  88.898   1.576   7.556
  401    HA3  GLY  49           HA1      GLY  49  87.736   0.248   7.601
  402    H1U  RCY  50           H1U      RCY  50  86.123  -0.388  -0.826
  403    H1S  RCY  50           H1S      RCY  50  83.606   1.734   2.759
  404    HB1  RCY  50           HB1      RCY  50  84.524   3.111   5.407
  405    HB2  RCY  50           HB2      RCY  50  85.157   1.927   4.264
  406    HA   RCY  50           HA       RCY  50  87.139   3.222   3.886
  407    HN1  RCY  50           HN1      RCY  50  87.264   3.669   6.710
  408    H    GLY  51           HN       GLY  51  86.466   5.183   2.757
  409    HA2  GLY  51           HA2      GLY  51  85.758   7.497   2.722
  410    HA3  GLY  51           HA1      GLY  51  85.958   7.554   4.473
  411    H    ASP  52           HN       ASP  52  87.966   8.120   5.318
  412    HA   ASP  52           HA       ASP  52  90.076   9.155   5.284
  413    HB2  ASP  52           HB2      ASP  52  90.554   6.743   4.519
  414    HB3  ASP  52           HB1      ASP  52  90.637   7.403   2.885
  415    H    ASP  53           HN       ASP  53  87.806   9.852   3.167
  416    HA   ASP  53           HA       ASP  53  89.345  12.044   1.965
  417    HB2  ASP  53           HB2      ASP  53  88.818  11.484  -0.343
  418    HB3  ASP  53           HB1      ASP  53  89.674  10.123   0.383
  419    H    ILE  54           HN       ILE  54  87.301  12.573  -0.049
  420    HA   ILE  54           HA       ILE  54  84.966  13.183   1.736
  421    HB   ILE  54           HB       ILE  54  85.858  14.865  -0.615
  422   HG12  ILE  54          HG12      ILE  54  87.692  14.786   1.030
  423   HG13  ILE  54          HG11      ILE  54  86.910  16.367   1.054
  424   HG21  ILE  54          HG21      ILE  54  83.543  15.166   0.136
  425   HG22  ILE  54          HG22      ILE  54  84.503  16.582   0.566
  426   HG23  ILE  54          HG23      ILE  54  84.093  15.387   1.797
  427   HD11  ILE  54          HD11      ILE  54  86.854  15.986   3.310
  428   HD12  ILE  54          HD12      ILE  54  86.928  14.234   3.119
  429   HD13  ILE  54          HD13      ILE  54  85.398  15.082   2.895
  430    HA   PRO  55           HA       PRO  55  83.409  10.855  -1.939
  431    HB2  PRO  55           HB2      PRO  55  82.209   8.820  -0.652
  432    HB3  PRO  55           HB1      PRO  55  83.968   8.848  -0.893
  433    HG2  PRO  55           HG2      PRO  55  82.392   9.460   1.549
  434    HG3  PRO  55           HG1      PRO  55  83.956   8.646   1.386
  435    HD2  PRO  55           HD2      PRO  55  83.595  11.340   2.084
  436    HD3  PRO  55           HD1      PRO  55  85.113  10.618   1.508
  437    H    GLY  56           HN       GLY  56  81.165  10.570  -2.651
  438    HA2  GLY  56           HA2      GLY  56  78.777  10.769  -2.356
  439    HA3  GLY  56           HA1      GLY  56  79.062  11.616  -0.836
  440    H    MET  57           HN       MET  57  81.203  12.907  -3.003
  441    HA   MET  57           HA       MET  57  79.772  15.399  -3.161
  442    HB2  MET  57           HB2      MET  57  81.615  16.084  -4.708
  443    HB3  MET  57           HB1      MET  57  82.204  15.391  -3.199
  444    HG2  MET  57           HG2      MET  57  82.085  13.131  -4.616
  445    HG3  MET  57           HG1      MET  57  82.277  14.253  -5.963
  446    HE1  MET  57           HE1      MET  57  84.584  11.872  -4.457
  447    HE2  MET  57           HE2      MET  57  85.727  12.668  -5.537
  448    HE3  MET  57           HE3      MET  57  84.070  12.392  -6.067
  449    H    GLU  58           HN       GLU  58  80.843  13.332  -5.894
  450    HA   GLU  58           HA       GLU  58  78.314  13.033  -7.114
  451    HB2  GLU  58           HB2      GLU  58  78.663  14.758  -8.998
  452    HB3  GLU  58           HB1      GLU  58  78.099  15.377  -7.448
  453    HG2  GLU  58           HG2      GLU  58  80.221  16.239  -6.880
  454    HG3  GLU  58           HG1      GLU  58  81.045  15.239  -8.077
  455    H    GLY  59           HN       GLY  59  80.137  11.181  -7.020
  456    HA2  GLY  59           HA2      GLY  59  80.637  10.163  -9.491
  457    HA3  GLY  59           HA1      GLY  59  81.980  11.293  -9.311
  458    H1U  RCY  60           H1U      RCY  60  80.704   1.902  -4.841
  459    H1S  RCY  60           H1S      RCY  60  79.603   6.175  -6.300
  460    HB1  RCY  60           HB1      RCY  60  82.051   6.672  -6.239
  461    HB2  RCY  60           HB2      RCY  60  82.701   5.498  -7.383
  462    HA   RCY  60           HA       RCY  60  83.754   7.997  -6.980
  463    HN1  RCY  60           HN1      RCY  60  82.326   8.472  -9.523
  464    H    GLY  61           HN       GLY  61  82.842   5.894  -9.714
  465    HA2  GLY  61           HA2      GLY  61  84.919   6.028 -11.444
  466    HA3  GLY  61           HA1      GLY  61  85.683   5.200 -10.086
  467    H    THR  62           HN       THR  62  85.053   3.059  -9.601
  468    HA   THR  62           HA       THR  62  84.436   1.283 -11.626
  469    HB   THR  62           HB       THR  62  84.118  -0.326  -9.984
  470    HG1  THR  62           HG1      THR  62  82.542  -0.084  -8.645
  471   HG21  THR  62          HG21      THR  62  85.591   0.165  -8.198
  472   HG22  THR  62          HG22      THR  62  85.153   1.874  -8.198
  473   HG23  THR  62          HG23      THR  62  86.129   1.213  -9.510
  474    H    ASP  63           HN       ASP  63  82.802   1.723 -13.074
  475    HA   ASP  63           HA       ASP  63  80.230   2.783 -12.313
  476    HB2  ASP  63           HB2      ASP  63  81.034   1.212 -14.788
  477    HB3  ASP  63           HB1      ASP  63  79.540   2.133 -14.605
  478    H    ILE  64           HN       ILE  64  80.345   1.046 -10.448
  479    HA   ILE  64           HA       ILE  64  79.745  -1.071  -9.591
  480    HB   ILE  64           HB       ILE  64  77.662   0.030  -9.374
  481   HG12  ILE  64          HG12      ILE  64  76.856  -2.322 -11.077
  482   HG13  ILE  64          HG11      ILE  64  77.682  -2.575  -9.540
  483   HG21  ILE  64          HG21      ILE  64  77.370  -0.352 -12.369
  484   HG22  ILE  64          HG22      ILE  64  77.627   1.176 -11.526
  485   HG23  ILE  64          HG23      ILE  64  76.112   0.298 -11.318
  486   HD11  ILE  64          HD11      ILE  64  75.296  -2.637  -9.126
  487   HD12  ILE  64          HD12      ILE  64  75.066  -1.109  -9.978
  488   HD13  ILE  64          HD13      ILE  64  75.932  -1.141  -8.441
  489    H    THR  65           HN       THR  65  81.316  -2.281 -10.903
  490    HA   THR  65           HA       THR  65  80.453  -3.477 -13.403
  491    HB   THR  65           HB       THR  65  82.854  -3.309 -12.907
  492    HG1  THR  65           HG1      THR  65  83.271  -5.706 -12.972
  493   HG21  THR  65          HG21      THR  65  82.446  -5.312 -10.685
  494   HG22  THR  65          HG22      THR  65  82.431  -3.574 -10.383
  495   HG23  THR  65          HG23      THR  65  83.878  -4.343 -11.035
  496    H    VAL  66           HN       VAL  66  78.387  -3.701 -11.689
  497    HA   VAL  66           HA       VAL  66  76.816  -5.314 -11.031
  498    HB   VAL  66           HB       VAL  66  78.872  -7.499 -11.288
  499   HG11  VAL  66          HG11      VAL  66  75.952  -7.379 -12.087
  500   HG12  VAL  66          HG12      VAL  66  76.498  -7.871 -10.483
  501   HG13  VAL  66          HG13      VAL  66  76.952  -8.819 -11.900
  502   HG21  VAL  66          HG21      VAL  66  77.922  -5.695 -13.420
  503   HG22  VAL  66          HG22      VAL  66  77.703  -7.409 -13.773
  504   HG23  VAL  66          HG23      VAL  66  79.310  -6.783 -13.404
  505    H    ILE  67           HN       ILE  67  80.113  -5.418  -9.858
  506    HA   ILE  67           HA       ILE  67  79.074  -5.654  -7.080
  507    HB   ILE  67           HB       ILE  67  81.340  -7.294  -8.256
  508   HG12  ILE  67          HG12      ILE  67  78.771  -8.139  -6.882
  509   HG13  ILE  67          HG11      ILE  67  78.995  -8.111  -8.631
  510   HG21  ILE  67          HG21      ILE  67  82.024  -6.571  -6.064
  511   HG22  ILE  67          HG22      ILE  67  81.445  -8.228  -5.901
  512   HG23  ILE  67          HG23      ILE  67  80.421  -6.883  -5.399
  513   HD11  ILE  67          HD11      ILE  67  79.398 -10.372  -7.692
  514   HD12  ILE  67          HD12      ILE  67  80.686  -9.709  -6.686
  515   HD13  ILE  67          HD13      ILE  67  80.849  -9.707  -8.442
  516    H1U  RCY  68           H1U      RCY  68  75.135  -0.922  -5.088
  517    H1S  RCY  68           H1S      RCY  68  79.309   0.514  -5.221
  518    HB1  RCY  68           HB1      RCY  68  81.467  -0.890  -5.066
  519    HB2  RCY  68           HB2      RCY  68  79.935  -1.742  -5.258
  520    HA   RCY  68           HA       RCY  68  82.045  -2.280  -7.291
  521    HN1  RCY  68           HN1      RCY  68  79.675  -3.635  -6.318
  522    HA   PRO  69           HA       PRO  69  85.062  -4.605  -4.930
  523    HB2  PRO  69           HB2      PRO  69  86.403  -1.921  -4.964
  524    HB3  PRO  69           HB1      PRO  69  87.078  -3.523  -5.321
  525    HG2  PRO  69           HG2      PRO  69  86.425  -1.816  -7.263
  526    HG3  PRO  69           HG1      PRO  69  86.203  -3.564  -7.446
  527    HD2  PRO  69           HD2      PRO  69  84.152  -1.445  -7.080
  528    HD3  PRO  69           HD1      PRO  69  83.997  -3.048  -7.832
  529    H    TRP  70           HN       TRP  70  85.283  -1.245  -3.748
  530    HA   TRP  70           HA       TRP  70  85.434  -2.117  -1.011
  531    HD1  TRP  70           HD1      TRP  70  83.995   1.823   0.125
  532    HE1  TRP  70           HE1      TRP  70  82.328   3.282  -1.190
  533    HE3  TRP  70           HE3      TRP  70  84.789   0.036  -4.592
  534    HZ2  TRP  70           HZ2      TRP  70  81.445   3.645  -3.890
  535    HZ3  TRP  70           HZ3      TRP  70  83.526   0.953  -6.512
  536    HH2  TRP  70           HH2      TRP  70  81.856   2.753  -6.171
  537    HB2  TRP  70           HB2      TRP  70  85.793   0.118  -0.477
  538    HB3  TRP  70           HB1      TRP  70  86.302   0.084  -2.162
  539    H    GLU  71           HN       GLU  71  83.114  -3.247  -2.055
  540    HA   GLU  71           HA       GLU  71  81.083  -1.974  -0.302
  541    HB2  GLU  71           HB2      GLU  71  80.743  -1.219  -2.707
  542    HB3  GLU  71           HB1      GLU  71  80.413  -2.904  -3.107
  543    HG2  GLU  71           HG2      GLU  71  78.934  -1.696  -0.805
  544    HG3  GLU  71           HG1      GLU  71  78.441  -1.241  -2.436
  545    H    ALA  72           HN       ALA  72  82.732  -4.693  -1.335
  546    HA   ALA  72           HA       ALA  72  80.670  -6.698  -1.085
  547    HB1  ALA  72           HB1      ALA  72  82.632  -7.412  -2.195
  548    HB2  ALA  72           HB2      ALA  72  82.723  -8.208  -0.624
  549    HB3  ALA  72           HB3      ALA  72  83.683  -6.762  -0.939
  550    H1U  RCY  73           H1U      RCY  73  76.772  -1.171   0.078
  551    H1S  RCY  73           H1S      RCY  73  80.475  -1.381   1.691
  552    HB1  RCY  73           HB1      RCY  73  79.980  -4.504   4.640
  553    HB2  RCY  73           HB2      RCY  73  79.188  -4.332   3.073
  554    HA   RCY  73           HA       RCY  73  81.904  -5.617   3.492
  555    HN1  RCY  73           HN1      RCY  73  80.780  -4.686   1.109
  556    H    ASN  74           HN       ASN  74  81.728  -7.550   4.474
  557    HA   ASN  74           HA       ASN  74  80.335  -9.779   3.809
  558    HB2  ASN  74           HB2      ASN  74  81.258  -8.698   6.409
  559    HB3  ASN  74           HB1      ASN  74  80.042  -9.969   6.525
  560   HD21  ASN  74          HD21      ASN  74  83.389  -9.378   6.016
  561   HD22  ASN  74          HD22      ASN  74  83.824 -10.945   5.528
  562    H    HIS  75           HN       HIS  75  78.316 -10.782   4.544
  563    HA   HIS  75           HA       HIS  75  76.026 -10.777   5.106
  564    HD1  HIS  75           HD1      HIS  75  73.993 -10.378   5.022
  565    HD2  HIS  75           HD2      HIS  75  74.505  -8.145   8.508
  566    HE1  HIS  75           HE1      HIS  75  71.831 -10.581   6.325
  567    HE2  HIS  75           HE2      HIS  75  72.129  -9.226   8.450
  568    HB2  HIS  75           HB2      HIS  75  76.833  -8.984   6.846
  569    HB3  HIS  75           HB1      HIS  75  76.142  -7.825   5.710
  570    H1U  RCY  76           H1U      RCY  76  77.582  -0.836   2.898
  571    H1S  RCY  76           H1S      RCY  76  77.663  -5.695   2.981
  572    HB1  RCY  76           HB1      RCY  76  76.110  -7.402  -0.105
  573    HB2  RCY  76           HB2      RCY  76  77.481  -7.731   0.953
  574    HA   RCY  76           HA       RCY  76  74.766  -9.048   1.247
  575    HN1  RCY  76           HN1      RCY  76  77.191 -10.159   2.487
  576    H    GLU  77           HN       GLU  77  77.208  -8.621  -0.919
  577    HA   GLU  77           HA       GLU  77  76.511 -11.005  -2.402
  578    HB2  GLU  77           HB2      GLU  77  77.286  -8.701  -3.307
  579    HB3  GLU  77           HB1      GLU  77  78.919  -9.280  -2.979
  580    HG2  GLU  77           HG2      GLU  77  78.500  -9.890  -5.238
  581    HG3  GLU  77           HG1      GLU  77  78.267 -11.377  -4.317
  582    H    LEU  78           HN       LEU  78  79.704  -9.940  -1.125
  583    HA   LEU  78           HA       LEU  78  80.254 -12.779  -0.425
  584    HG   LEU  78           HG       LEU  78  82.776 -13.222  -0.437
  585    HB2  LEU  78           HB2      LEU  78  81.154 -12.206  -2.750
  586    HB3  LEU  78           HB1      LEU  78  82.267 -11.106  -1.939
  587   HD11  LEU  78          HD11      LEU  78  81.050 -14.651  -1.424
  588   HD12  LEU  78          HD12      LEU  78  82.645 -15.306  -1.793
  589   HD13  LEU  78          HD13      LEU  78  81.748 -14.421  -3.027
  590   HD21  LEU  78          HD21      LEU  78  84.443 -12.110  -1.831
  591   HD22  LEU  78          HD22      LEU  78  83.770 -12.855  -3.281
  592   HD23  LEU  78          HD23      LEU  78  84.570 -13.853  -2.066
  593    H    HIS  79           HN       HIS  79  83.122 -11.175  -0.413
  594    HA   HIS  79           HA       HIS  79  82.879  -9.565   1.980
  595    HD1  HIS  79           HD1      HIS  79  84.570  -8.958   3.368
  596    HD2  HIS  79           HD2      HIS  79  85.407 -12.849   4.618
  597    HE1  HIS  79           HE1      HIS  79  86.382  -8.770   5.128
  598    HE2  HIS  79           HE2      HIS  79  86.901 -11.131   5.897
  599    HB2  HIS  79           HB2      HIS  79  82.625 -11.617   3.172
  600    HB3  HIS  79           HB1      HIS  79  83.861 -12.418   2.203
  601    H    GLU  80           HN       GLU  80  84.685  -8.258   2.115
  602    HA   GLU  80           HA       GLU  80  87.210  -9.158   0.835
  603    HB2  GLU  80           HB2      GLU  80  85.743  -6.603   0.107
  604    HB3  GLU  80           HB1      GLU  80  87.403  -6.966  -0.360
  605    HG2  GLU  80           HG2      GLU  80  85.014  -8.701  -1.052
  606    HG3  GLU  80           HG1      GLU  80  85.747  -7.531  -2.150
  607    H    LEU  81           HN       LEU  81  86.385  -5.839   1.661
  608    HA   LEU  81           HA       LEU  81  88.474  -5.921   3.776
  609    HG   LEU  81           HG       LEU  81  85.854  -3.806   2.543
  610    HB2  LEU  81           HB2      LEU  81  88.242  -3.404   3.661
  611    HB3  LEU  81           HB1      LEU  81  88.801  -4.160   2.169
  612   HD11  LEU  81          HD11      LEU  81  87.840  -1.601   1.965
  613   HD12  LEU  81          HD12      LEU  81  86.539  -1.609   3.156
  614   HD13  LEU  81          HD13      LEU  81  86.159  -1.509   1.437
  615   HD21  LEU  81          HD21      LEU  81  85.818  -4.038   0.258
  616   HD22  LEU  81          HD22      LEU  81  87.368  -4.827   0.549
  617   HD23  LEU  81          HD23      LEU  81  87.320  -3.139   0.042
  618    H    ALA  82           HN       ALA  82  85.621  -6.926   4.088
  619    HA   ALA  82           HA       ALA  82  83.964  -5.245   5.576
  620    HB1  ALA  82           HB1      ALA  82  83.582  -7.704   4.994
  621    HB2  ALA  82           HB2      ALA  82  83.048  -7.204   6.600
  622    HB3  ALA  82           HB3      ALA  82  84.560  -8.093   6.410
  623    H    GLN  83           HN       GLN  83  83.911  -4.534   7.723
  624    HA   GLN  83           HA       GLN  83  85.980  -5.400   9.622
  625    HB2  GLN  83           HB2      GLN  83  86.962  -3.554   8.091
  626    HB3  GLN  83           HB1      GLN  83  85.862  -2.462   8.931
  627    HG2  GLN  83           HG2      GLN  83  87.849  -2.318  10.195
  628    HG3  GLN  83           HG1      GLN  83  86.863  -3.463  11.105
  629   HE21  GLN  83          HE21      GLN  83  87.478  -5.738  11.047
  630   HE22  GLN  83          HE22      GLN  83  88.991  -6.233  10.455
  631    H    TYR  84           HN       TYR  84  84.073  -2.397   9.310
  632    HA   TYR  84           HA       TYR  84  82.537  -3.241  11.742
  633    HD1  TYR  84           HD2      TYR  84  82.658  -1.930  14.272
  634    HD2  TYR  84           HD1      TYR  84  85.949  -1.318  11.580
  635    HE1  TYR  84           HE2      TYR  84  84.247  -2.546  16.074
  636    HE2  TYR  84           HE1      TYR  84  87.538  -1.934  13.382
  637    HH   TYR  84           HH       TYR  84  86.409  -3.166  16.484
  638    HB2  TYR  84           HB2      TYR  84  83.731  -0.567  10.999
  639    HB3  TYR  84           HB1      TYR  84  82.391  -0.688  12.141
  640    H    GLY  85           HN       GLY  85  82.458  -2.175   8.489
  641    HA2  GLY  85           HA2      GLY  85  79.778  -1.019   8.584
  642    HA3  GLY  85           HA1      GLY  85  80.683  -1.418   7.121
  643    H    ILE  86           HN       ILE  86  80.128  -3.704   9.717
  644    HA   ILE  86           HA       ILE  86  79.539  -6.023   8.836
  645    HB   ILE  86           HB       ILE  86  77.362  -6.236  10.057
  646   HG12  ILE  86          HG12      ILE  86  77.589  -3.251   9.893
  647   HG13  ILE  86          HG11      ILE  86  76.160  -4.273   9.728
  648   HG21  ILE  86          HG21      ILE  86  78.319  -5.871  12.189
  649   HG22  ILE  86          HG22      ILE  86  79.252  -4.484  11.627
  650   HG23  ILE  86          HG23      ILE  86  79.712  -6.114  11.135
  651   HD11  ILE  86          HD11      ILE  86  77.584  -3.429  12.249
  652   HD12  ILE  86          HD12      ILE  86  76.539  -4.850  12.227
  653   HD13  ILE  86          HD13      ILE  86  75.876  -3.261  11.842
  654    H1U  RCY  87           H1U      RCY  87  76.903  -7.547   1.890
  655    H1S  RCY  87           H1S      RCY  87  74.813  -5.632   5.407
  656    HB1  RCY  87           HB1      RCY  87  75.475  -2.402   6.081
  657    HB2  RCY  87           HB2      RCY  87  74.718  -3.201   7.459
  658    HA   RCY  87           HA       RCY  87  75.542  -5.405   6.309
  659    HN1  RCY  87           HN1      RCY  87  76.802  -3.760   8.241
  Start of MODEL   35
    1    HA   MET   1           HA       MET   1  83.314 -12.958  19.077
    2    HB2  MET   1           HB2      MET   1  85.695 -12.239  18.606
    3    HB3  MET   1           HB1      MET   1  86.109 -13.946  18.452
    4    HG2  MET   1           HG2      MET   1  85.653 -13.122  16.233
    5    HG3  MET   1           HG1      MET   1  84.290 -14.136  16.705
    6    HE1  MET   1           HE1      MET   1  85.381 -10.949  15.203
    7    HE2  MET   1           HE2      MET   1  85.701 -10.527  16.884
    8    HE3  MET   1           HE3      MET   1  84.465  -9.653  15.982
    9    H    ASN   2           HN       ASN   2  81.919 -14.581  18.617
   10    HA   ASN   2           HA       ASN   2  82.775 -17.195  17.808
   11    HB2  ASN   2           HB2      ASN   2  81.658 -18.411  19.776
   12    HB3  ASN   2           HB1      ASN   2  83.239 -17.694  20.093
   13   HD21  ASN   2          HD21      ASN   2  83.111 -16.929  22.223
   14   HD22  ASN   2          HD22      ASN   2  81.864 -15.944  22.818
   15    H    LEU   3           HN       LEU   3  80.017 -17.554  19.700
   16    HA   LEU   3           HA       LEU   3  77.755 -17.772  19.128
   17    HG   LEU   3           HG       LEU   3  75.937 -16.859  18.043
   18    HB2  LEU   3           HB2      LEU   3  77.968 -15.289  19.115
   19    HB3  LEU   3           HB1      LEU   3  78.366 -15.353  17.400
   20   HD11  LEU   3          HD11      LEU   3  75.620 -15.151  19.742
   21   HD12  LEU   3          HD12      LEU   3  74.552 -14.794  18.385
   22   HD13  LEU   3          HD13      LEU   3  76.045 -13.880  18.597
   23   HD21  LEU   3          HD21      LEU   3  75.147 -15.800  16.059
   24   HD22  LEU   3          HD22      LEU   3  76.867 -16.073  15.780
   25   HD23  LEU   3          HD23      LEU   3  76.289 -14.467  16.226
   26    H    GLU   4           HN       GLU   4  77.339 -19.572  17.929
   27    HA   GLU   4           HA       GLU   4  78.502 -20.325  15.497
   28    HB2  GLU   4           HB2      GLU   4  76.132 -21.511  15.185
   29    HB3  GLU   4           HB1      GLU   4  77.255 -22.044  16.436
   30    HG2  GLU   4           HG2      GLU   4  76.094 -20.844  18.135
   31    HG3  GLU   4           HG1      GLU   4  75.166 -19.921  16.952
   32    HA   PRO   5           HA       PRO   5  76.938 -17.635  12.380
   33    HB2  PRO   5           HB2      PRO   5  76.328 -19.467  10.363
   34    HB3  PRO   5           HB1      PRO   5  77.941 -18.809  10.690
   35    HG2  PRO   5           HG2      PRO   5  76.773 -21.421  11.475
   36    HG3  PRO   5           HG1      PRO   5  78.429 -21.019  10.993
   37    HD2  PRO   5           HD2      PRO   5  77.752 -21.442  13.590
   38    HD3  PRO   5           HD1      PRO   5  79.017 -20.282  13.122
   39    HA   PRO   6           HA       PRO   6  72.518 -17.595  12.544
   40    HB2  PRO   6           HB2      PRO   6  71.859 -16.321  10.216
   41    HB3  PRO   6           HB1      PRO   6  72.609 -15.491  11.593
   42    HG2  PRO   6           HG2      PRO   6  73.859 -16.480   9.080
   43    HG3  PRO   6           HG1      PRO   6  74.159 -14.982   9.978
   44    HD2  PRO   6           HD2      PRO   6  75.804 -17.172  10.134
   45    HD3  PRO   6           HD1      PRO   6  75.613 -16.003  11.460
   46    H    LYS   7           HN       LYS   7  70.746 -18.857  11.939
   47    HA   LYS   7           HA       LYS   7  71.164 -21.195  10.367
   48    HB2  LYS   7           HB2      LYS   7  68.603 -19.806  11.209
   49    HB3  LYS   7           HB1      LYS   7  68.659 -21.408  10.475
   50    HG2  LYS   7           HG2      LYS   7  70.408 -20.895  12.846
   51    HG3  LYS   7           HG1      LYS   7  68.679 -21.109  13.124
   52    HD2  LYS   7           HD2      LYS   7  70.144 -23.051  11.362
   53    HD3  LYS   7           HD1      LYS   7  70.255 -23.212  13.115
   54    HE2  LYS   7           HE2      LYS   7  68.008 -23.718  13.351
   55    HE3  LYS   7           HE1      LYS   7  67.548 -22.829  11.900
   56    HZ1  LYS   7           HZ1      LYS   7  68.375 -25.572  12.190
   57    HZ2  LYS   7           HZ2      LYS   7  69.158 -24.755  10.923
   58    HZ3  LYS   7           HZ3      LYS   7  67.462 -24.838  10.963
   59    H    ALA   8           HN       ALA   8  68.790 -21.220   8.730
   60    HA   ALA   8           HA       ALA   8  69.475 -19.183   6.643
   61    HB1  ALA   8           HB1      ALA   8  69.267 -20.866   4.923
   62    HB2  ALA   8           HB2      ALA   8  68.735 -22.071   6.095
   63    HB3  ALA   8           HB3      ALA   8  70.396 -21.481   6.130
   64    H    GLU   9           HN       GLU   9  67.586 -18.057   7.606
   65    HA   GLU   9           HA       GLU   9  65.056 -19.060   6.396
   66    HB2  GLU   9           HB2      GLU   9  65.474 -18.248   9.280
   67    HB3  GLU   9           HB1      GLU   9  63.881 -18.240   8.522
   68    HG2  GLU   9           HG2      GLU   9  64.010 -20.602   8.055
   69    HG3  GLU   9           HG1      GLU   9  65.701 -20.662   8.554
   70    H1U  RCY  10           H1U      RCY  10  60.207 -10.794   5.242
   71    H1S  RCY  10           H1S      RCY  10  63.463 -12.035   2.169
   72    HB1  RCY  10           HB1      RCY  10  63.287 -15.447   3.410
   73    HB2  RCY  10           HB2      RCY  10  64.966 -15.975   3.289
   74    HA   RCY  10           HA       RCY  10  65.215 -14.683   5.581
   75    HN1  RCY  10           HN1      RCY  10  64.256 -17.448   5.146
   76    H    ARG  11           HN       ARG  11  63.536 -12.902   5.421
   77    HA   ARG  11           HA       ARG  11  61.700 -11.862   6.460
   78    HE   ARG  11           HE       ARG  11  58.071 -11.688   4.366
   79    HB2  ARG  11           HB2      ARG  11  60.463 -14.382   5.322
   80    HB3  ARG  11           HB1      ARG  11  59.513 -13.076   6.033
   81    HG2  ARG  11           HG2      ARG  11  60.400 -11.490   4.404
   82    HG3  ARG  11           HG1      ARG  11  61.458 -12.731   3.732
   83    HD2  ARG  11           HD2      ARG  11  59.571 -12.655   2.277
   84    HD3  ARG  11           HD1      ARG  11  59.336 -14.088   3.277
   85   HH11  ARG  11          HH21      ARG  11  57.846 -14.400   2.249
   86   HH12  ARG  11          HH22      ARG  11  56.115 -14.448   2.279
   87   HH21  ARG  11          HH11      ARG  11  55.812 -11.735   4.417
   88   HH22  ARG  11          HH12      ARG  11  54.963 -12.939   3.507
   89    H    SER  12           HN       SER  12  62.585 -12.119   8.627
   90    HA   SER  12           HA       SER  12  61.771 -14.480  10.185
   91    HG   SER  12           HG       SER  12  62.033 -13.861  12.429
   92    HB2  SER  12           HB2      SER  12  63.958 -13.465  10.629
   93    HB3  SER  12           HB1      SER  12  63.190 -11.924  10.996
   94    H    ALA  13           HN       ALA  13  60.925 -11.041   9.947
   95    HA   ALA  13           HA       ALA  13  58.247 -11.522  10.900
   96    HB1  ALA  13           HB1      ALA  13  60.109 -10.075  12.809
   97    HB2  ALA  13           HB2      ALA  13  59.474 -11.701  13.060
   98    HB3  ALA  13           HB3      ALA  13  58.377 -10.320  13.031
   99    H    THR  14           HN       THR  14  58.834 -10.313   8.631
  100    HA   THR  14           HA       THR  14  58.686  -8.315   7.402
  101    HB   THR  14           HB       THR  14  56.977  -6.820   8.126
  102    HG1  THR  14           HG1      THR  14  56.651  -6.355  10.172
  103   HG21  THR  14          HG21      THR  14  55.187  -8.300   8.722
  104   HG22  THR  14          HG22      THR  14  56.297  -9.435   9.489
  105   HG23  THR  14          HG23      THR  14  56.308  -9.239   7.736
  106    H    ARG  15           HN       ARG  15  61.086  -8.110   7.877
  107    HA   ARG  15           HA       ARG  15  62.235  -6.630   9.945
  108    HE   ARG  15           HE       ARG  15  63.755  -5.664   3.828
  109    HB2  ARG  15           HB2      ARG  15  63.939  -5.902   8.202
  110    HB3  ARG  15           HB1      ARG  15  63.663  -7.642   8.298
  111    HG2  ARG  15           HG2      ARG  15  62.225  -7.598   6.365
  112    HG3  ARG  15           HG1      ARG  15  62.218  -5.834   6.344
  113    HD2  ARG  15           HD2      ARG  15  64.710  -5.903   5.980
  114    HD3  ARG  15           HD1      ARG  15  64.581  -7.653   5.802
  115   HH11  ARG  15          HH21      ARG  15  63.345  -8.838   5.112
  116   HH12  ARG  15          HH22      ARG  15  62.723  -9.498   3.637
  117   HH21  ARG  15          HH11      ARG  15  62.945  -6.508   1.894
  118   HH22  ARG  15          HH12      ARG  15  62.496  -8.179   1.815
  119    H    VAL  16           HN       VAL  16  63.036  -4.312   9.832
  120    HA   VAL  16           HA       VAL  16  60.942  -2.462   9.763
  121    HB   VAL  16           HB       VAL  16  63.876  -1.958   9.176
  122   HG11  VAL  16          HG11      VAL  16  61.569  -0.122   9.852
  123   HG12  VAL  16          HG12      VAL  16  62.673  -0.018   8.480
  124   HG13  VAL  16          HG13      VAL  16  63.251   0.345  10.106
  125   HG21  VAL  16          HG21      VAL  16  62.261  -1.840  11.744
  126   HG22  VAL  16          HG22      VAL  16  63.955  -1.377  11.587
  127   HG23  VAL  16          HG23      VAL  16  63.473  -3.056  11.342
  128    H    MET  17           HN       MET  17  59.717  -1.737   8.097
  129    HA   MET  17           HA       MET  17  60.944  -1.059   5.524
  130    HB2  MET  17           HB2      MET  17  59.492  -2.558   4.199
  131    HB3  MET  17           HB1      MET  17  60.564  -3.482   5.252
  132    HG2  MET  17           HG2      MET  17  58.699  -3.587   6.939
  133    HG3  MET  17           HG1      MET  17  57.642  -2.843   5.739
  134    HE1  MET  17           HE1      MET  17  57.437  -3.534   3.484
  135    HE2  MET  17           HE2      MET  17  57.273  -5.199   2.933
  136    HE3  MET  17           HE3      MET  17  58.855  -4.423   2.912
  137    H    GLY  18           HN       GLY  18  58.226  -1.179   7.700
  138    HA2  GLY  18           HA2      GLY  18  56.319   0.179   7.859
  139    HA3  GLY  18           HA1      GLY  18  57.243   1.376   6.949
  140    H    GLY  19           HN       GLY  19  55.221   1.902   5.828
  141    HA2  GLY  19           HA2      GLY  19  53.975  -0.145   4.148
  142    HA3  GLY  19           HA1      GLY  19  53.555   1.569   4.176
  143    HA   PRO  20           HA       PRO  20  55.650   0.490   0.094
  144    HB2  PRO  20           HB2      PRO  20  53.876   2.817  -0.552
  145    HB3  PRO  20           HB1      PRO  20  54.186   1.342  -1.489
  146    HG2  PRO  20           HG2      PRO  20  51.927   1.667  -0.124
  147    HG3  PRO  20           HG1      PRO  20  52.715   0.085  -0.247
  148    HD2  PRO  20           HD2      PRO  20  52.575   1.938   2.086
  149    HD3  PRO  20           HD1      PRO  20  52.700   0.166   2.058
  150    H1U  RCY  21           H1U      RCY  21  61.757   0.453  -5.665
  151    H1S  RCY  21           H1S      RCY  21  62.141   2.142  -1.190
  152    HB1  RCY  21           HB1      RCY  21  60.195   3.878  -1.162
  153    HB2  RCY  21           HB2      RCY  21  59.235   2.710  -2.070
  154    HA   RCY  21           HA       RCY  21  58.444   3.869   0.621
  155    HN1  RCY  21           HN1      RCY  21  57.261   1.745  -1.006
  156    H    THR  22           HN       THR  22  58.431   6.066   0.155
  157    HA   THR  22           HA       THR  22  57.210   6.964  -2.406
  158    HB   THR  22           HB       THR  22  55.866   8.654  -1.025
  159    HG1  THR  22           HG1      THR  22  55.949   6.777   1.027
  160   HG21  THR  22          HG21      THR  22  54.061   6.993  -0.581
  161   HG22  THR  22          HG22      THR  22  55.225   5.696  -0.853
  162   HG23  THR  22          HG23      THR  22  54.795   6.785  -2.171
  163    HA   PRO  23           HA       PRO  23  60.743   9.660  -1.331
  164    HB2  PRO  23           HB2      PRO  23  61.822   9.823  -3.799
  165    HB3  PRO  23           HB1      PRO  23  62.022   8.377  -2.789
  166    HG2  PRO  23           HG2      PRO  23  60.228   8.820  -5.110
  167    HG3  PRO  23           HG1      PRO  23  61.085   7.356  -4.605
  168    HD2  PRO  23           HD2      PRO  23  58.372   7.915  -4.114
  169    HD3  PRO  23           HD1      PRO  23  59.337   6.662  -3.303
  170    H    ARG  24           HN       ARG  24  60.400  10.614  -4.627
  171    HA   ARG  24           HA       ARG  24  59.745  12.660  -5.573
  172    HE   ARG  24           HE       ARG  24  57.412   9.526  -7.748
  173    HB2  ARG  24           HB2      ARG  24  57.542  12.574  -3.495
  174    HB3  ARG  24           HB1      ARG  24  57.505  13.385  -5.059
  175    HG2  ARG  24           HG2      ARG  24  57.969  10.412  -4.890
  176    HG3  ARG  24           HG1      ARG  24  56.332  11.068  -4.845
  177    HD2  ARG  24           HD2      ARG  24  56.763  12.257  -6.977
  178    HD3  ARG  24           HD1      ARG  24  58.380  11.556  -7.029
  179   HH11  ARG  24          HH21      ARG  24  55.091  11.655  -6.344
  180   HH12  ARG  24          HH22      ARG  24  53.733  10.668  -6.768
  181   HH21  ARG  24          HH11      ARG  24  55.651   8.225  -8.310
  182   HH22  ARG  24          HH12      ARG  24  54.049   8.726  -7.881
  183    H    LYS  25           HN       LYS  25  61.397  12.544  -2.957
  184    HA   LYS  25           HA       LYS  25  60.746  14.967  -1.519
  185    HB2  LYS  25           HB2      LYS  25  62.219  12.920  -0.798
  186    HB3  LYS  25           HB1      LYS  25  63.516  13.788  -1.615
  187    HG2  LYS  25           HG2      LYS  25  63.713  14.662   0.530
  188    HG3  LYS  25           HG1      LYS  25  62.608  15.832  -0.193
  189    HD2  LYS  25           HD2      LYS  25  61.696  15.177   1.951
  190    HD3  LYS  25           HD1      LYS  25  60.692  14.458   0.692
  191    HE2  LYS  25           HE2      LYS  25  61.709  13.040   2.770
  192    HE3  LYS  25           HE1      LYS  25  61.348  12.328   1.198
  193    HZ1  LYS  25           HZ1      LYS  25  63.651  12.844   0.534
  194    HZ2  LYS  25           HZ2      LYS  25  63.565  11.747   1.829
  195    HZ3  LYS  25           HZ3      LYS  25  63.971  13.372   2.114
  196    H    GLY  26           HN       GLY  26  62.857  14.188  -4.244
  197    HA2  GLY  26           HA2      GLY  26  63.268  15.916  -5.951
  198    HA3  GLY  26           HA1      GLY  26  63.254  17.120  -4.661
  199    HA   PRO  27           HA       PRO  27  67.637  15.438  -5.995
  200    HB2  PRO  27           HB2      PRO  27  67.890  18.420  -6.150
  201    HB3  PRO  27           HB1      PRO  27  68.650  17.172  -7.157
  202    HG2  PRO  27           HG2      PRO  27  66.552  18.585  -8.011
  203    HG3  PRO  27           HG1      PRO  27  66.779  16.884  -8.450
  204    HD2  PRO  27           HD2      PRO  27  64.794  18.089  -6.603
  205    HD3  PRO  27           HD1      PRO  27  64.723  16.550  -7.489
  206    HA   PRO  28           HA       PRO  28  68.430  15.996  -1.548
  207    HB2  PRO  28           HB2      PRO  28  71.129  15.060  -2.435
  208    HB3  PRO  28           HB1      PRO  28  70.116  14.478  -1.100
  209    HG2  PRO  28           HG2      PRO  28  70.358  13.104  -3.370
  210    HG3  PRO  28           HG1      PRO  28  68.829  13.161  -2.477
  211    HD2  PRO  28           HD2      PRO  28  69.570  14.527  -5.028
  212    HD3  PRO  28           HD1      PRO  28  67.981  13.954  -4.473
  213    H    LYS  29           HN       LYS  29  70.045  17.261  -0.251
  214    HA   LYS  29           HA       LYS  29  70.922  19.655  -1.767
  215    HB2  LYS  29           HB2      LYS  29  70.527  19.029   1.159
  216    HB3  LYS  29           HB1      LYS  29  71.442  20.450   0.656
  217    HG2  LYS  29           HG2      LYS  29  69.100  21.067   0.996
  218    HG3  LYS  29           HG1      LYS  29  69.496  21.179  -0.719
  219    HD2  LYS  29           HD2      LYS  29  68.376  19.149  -1.224
  220    HD3  LYS  29           HD1      LYS  29  68.307  18.672   0.473
  221    HE2  LYS  29           HE2      LYS  29  66.114  19.511  -0.380
  222    HE3  LYS  29           HE1      LYS  29  66.738  20.475   0.958
  223    HZ1  LYS  29           HZ1      LYS  29  67.191  21.166  -1.888
  224    HZ2  LYS  29           HZ2      LYS  29  67.480  22.137  -0.525
  225    HZ3  LYS  29           HZ3      LYS  29  65.887  21.769  -0.986
  226    H1U  RCY  30           H1U      RCY  30  80.688  15.236  -1.634
  227    H1S  RCY  30           H1S      RCY  30  77.619  16.805   0.651
  228    HB1  RCY  30           HB1      RCY  30  75.070  20.217   0.588
  229    HB2  RCY  30           HB2      RCY  30  75.278  19.483  -1.001
  230    HA   RCY  30           HA       RCY  30  74.770  17.283  -0.116
  231    HN1  RCY  30           HN1      RCY  30  72.528  18.554   1.149
  232    H    LYS  31           HN       LYS  31  73.474  16.359   1.987
  233    HA   LYS  31           HA       LYS  31  75.340  16.842   4.264
  234    HB2  LYS  31           HB2      LYS  31  72.401  16.397   4.778
  235    HB3  LYS  31           HB1      LYS  31  73.616  17.087   5.850
  236    HG2  LYS  31           HG2      LYS  31  72.794  18.438   3.271
  237    HG3  LYS  31           HG1      LYS  31  71.970  18.748   4.800
  238    HD2  LYS  31           HD2      LYS  31  74.954  18.911   4.764
  239    HD3  LYS  31           HD1      LYS  31  74.046  20.232   4.027
  240    HE2  LYS  31           HE2      LYS  31  72.809  20.599   6.087
  241    HE3  LYS  31           HE1      LYS  31  73.558  19.186   6.831
  242    HZ1  LYS  31           HZ1      LYS  31  75.072  20.621   7.573
  243    HZ2  LYS  31           HZ2      LYS  31  74.593  21.844   6.494
  244    HZ3  LYS  31           HZ3      LYS  31  75.680  20.639   5.989
  245    H    GLN  32           HN       GLN  32  76.090  14.775   3.050
  246    HA   GLN  32           HA       GLN  32  75.091  12.483   4.577
  247    HB2  GLN  32           HB2      GLN  32  74.941  11.259   2.175
  248    HB3  GLN  32           HB1      GLN  32  73.542  12.010   2.941
  249    HG2  GLN  32           HG2      GLN  32  73.873  12.687   0.537
  250    HG3  GLN  32           HG1      GLN  32  73.851  14.043   1.666
  251   HE21  GLN  32          HE21      GLN  32  75.673  15.400   1.670
  252   HE22  GLN  32          HE22      GLN  32  77.128  15.053   0.869
  253    H    ARG  33           HN       ARG  33  77.296  12.475   5.323
  254    HA   ARG  33           HA       ARG  33  79.530  12.309   3.494
  255    HE   ARG  33           HE       ARG  33  79.007  12.639   8.732
  256    HB2  ARG  33           HB2      ARG  33  79.314  11.456   6.402
  257    HB3  ARG  33           HB1      ARG  33  80.818  11.615   5.498
  258    HG2  ARG  33           HG2      ARG  33  80.816  13.737   6.337
  259    HG3  ARG  33           HG1      ARG  33  79.682  14.052   5.023
  260    HD2  ARG  33           HD2      ARG  33  78.518  14.867   6.886
  261    HD3  ARG  33           HD1      ARG  33  77.875  13.232   6.729
  262   HH11  ARG  33          HH21      ARG  33  79.975  15.706   7.490
  263   HH12  ARG  33          HH22      ARG  33  80.869  16.146   8.907
  264   HH21  ARG  33          HH11      ARG  33  80.168  13.196  10.589
  265   HH22  ARG  33          HH12      ARG  33  80.978  14.725  10.661
  266    H    GLN  34           HN       GLN  34  80.823   9.983   4.784
  267    HA   GLN  34           HA       GLN  34  79.182   7.655   4.334
  268    HB2  GLN  34           HB2      GLN  34  80.097   6.846   2.269
  269    HB3  GLN  34           HB1      GLN  34  79.565   8.499   1.973
  270    HG2  GLN  34           HG2      GLN  34  82.386   7.493   2.383
  271    HG3  GLN  34           HG1      GLN  34  81.736   8.385   1.007
  272   HE21  GLN  34          HE21      GLN  34  83.800   8.881   3.467
  273   HE22  GLN  34          HE22      GLN  34  83.475  10.506   3.835
  274    H    THR  35           HN       THR  35  80.011   6.409   5.916
  275    HA   THR  35           HA       THR  35  82.839   5.665   5.836
  276    HB   THR  35           HB       THR  35  83.137   6.296   8.300
  277    HG1  THR  35           HG1      THR  35  81.313   8.326   7.962
  278   HG21  THR  35          HG21      THR  35  82.736   8.710   6.538
  279   HG22  THR  35          HG22      THR  35  84.024   7.548   6.219
  280   HG23  THR  35          HG23      THR  35  83.988   8.428   7.747
  281    H    ARG  36           HN       ARG  36  82.718   3.482   6.126
  282    HA   ARG  36           HA       ARG  36  81.763   2.198   8.415
  283    HE   ARG  36           HE       ARG  36  81.434   0.611   8.490
  284    HB2  ARG  36           HB2      ARG  36  79.508   2.439   8.218
  285    HB3  ARG  36           HB1      ARG  36  79.628   2.950   6.540
  286    HG2  ARG  36           HG2      ARG  36  78.482   0.891   6.390
  287    HG3  ARG  36           HG1      ARG  36  80.154   0.447   6.043
  288    HD2  ARG  36           HD2      ARG  36  78.569   0.000   8.562
  289    HD3  ARG  36           HD1      ARG  36  79.527  -1.156   7.637
  290   HH11  ARG  36          HH21      ARG  36  78.821  -1.039  10.019
  291   HH12  ARG  36          HH22      ARG  36  79.608  -1.136  11.559
  292   HH21  ARG  36          HH11      ARG  36  82.477   0.495  10.492
  293   HH22  ARG  36          HH12      ARG  36  81.678  -0.267  11.827
  294    H    GLN  37           HN       GLN  37  82.175   2.053   4.930
  295    HA   GLN  37           HA       GLN  37  83.333   0.475   3.637
  296    HB2  GLN  37           HB2      GLN  37  84.716   0.339   5.868
  297    HB3  GLN  37           HB1      GLN  37  83.881  -1.195   6.083
  298    HG2  GLN  37           HG2      GLN  37  84.623  -1.797   3.724
  299    HG3  GLN  37           HG1      GLN  37  85.666  -0.376   3.784
  300   HE21  GLN  37          HE21      GLN  37  85.549  -1.366   6.928
  301   HE22  GLN  37          HE22      GLN  37  86.888  -2.408   6.959
  302    H1U  RCY  38           H1U      RCY  38  80.875  -4.122  -2.341
  303    H1S  RCY  38           H1S      RCY  38  80.292  -6.053   1.409
  304    HB1  RCY  38           HB1      RCY  38  82.260  -4.206   3.718
  305    HB2  RCY  38           HB2      RCY  38  81.111  -3.184   2.858
  306    HA   RCY  38           HA       RCY  38  79.935  -2.685   4.937
  307    HN1  RCY  38           HN1      RCY  38  82.547  -2.051   5.942
  308    H    LYS  39           HN       LYS  39  82.882  -4.550   5.754
  309    HA   LYS  39           HA       LYS  39  82.292  -5.142   8.418
  310    HB2  LYS  39           HB2      LYS  39  80.519  -6.538   6.581
  311    HB3  LYS  39           HB1      LYS  39  81.503  -7.697   7.468
  312    HG2  LYS  39           HG2      LYS  39  80.086  -5.422   8.862
  313    HG3  LYS  39           HG1      LYS  39  79.297  -6.973   8.572
  314    HD2  LYS  39           HD2      LYS  39  80.677  -8.110  10.039
  315    HD3  LYS  39           HD1      LYS  39  82.022  -6.992   9.804
  316    HE2  LYS  39           HE2      LYS  39  81.053  -6.699  12.044
  317    HE3  LYS  39           HE1      LYS  39  80.784  -5.256  11.067
  318    HZ1  LYS  39           HZ1      LYS  39  78.575  -5.639  10.937
  319    HZ2  LYS  39           HZ2      LYS  39  78.853  -6.448  12.405
  320    HZ3  LYS  39           HZ3      LYS  39  78.737  -7.327  10.956
  321    H    SER  40           HN       SER  40  84.647  -4.837   7.924
  322    HA   SER  40           HA       SER  40  86.811  -5.716   7.707
  323    HG   SER  40           HG       SER  40  86.007  -7.787  10.302
  324    HB2  SER  40           HB2      SER  40  85.585  -8.463   7.920
  325    HB3  SER  40           HB1      SER  40  87.151  -7.910   8.507
  326    H    LYS  41           HN       LYS  41  88.172  -6.987   6.185
  327    HA   LYS  41           HA       LYS  41  87.616  -6.668   3.518
  328    HB2  LYS  41           HB2      LYS  41  89.054  -9.079   4.659
  329    HB3  LYS  41           HB1      LYS  41  89.234  -8.431   3.030
  330    HG2  LYS  41           HG2      LYS  41  90.965  -7.249   3.913
  331    HG3  LYS  41           HG1      LYS  41  89.704  -6.202   4.564
  332    HD2  LYS  41           HD2      LYS  41  89.641  -7.880   6.548
  333    HD3  LYS  41           HD1      LYS  41  91.213  -8.412   5.949
  334    HE2  LYS  41           HE2      LYS  41  90.432  -5.661   6.928
  335    HE3  LYS  41           HE1      LYS  41  91.694  -6.720   7.557
  336    HZ1  LYS  41           HZ1      LYS  41  93.127  -6.083   5.981
  337    HZ2  LYS  41           HZ2      LYS  41  92.106  -4.737   5.797
  338    HZ3  LYS  41           HZ3      LYS  41  91.953  -6.071   4.756
  339    HA   PRO  42           HA       PRO  42  84.144  -9.603   3.297
  340    HB2  PRO  42           HB2      PRO  42  82.999  -8.561   1.051
  341    HB3  PRO  42           HB1      PRO  42  82.795  -7.838   2.658
  342    HG2  PRO  42           HG2      PRO  42  84.547  -6.997   0.416
  343    HG3  PRO  42           HG1      PRO  42  83.669  -6.013   1.596
  344    HD2  PRO  42           HD2      PRO  42  86.389  -6.581   1.728
  345    HD3  PRO  42           HD1      PRO  42  85.393  -6.077   3.110
  346    HA   PRO  43           HA       PRO  43  85.282 -12.874   0.564
  347    HB2  PRO  43           HB2      PRO  43  82.825 -12.170  -1.020
  348    HB3  PRO  43           HB1      PRO  43  83.407 -13.765  -0.499
  349    HG2  PRO  43           HG2      PRO  43  81.444 -12.463   0.788
  350    HG3  PRO  43           HG1      PRO  43  82.597 -13.514   1.626
  351    HD2  PRO  43           HD2      PRO  43  82.340 -10.584   1.755
  352    HD3  PRO  43           HD1      PRO  43  83.208 -11.683   2.848
  353    H    LYS  44           HN       LYS  44  85.942 -13.291  -1.723
  354    HA   LYS  44           HA       LYS  44  87.653 -11.658  -2.940
  355    HB2  LYS  44           HB2      LYS  44  86.892 -12.461  -5.188
  356    HB3  LYS  44           HB1      LYS  44  87.058 -13.746  -3.996
  357    HG2  LYS  44           HG2      LYS  44  84.932 -14.326  -4.508
  358    HG3  LYS  44           HG1      LYS  44  84.436 -12.865  -3.652
  359    HD2  LYS  44           HD2      LYS  44  83.436 -12.596  -5.761
  360    HD3  LYS  44           HD1      LYS  44  84.924 -11.660  -5.911
  361    HE2  LYS  44           HE2      LYS  44  86.031 -13.506  -7.041
  362    HE3  LYS  44           HE1      LYS  44  84.634 -14.550  -6.779
  363    HZ1  LYS  44           HZ1      LYS  44  83.767 -13.781  -8.646
  364    HZ2  LYS  44           HZ2      LYS  44  85.095 -12.747  -8.877
  365    HZ3  LYS  44           HZ3      LYS  44  83.739 -12.210  -8.005
  366    H    LYS  45           HN       LYS  45  87.714  -9.567  -3.491
  367    HA   LYS  45           HA       LYS  45  85.159  -8.202  -4.255
  368    HB2  LYS  45           HB2      LYS  45  86.334  -7.435  -2.139
  369    HB3  LYS  45           HB1      LYS  45  87.676  -6.918  -3.158
  370    HG2  LYS  45           HG2      LYS  45  86.447  -5.207  -4.150
  371    HG3  LYS  45           HG1      LYS  45  84.903  -6.004  -3.848
  372    HD2  LYS  45           HD2      LYS  45  85.129  -4.081  -2.356
  373    HD3  LYS  45           HD1      LYS  45  85.191  -5.569  -1.411
  374    HE2  LYS  45           HE2      LYS  45  86.960  -3.995  -0.705
  375    HE3  LYS  45           HE1      LYS  45  87.654  -5.464  -1.393
  376    HZ1  LYS  45           HZ1      LYS  45  88.226  -4.386  -3.338
  377    HZ2  LYS  45           HZ2      LYS  45  88.541  -3.198  -2.165
  378    HZ3  LYS  45           HZ3      LYS  45  87.124  -3.119  -3.098
  379    H    GLY  46           HN       GLY  46  86.400  -9.565  -6.279
  380    HA2  GLY  46           HA2      GLY  46  88.348  -7.902  -7.668
  381    HA3  GLY  46           HA1      GLY  46  87.546  -9.327  -8.330
  382    H    VAL  47           HN       VAL  47  85.482  -9.073  -9.328
  383    HA   VAL  47           HA       VAL  47  84.277  -7.869 -10.999
  384    HB   VAL  47           HB       VAL  47  82.762  -6.182  -9.752
  385   HG11  VAL  47          HG11      VAL  47  82.056  -8.467 -10.228
  386   HG12  VAL  47          HG12      VAL  47  81.586  -8.054  -8.579
  387   HG13  VAL  47          HG13      VAL  47  82.997  -9.073  -8.865
  388   HG21  VAL  47          HG21      VAL  47  82.851  -6.315  -7.312
  389   HG22  VAL  47          HG22      VAL  47  84.412  -5.766  -7.922
  390   HG23  VAL  47          HG23      VAL  47  84.208  -7.438  -7.397
  391    H    GLN  48           HN       GLN  48  86.271  -6.909 -11.975
  392    HA   GLN  48           HA       GLN  48  87.437  -5.064 -12.831
  393    HB2  GLN  48           HB2      GLN  48  85.088  -3.429 -11.849
  394    HB3  GLN  48           HB1      GLN  48  86.155  -3.081 -13.209
  395    HG2  GLN  48           HG2      GLN  48  84.245  -5.429 -13.020
  396    HG3  GLN  48           HG1      GLN  48  84.007  -3.985 -14.004
  397   HE21  GLN  48          HE21      GLN  48  86.200  -6.795 -13.591
  398   HE22  GLN  48          HE22      GLN  48  86.760  -6.789 -15.193
  399    H    GLY  49           HN       GLY  49  88.005  -5.838 -10.114
  400    HA2  GLY  49           HA2      GLY  49  88.981  -5.002  -8.141
  401    HA3  GLY  49           HA1      GLY  49  89.690  -3.812  -9.233
  402    H1U  RCY  50           H1U      RCY  50  79.558  -0.060  -5.036
  403    H1S  RCY  50           H1S      RCY  50  82.610  -1.222  -8.485
  404    HB1  RCY  50           HB1      RCY  50  83.997  -2.423  -6.109
  405    HB2  RCY  50           HB2      RCY  50  84.631  -4.054  -6.325
  406    HA   RCY  50           HA       RCY  50  85.930  -1.616  -7.563
  407    HN1  RCY  50           HN1      RCY  50  86.634  -4.471  -7.492
  408    H    GLY  51           HN       GLY  51  87.370  -0.461  -6.283
  409    HA2  GLY  51           HA2      GLY  51  87.056  -0.640  -3.418
  410    HA3  GLY  51           HA1      GLY  51  88.627  -1.269  -3.919
  411    H    ASP  52           HN       ASP  52  88.583   0.967  -2.322
  412    HA   ASP  52           HA       ASP  52  89.719   2.995  -4.159
  413    HB2  ASP  52           HB2      ASP  52  87.429   3.767  -3.906
  414    HB3  ASP  52           HB1      ASP  52  87.514   3.569  -2.156
  415    H    ASP  53           HN       ASP  53  91.557   1.834  -2.986
  416    HA   ASP  53           HA       ASP  53  93.249   1.856  -1.362
  417    HB2  ASP  53           HB2      ASP  53  92.068   4.587  -0.758
  418    HB3  ASP  53           HB1      ASP  53  93.670   4.022  -0.283
  419    H    ILE  54           HN       ILE  54  91.700   3.944   0.862
  420    HA   ILE  54           HA       ILE  54  90.693   1.598   2.433
  421    HB   ILE  54           HB       ILE  54  92.092   4.047   3.554
  422   HG12  ILE  54          HG12      ILE  54  93.438   2.247   2.182
  423   HG13  ILE  54          HG11      ILE  54  94.057   2.793   3.741
  424   HG21  ILE  54          HG21      ILE  54  92.163   2.475   5.595
  425   HG22  ILE  54          HG22      ILE  54  90.941   1.524   4.752
  426   HG23  ILE  54          HG23      ILE  54  90.604   3.197   5.197
  427   HD11  ILE  54          HD11      ILE  54  92.231   0.399   3.516
  428   HD12  ILE  54          HD12      ILE  54  93.291   0.843   4.853
  429   HD13  ILE  54          HD13      ILE  54  93.979   0.248   3.343
  430    HA   PRO  55           HA       PRO  55  87.398   4.815   2.169
  431    HB2  PRO  55           HB2      PRO  55  85.509   3.371   0.918
  432    HB3  PRO  55           HB1      PRO  55  86.870   4.074   0.021
  433    HG2  PRO  55           HG2      PRO  55  86.430   1.267   0.878
  434    HG3  PRO  55           HG1      PRO  55  87.179   1.896  -0.598
  435    HD2  PRO  55           HD2      PRO  55  88.557   0.972   1.679
  436    HD3  PRO  55           HD1      PRO  55  89.256   1.932   0.357
  437    H    GLY  56           HN       GLY  56  84.999   4.558   2.956
  438    HA2  GLY  56           HA2      GLY  56  83.457   3.788   4.557
  439    HA3  GLY  56           HA1      GLY  56  84.384   2.291   4.656
  440    H    MET  57           HN       MET  57  86.782   2.924   5.616
  441    HA   MET  57           HA       MET  57  87.898   3.460   7.610
  442    HB2  MET  57           HB2      MET  57  87.311   5.780   6.600
  443    HB3  MET  57           HB1      MET  57  86.053   5.842   7.832
  444    HG2  MET  57           HG2      MET  57  87.970   5.199   9.483
  445    HG3  MET  57           HG1      MET  57  89.040   5.751   8.194
  446    HE1  MET  57           HE1      MET  57  89.045   7.882   7.114
  447    HE2  MET  57           HE2      MET  57  88.279   9.379   7.640
  448    HE3  MET  57           HE3      MET  57  87.321   8.146   6.825
  449    H    GLU  58           HN       GLU  58  84.732   4.862   8.465
  450    HA   GLU  58           HA       GLU  58  83.518   2.778   9.828
  451    HB2  GLU  58           HB2      GLU  58  84.299   3.402  12.246
  452    HB3  GLU  58           HB1      GLU  58  85.300   2.316  11.288
  453    HG2  GLU  58           HG2      GLU  58  86.984   3.843  11.074
  454    HG3  GLU  58           HG1      GLU  58  85.865   5.196  10.905
  455    H    GLY  59           HN       GLY  59  81.526   3.602  10.333
  456    HA2  GLY  59           HA2      GLY  59  80.756   5.671  11.906
  457    HA3  GLY  59           HA1      GLY  59  81.205   6.529  10.432
  458    H1U  RCY  60           H1U      RCY  60  76.309   7.012   1.621
  459    H1S  RCY  60           H1S      RCY  60  74.740   5.364   5.562
  460    HB1  RCY  60           HB1      RCY  60  78.258   4.378   8.018
  461    HB2  RCY  60           HB2      RCY  60  78.028   5.859   7.092
  462    HA   RCY  60           HA       RCY  60  76.968   6.955   8.941
  463    HN1  RCY  60           HN1      RCY  60  79.129   7.166   9.825
  464    H    GLY  61           HN       GLY  61  77.427   3.501   9.617
  465    HA2  GLY  61           HA2      GLY  61  76.475   2.209  11.390
  466    HA3  GLY  61           HA1      GLY  61  75.676   3.665  11.989
  467    H    THR  62           HN       THR  62  75.427   3.123   8.626
  468    HA   THR  62           HA       THR  62  73.550   2.748   7.276
  469    HB   THR  62           HB       THR  62  72.206   0.676   8.044
  470    HG1  THR  62           HG1      THR  62  74.420   0.416   9.776
  471   HG21  THR  62          HG21      THR  62  74.058  -0.822   7.382
  472   HG22  THR  62          HG22      THR  62  75.202   0.500   7.617
  473   HG23  THR  62          HG23      THR  62  73.983   0.604   6.347
  474    H    ASP  63           HN       ASP  63  73.233   4.124  10.216
  475    HA   ASP  63           HA       ASP  63  70.387   3.891  10.673
  476    HB2  ASP  63           HB2      ASP  63  72.465   5.906  11.559
  477    HB3  ASP  63           HB1      ASP  63  70.769   6.025  12.029
  478    H    ILE  64           HN       ILE  64  70.566   4.284   7.981
  479    HA   ILE  64           HA       ILE  64  69.842   5.673   6.230
  480    HB   ILE  64           HB       ILE  64  68.403   6.698   8.668
  481   HG12  ILE  64          HG12      ILE  64  66.452   5.891   7.425
  482   HG13  ILE  64          HG11      ILE  64  67.458   5.571   6.012
  483   HG21  ILE  64          HG21      ILE  64  68.714   8.751   7.502
  484   HG22  ILE  64          HG22      ILE  64  67.113   8.189   7.022
  485   HG23  ILE  64          HG23      ILE  64  68.484   7.982   5.932
  486   HD11  ILE  64          HD11      ILE  64  67.923   4.283   8.714
  487   HD12  ILE  64          HD12      ILE  64  68.686   3.858   7.181
  488   HD13  ILE  64          HD13      ILE  64  66.971   3.535   7.432
  489    H    THR  65           HN       THR  65  72.009   6.583   8.497
  490    HA   THR  65           HA       THR  65  73.237   8.581   8.909
  491    HB   THR  65           HB       THR  65  74.509   7.424   7.175
  492    HG1  THR  65           HG1      THR  65  74.230  10.201   7.097
  493   HG21  THR  65          HG21      THR  65  74.097   8.085   4.770
  494   HG22  THR  65          HG22      THR  65  72.603   8.852   5.307
  495   HG23  THR  65          HG23      THR  65  72.816   7.111   5.492
  496    H    VAL  66           HN       VAL  66  70.601   9.303   8.867
  497    HA   VAL  66           HA       VAL  66  69.311  11.250   8.709
  498    HB   VAL  66           HB       VAL  66  71.605  12.563   7.245
  499   HG11  VAL  66          HG11      VAL  66  70.701  14.579   8.159
  500   HG12  VAL  66          HG12      VAL  66  69.665  13.689   9.275
  501   HG13  VAL  66          HG13      VAL  66  69.322  13.667   7.545
  502   HG21  VAL  66          HG21      VAL  66  72.181  13.287   9.710
  503   HG22  VAL  66          HG22      VAL  66  72.772  11.742   9.098
  504   HG23  VAL  66          HG23      VAL  66  71.350  11.792  10.139
  505    H    ILE  67           HN       ILE  67  71.309  10.898   5.753
  506    HA   ILE  67           HA       ILE  67  68.770  10.746   4.190
  507    HB   ILE  67           HB       ILE  67  71.178  12.464   3.525
  508   HG12  ILE  67          HG12      ILE  67  68.281  13.246   3.953
  509   HG13  ILE  67          HG11      ILE  67  69.501  13.325   5.224
  510   HG21  ILE  67          HG21      ILE  67  69.666  13.140   1.574
  511   HG22  ILE  67          HG22      ILE  67  68.712  11.704   1.948
  512   HG23  ILE  67          HG23      ILE  67  70.401  11.540   1.466
  513   HD11  ILE  67          HD11      ILE  67  69.589  14.790   2.570
  514   HD12  ILE  67          HD12      ILE  67  70.869  14.822   3.783
  515   HD13  ILE  67          HD13      ILE  67  69.289  15.515   4.150
  516    H1U  RCY  68           H1U      RCY  68  73.253   0.858   1.189
  517    H1S  RCY  68           H1S      RCY  68  71.588   4.390   2.161
  518    HB1  RCY  68           HB1      RCY  68  69.799   5.485   2.483
  519    HB2  RCY  68           HB2      RCY  68  69.291   6.330   3.943
  520    HA   RCY  68           HA       RCY  68  71.651   7.561   2.721
  521    HN1  RCY  68           HN1      RCY  68  69.112   8.476   3.896
  522    HA   PRO  69           HA       PRO  69  70.414   8.111  -1.491
  523    HB2  PRO  69           HB2      PRO  69  71.643   5.946  -2.680
  524    HB3  PRO  69           HB1      PRO  69  72.499   7.416  -2.176
  525    HG2  PRO  69           HG2      PRO  69  72.299   4.786  -0.802
  526    HG3  PRO  69           HG1      PRO  69  73.681   5.885  -0.947
  527    HD2  PRO  69           HD2      PRO  69  72.179   5.720   1.324
  528    HD3  PRO  69           HD1      PRO  69  72.975   7.225   0.813
  529    H    TRP  70           HN       TRP  70  69.207   5.656   0.403
  530    HA   TRP  70           HA       TRP  70  67.863   4.117  -1.690
  531    HD1  TRP  70           HD1      TRP  70  67.672   6.330   1.350
  532    HE1  TRP  70           HE1      TRP  70  66.299   6.731   3.493
  533    HE3  TRP  70           HE3      TRP  70  65.807   1.635   2.091
  534    HZ2  TRP  70           HZ2      TRP  70  64.626   5.253   5.289
  535    HZ3  TRP  70           HZ3      TRP  70  64.330   1.159   4.019
  536    HH2  TRP  70           HH2      TRP  70  63.737   2.957   5.618
  537    HB2  TRP  70           HB2      TRP  70  66.958   2.812   0.062
  538    HB3  TRP  70           HB1      TRP  70  68.551   3.277   0.652
  539    H    GLU  71           HN       GLU  71  67.372   7.164  -0.420
  540    HA   GLU  71           HA       GLU  71  64.501   7.098  -1.256
  541    HB2  GLU  71           HB2      GLU  71  65.702   8.233   1.266
  542    HB3  GLU  71           HB1      GLU  71  64.235   8.936   0.586
  543    HG2  GLU  71           HG2      GLU  71  63.117   6.758   0.670
  544    HG3  GLU  71           HG1      GLU  71  64.592   6.004   1.277
  545    H    ALA  72           HN       ALA  72  67.585   8.453  -1.513
  546    HA   ALA  72           HA       ALA  72  66.970  11.179  -2.123
  547    HB1  ALA  72           HB1      ALA  72  69.149  11.089  -3.409
  548    HB2  ALA  72           HB2      ALA  72  69.214   9.365  -3.046
  549    HB3  ALA  72           HB3      ALA  72  69.266  10.544  -1.736
  550    H1U  RCY  73           H1U      RCY  73  67.676   6.672  -2.948
  551    H1S  RCY  73           H1S      RCY  73  70.283  10.357  -4.635
  552    HB1  RCY  73           HB1      RCY  73  67.598  11.628  -7.935
  553    HB2  RCY  73           HB2      RCY  73  68.371  10.052  -8.095
  554    HA   RCY  73           HA       RCY  73  66.099  10.764  -6.488
  555    HN1  RCY  73           HN1      RCY  73  68.508  10.402  -4.873
  556    H    ASN  74           HN       ASN  74  64.847   8.889  -6.287
  557    HA   ASN  74           HA       ASN  74  65.938   6.226  -6.460
  558    HB2  ASN  74           HB2      ASN  74  63.095   7.055  -7.097
  559    HB3  ASN  74           HB1      ASN  74  63.654   5.482  -6.526
  560   HD21  ASN  74          HD21      ASN  74  64.096   5.237  -4.254
  561   HD22  ASN  74          HD22      ASN  74  63.741   6.449  -3.121
  562    H    HIS  75           HN       HIS  75  66.812   7.964  -8.640
  563    HA   HIS  75           HA       HIS  75  65.387   6.981 -11.028
  564    HD1  HIS  75           HD1      HIS  75  64.621   8.005 -12.745
  565    HD2  HIS  75           HD2      HIS  75  68.574   8.964 -13.670
  566    HE1  HIS  75           HE1      HIS  75  64.753   8.134 -15.271
  567    HE2  HIS  75           HE2      HIS  75  67.154   8.718 -15.847
  568    HB2  HIS  75           HB2      HIS  75  66.422   9.331 -10.755
  569    HB3  HIS  75           HB1      HIS  75  67.978   8.539 -11.003
  570    H1U  RCY  76           H1U      RCY  76  71.893  -0.276  -5.461
  571    H1S  RCY  76           H1S      RCY  76  69.727   3.142  -6.480
  572    HB1  RCY  76           HB1      RCY  76  69.553   4.542  -8.250
  573    HB2  RCY  76           HB2      RCY  76  70.005   2.996  -8.966
  574    HA   RCY  76           HA       RCY  76  69.387   4.430 -10.786
  575    HN1  RCY  76           HN1      RCY  76  67.325   5.454  -8.996
  576    H    GLU  77           HN       GLU  77  67.022   4.134 -12.138
  577    HA   GLU  77           HA       GLU  77  65.778   1.558 -11.683
  578    HB2  GLU  77           HB2      GLU  77  64.863   3.630 -12.978
  579    HB3  GLU  77           HB1      GLU  77  65.774   2.979 -14.341
  580    HG2  GLU  77           HG2      GLU  77  64.599   0.777 -13.969
  581    HG3  GLU  77           HG1      GLU  77  63.577   1.592 -12.784
  582    H    LEU  78           HN       LEU  78  68.682   1.436 -11.838
  583    HA   LEU  78           HA       LEU  78  69.343   0.256 -14.438
  584    HG   LEU  78           HG       LEU  78  71.446   1.511 -14.667
  585    HB2  LEU  78           HB2      LEU  78  70.827   0.620 -11.834
  586    HB3  LEU  78           HB1      LEU  78  71.497  -0.366 -13.134
  587   HD11  LEU  78          HD11      LEU  78  69.946   2.847 -12.411
  588   HD12  LEU  78          HD12      LEU  78  69.449   2.657 -14.092
  589   HD13  LEU  78          HD13      LEU  78  70.740   3.784 -13.676
  590   HD21  LEU  78          HD21      LEU  78  73.442   1.511 -13.369
  591   HD22  LEU  78          HD22      LEU  78  72.602   2.102 -11.936
  592   HD23  LEU  78          HD23      LEU  78  72.865   3.176 -13.310
  593    H    HIS  79           HN       HIS  79  70.042  -2.030 -14.638
  594    HA   HIS  79           HA       HIS  79  69.476  -3.910 -12.505
  595    HD1  HIS  79           HD1      HIS  79  67.082  -5.461 -11.496
  596    HD2  HIS  79           HD2      HIS  79  67.685  -6.464 -15.500
  597    HE1  HIS  79           HE1      HIS  79  66.712  -7.960 -11.670
  598    HE2  HIS  79           HE2      HIS  79  67.076  -8.584 -14.103
  599    HB2  HIS  79           HB2      HIS  79  67.162  -3.403 -13.103
  600    HB3  HIS  79           HB1      HIS  79  67.507  -3.716 -14.804
  601    H    GLU  80           HN       GLU  80  70.284  -3.201 -15.828
  602    HA   GLU  80           HA       GLU  80  71.905  -5.671 -15.897
  603    HB2  GLU  80           HB2      GLU  80  71.010  -6.335 -18.109
  604    HB3  GLU  80           HB1      GLU  80  69.764  -6.384 -16.863
  605    HG2  GLU  80           HG2      GLU  80  68.659  -5.242 -18.573
  606    HG3  GLU  80           HG1      GLU  80  69.308  -3.905 -17.622
  607    H    LEU  81           HN       LEU  81  71.458  -2.404 -16.635
  608    HA   LEU  81           HA       LEU  81  73.418  -2.426 -18.857
  609    HG   LEU  81           HG       LEU  81  71.836  -0.472 -16.315
  610    HB2  LEU  81           HB2      LEU  81  73.083   0.146 -18.616
  611    HB3  LEU  81           HB1      LEU  81  71.763  -0.814 -19.280
  612   HD11  LEU  81          HD11      LEU  81  70.472   1.698 -16.732
  613   HD12  LEU  81          HD12      LEU  81  71.275   1.726 -18.302
  614   HD13  LEU  81          HD13      LEU  81  72.231   1.798 -16.822
  615   HD21  LEU  81          HD21      LEU  81  69.534  -0.215 -18.261
  616   HD22  LEU  81          HD22      LEU  81  69.469  -0.630 -16.548
  617   HD23  LEU  81          HD23      LEU  81  70.121  -1.785 -17.711
  618    H    ALA  82           HN       ALA  82  73.315  -2.064 -15.436
  619    HA   ALA  82           HA       ALA  82  75.677  -0.436 -15.110
  620    HB1  ALA  82           HB1      ALA  82  73.933  -0.908 -13.328
  621    HB2  ALA  82           HB2      ALA  82  75.603  -1.105 -12.797
  622    HB3  ALA  82           HB3      ALA  82  74.626  -2.522 -13.181
  623    H    GLN  83           HN       GLN  83  75.496  -3.212 -16.711
  624    HA   GLN  83           HA       GLN  83  77.599  -4.793 -15.481
  625    HB2  GLN  83           HB2      GLN  83  76.346  -4.817 -18.237
  626    HB3  GLN  83           HB1      GLN  83  77.586  -5.965 -17.732
  627    HG2  GLN  83           HG2      GLN  83  75.120  -5.557 -16.054
  628    HG3  GLN  83           HG1      GLN  83  75.082  -6.638 -17.447
  629   HE21  GLN  83          HE21      GLN  83  76.058  -6.370 -14.140
  630   HE22  GLN  83          HE22      GLN  83  76.880  -7.852 -14.037
  631    H    TYR  84           HN       TYR  84  78.319  -2.017 -15.882
  632    HA   TYR  84           HA       TYR  84  80.814  -2.457 -17.409
  633    HD1  TYR  84           HD2      TYR  84  78.319  -2.751 -19.762
  634    HD2  TYR  84           HD1      TYR  84  81.977  -0.500 -19.677
  635    HE1  TYR  84           HE2      TYR  84  79.051  -3.861 -21.856
  636    HE2  TYR  84           HE1      TYR  84  82.709  -1.611 -21.770
  637    HH   TYR  84           HH       TYR  84  81.567  -2.742 -23.745
  638    HB2  TYR  84           HB2      TYR  84  78.581  -0.769 -18.316
  639    HB3  TYR  84           HB1      TYR  84  80.113   0.098 -18.241
  640    H    GLY  85           HN       GLY  85  79.079  -1.090 -14.840
  641    HA2  GLY  85           HA2      GLY  85  79.899   0.026 -12.933
  642    HA3  GLY  85           HA1      GLY  85  81.512  -0.042 -13.645
  643    H    ILE  86           HN       ILE  86  80.756   1.272 -16.133
  644    HA   ILE  86           HA       ILE  86  80.866   4.043 -15.168
  645    HB   ILE  86           HB       ILE  86  80.713   3.146 -18.054
  646   HG12  ILE  86          HG12      ILE  86  82.494   1.951 -16.570
  647   HG13  ILE  86          HG11      ILE  86  83.025   2.695 -18.079
  648   HG21  ILE  86          HG21      ILE  86  81.729   5.567 -16.567
  649   HG22  ILE  86          HG22      ILE  86  80.573   5.501 -17.898
  650   HG23  ILE  86          HG23      ILE  86  82.284   5.200 -18.201
  651   HD11  ILE  86          HD11      ILE  86  84.017   4.511 -16.989
  652   HD12  ILE  86          HD12      ILE  86  84.360   3.185 -15.877
  653   HD13  ILE  86          HD13      ILE  86  83.037   4.301 -15.538
  654    H1U  RCY  87           H1U      RCY  87  78.208   0.249  -8.290
  655    H1S  RCY  87           H1S      RCY  87  77.537   2.992 -11.618
  656    HB1  RCY  87           HB1      RCY  87  74.908   3.092 -14.458
  657    HB2  RCY  87           HB2      RCY  87  75.920   4.168 -13.495
  658    HA   RCY  87           HA       RCY  87  76.311   3.197 -16.301
  659    HN1  RCY  87           HN1      RCY  87  78.442   2.959 -14.464
  Start of MODEL   36
    1    HA   MET   1           HA       MET   1  60.699  -6.033  26.203
    2    HB2  MET   1           HB2      MET   1  61.214  -6.924  28.545
    3    HB3  MET   1           HB1      MET   1  62.425  -5.647  28.656
    4    HG2  MET   1           HG2      MET   1  60.442  -4.097  27.884
    5    HG3  MET   1           HG1      MET   1  59.437  -5.411  28.494
    6    HE1  MET   1           HE1      MET   1  61.537  -6.430  31.076
    7    HE2  MET   1           HE2      MET   1  59.867  -6.595  30.537
    8    HE3  MET   1           HE3      MET   1  60.215  -5.832  32.087
    9    H    ASN   2           HN       ASN   2  64.087  -5.255  27.072
   10    HA   ASN   2           HA       ASN   2  63.848  -2.462  26.452
   11    HB2  ASN   2           HB2      ASN   2  66.420  -2.663  26.233
   12    HB3  ASN   2           HB1      ASN   2  65.703  -3.048  27.798
   13   HD21  ASN   2          HD21      ASN   2  65.261  -5.452  28.189
   14   HD22  ASN   2          HD22      ASN   2  66.315  -6.580  27.482
   15    H    LEU   3           HN       LEU   3  65.656  -4.952  24.604
   16    HA   LEU   3           HA       LEU   3  65.841  -3.378  22.238
   17    HG   LEU   3           HG       LEU   3  65.023  -6.563  23.532
   18    HB2  LEU   3           HB2      LEU   3  66.339  -5.531  21.088
   19    HB3  LEU   3           HB1      LEU   3  67.268  -5.330  22.571
   20   HD11  LEU   3          HD11      LEU   3  65.617  -7.984  20.934
   21   HD12  LEU   3          HD12      LEU   3  64.328  -6.787  21.056
   22   HD13  LEU   3          HD13      LEU   3  64.271  -8.247  22.043
   23   HD21  LEU   3          HD21      LEU   3  66.417  -8.616  23.567
   24   HD22  LEU   3          HD22      LEU   3  67.354  -7.190  24.010
   25   HD23  LEU   3          HD23      LEU   3  67.511  -7.881  22.396
   26    H    GLU   4           HN       GLU   4  64.425  -3.071  20.549
   27    HA   GLU   4           HA       GLU   4  61.640  -3.617  20.935
   28    HB2  GLU   4           HB2      GLU   4  63.311  -2.624  18.637
   29    HB3  GLU   4           HB1      GLU   4  61.616  -3.022  18.366
   30    HG2  GLU   4           HG2      GLU   4  62.518  -1.194  20.601
   31    HG3  GLU   4           HG1      GLU   4  62.091  -0.596  18.997
   32    HA   PRO   5           HA       PRO   5  61.118  -7.756  19.514
   33    HB2  PRO   5           HB2      PRO   5  58.899  -7.425  17.823
   34    HB3  PRO   5           HB1      PRO   5  58.836  -7.684  19.575
   35    HG2  PRO   5           HG2      PRO   5  58.598  -5.169  18.028
   36    HG3  PRO   5           HG1      PRO   5  57.805  -5.653  19.536
   37    HD2  PRO   5           HD2      PRO   5  59.867  -3.886  19.501
   38    HD3  PRO   5           HD1      PRO   5  59.615  -5.013  20.854
   39    HA   PRO   6           HA       PRO   6  63.036  -8.283  15.580
   40    HB2  PRO   6           HB2      PRO   6  61.794 -10.540  14.592
   41    HB3  PRO   6           HB1      PRO   6  63.028 -10.565  15.866
   42    HG2  PRO   6           HG2      PRO   6  60.069 -10.737  16.101
   43    HG3  PRO   6           HG1      PRO   6  61.327 -11.592  17.008
   44    HD2  PRO   6           HD2      PRO   6  59.979  -9.454  18.036
   45    HD3  PRO   6           HD1      PRO   6  61.661  -9.828  18.477
   46    H    LYS   7           HN       LYS   7  62.735  -8.052  13.271
   47    HA   LYS   7           HA       LYS   7  60.610  -6.340  12.484
   48    HB2  LYS   7           HB2      LYS   7  61.363  -6.875  10.138
   49    HB3  LYS   7           HB1      LYS   7  62.662  -6.362  11.213
   50    HG2  LYS   7           HG2      LYS   7  63.711  -8.249  10.478
   51    HG3  LYS   7           HG1      LYS   7  62.664  -9.067  11.639
   52    HD2  LYS   7           HD2      LYS   7  60.989  -9.456   9.889
   53    HD3  LYS   7           HD1      LYS   7  61.988  -8.591   8.721
   54    HE2  LYS   7           HE2      LYS   7  63.746 -10.251   8.905
   55    HE3  LYS   7           HE1      LYS   7  62.894 -11.066  10.217
   56    HZ1  LYS   7           HZ1      LYS   7  61.268 -10.731   7.886
   57    HZ2  LYS   7           HZ2      LYS   7  61.595 -12.135   8.787
   58    HZ3  LYS   7           HZ3      LYS   7  62.666 -11.637   7.565
   59    H    ALA   8           HN       ALA   8  58.724  -6.747  11.240
   60    HA   ALA   8           HA       ALA   8  57.647  -9.492  11.570
   61    HB1  ALA   8           HB1      ALA   8  55.481  -8.495  11.087
   62    HB2  ALA   8           HB2      ALA   8  56.247  -6.982  10.602
   63    HB3  ALA   8           HB3      ALA   8  56.304  -7.499  12.287
   64    H    GLU   9           HN       GLU   9  55.737  -8.830   9.285
   65    HA   GLU   9           HA       GLU   9  57.481  -9.920   7.148
   66    HB2  GLU   9           HB2      GLU   9  54.488  -9.475   7.041
   67    HB3  GLU   9           HB1      GLU   9  55.457 -10.556   6.038
   68    HG2  GLU   9           HG2      GLU   9  55.037 -10.828   9.030
   69    HG3  GLU   9           HG1      GLU   9  54.274 -11.824   7.789
   70    H1U  RCY  10           H1U      RCY  10  58.859 -12.235  -0.705
   71    H1S  RCY  10           H1S      RCY  10  57.422  -9.437   2.096
   72    HB1  RCY  10           HB1      RCY  10  57.634  -7.764   2.924
   73    HB2  RCY  10           HB2      RCY  10  56.646  -6.418   2.358
   74    HA   RCY  10           HA       RCY  10  57.126  -6.226   4.780
   75    HN1  RCY  10           HN1      RCY  10  56.143  -9.000   4.889
   76    H    ARG  11           HN       ARG  11  55.722  -4.712   5.564
   77    HA   ARG  11           HA       ARG  11  52.806  -5.087   5.173
   78    HE   ARG  11           HE       ARG  11  55.909  -3.968   8.844
   79    HB2  ARG  11           HB2      ARG  11  54.500  -3.221   6.835
   80    HB3  ARG  11           HB1      ARG  11  52.801  -2.859   6.539
   81    HG2  ARG  11           HG2      ARG  11  52.650  -4.103   8.504
   82    HG3  ARG  11           HG1      ARG  11  52.447  -5.367   7.290
   83    HD2  ARG  11           HD2      ARG  11  54.081  -6.244   8.758
   84    HD3  ARG  11           HD1      ARG  11  55.018  -5.617   7.401
   85   HH11  ARG  11          HH21      ARG  11  53.134  -5.524  10.171
   86   HH12  ARG  11          HH22      ARG  11  53.305  -4.792  11.732
   87   HH21  ARG  11          HH11      ARG  11  56.149  -3.003  10.874
   88   HH22  ARG  11          HH12      ARG  11  55.012  -3.365  12.129
   89    H    SER  12           HN       SER  12  55.278  -3.876   3.381
   90    HA   SER  12           HA       SER  12  55.416  -2.295   1.648
   91    HG   SER  12           HG       SER  12  53.755  -3.839  -0.412
   92    HB2  SER  12           HB2      SER  12  52.441  -2.874   1.663
   93    HB3  SER  12           HB1      SER  12  53.263  -1.972   0.394
   94    H    ALA  13           HN       ALA  13  52.179  -1.221   2.498
   95    HA   ALA  13           HA       ALA  13  51.427   0.775   3.486
   96    HB1  ALA  13           HB1      ALA  13  54.187   1.535   4.363
   97    HB2  ALA  13           HB2      ALA  13  53.449   0.115   5.103
   98    HB3  ALA  13           HB3      ALA  13  52.654   1.685   5.223
   99    H    THR  14           HN       THR  14  54.314   0.741   1.500
  100    HA   THR  14           HA       THR  14  53.299   3.038  -0.010
  101    HB   THR  14           HB       THR  14  54.477   4.271   1.695
  102    HG1  THR  14           HG1      THR  14  55.071   4.388  -0.781
  103   HG21  THR  14          HG21      THR  14  56.669   2.245   1.210
  104   HG22  THR  14          HG22      THR  14  55.810   2.569   2.716
  105   HG23  THR  14          HG23      THR  14  56.943   3.758   2.074
  106    H    ARG  15           HN       ARG  15  53.690   0.374  -0.782
  107    HA   ARG  15           HA       ARG  15  54.790  -0.947  -2.386
  108    HE   ARG  15           HE       ARG  15  55.544  -0.653  -7.779
  109    HB2  ARG  15           HB2      ARG  15  54.167   1.419  -3.531
  110    HB3  ARG  15           HB1      ARG  15  55.921   1.488  -3.692
  111    HG2  ARG  15           HG2      ARG  15  55.715  -0.938  -4.605
  112    HG3  ARG  15           HG1      ARG  15  54.009  -0.549  -4.827
  113    HD2  ARG  15           HD2      ARG  15  54.839   1.566  -6.049
  114    HD3  ARG  15           HD1      ARG  15  56.408   0.764  -6.106
  115   HH11  ARG  15          HH21      ARG  15  53.044   0.870  -5.959
  116   HH12  ARG  15          HH22      ARG  15  51.765   0.263  -6.956
  117   HH21  ARG  15          HH11      ARG  15  53.889  -1.455  -9.092
  118   HH22  ARG  15          HH12      ARG  15  52.243  -1.054  -8.730
  119    H    VAL  16           HN       VAL  16  57.120  -1.046  -3.589
  120    HA   VAL  16           HA       VAL  16  59.060  -1.575  -1.655
  121    HB   VAL  16           HB       VAL  16  59.613  -0.567  -4.462
  122   HG11  VAL  16          HG11      VAL  16  61.197  -2.213  -2.473
  123   HG12  VAL  16          HG12      VAL  16  61.643  -0.658  -3.175
  124   HG13  VAL  16          HG13      VAL  16  61.614  -2.104  -4.184
  125   HG21  VAL  16          HG21      VAL  16  57.963  -2.464  -4.330
  126   HG22  VAL  16          HG22      VAL  16  59.194  -3.411  -3.495
  127   HG23  VAL  16          HG23      VAL  16  59.462  -2.888  -5.158
  128    H    MET  17           HN       MET  17  59.879   1.051  -3.865
  129    HA   MET  17           HA       MET  17  60.112   2.947  -1.590
  130    HB2  MET  17           HB2      MET  17  62.390   1.961  -3.313
  131    HB3  MET  17           HB1      MET  17  62.451   3.543  -2.535
  132    HG2  MET  17           HG2      MET  17  61.874   0.983  -1.025
  133    HG3  MET  17           HG1      MET  17  63.495   1.655  -1.198
  134    HE1  MET  17           HE1      MET  17  63.850   4.323   1.234
  135    HE2  MET  17           HE2      MET  17  64.155   4.085  -0.485
  136    HE3  MET  17           HE3      MET  17  64.459   2.770   0.648
  137    H    GLY  18           HN       GLY  18  59.922   5.111  -2.254
  138    HA2  GLY  18           HA2      GLY  18  59.179   6.836  -3.664
  139    HA3  GLY  18           HA1      GLY  18  60.285   6.140  -4.849
  140    H    GLY  19           HN       GLY  19  58.390   6.983  -6.257
  141    HA2  GLY  19           HA2      GLY  19  55.862   5.677  -6.279
  142    HA3  GLY  19           HA1      GLY  19  56.605   6.446  -7.682
  143    HA   PRO  20           HA       PRO  20  56.059   1.874  -8.582
  144    HB2  PRO  20           HB2      PRO  20  56.273   3.183 -11.272
  145    HB3  PRO  20           HB1      PRO  20  55.197   1.877 -10.738
  146    HG2  PRO  20           HG2      PRO  20  54.313   4.366 -11.020
  147    HG3  PRO  20           HG1      PRO  20  53.736   3.326  -9.707
  148    HD2  PRO  20           HD2      PRO  20  55.597   5.652  -9.580
  149    HD3  PRO  20           HD1      PRO  20  54.483   5.028  -8.344
  150    H1U  RCY  21           H1U      RCY  21  60.340  -0.262  -2.175
  151    H1S  RCY  21           H1S      RCY  21  60.210  -0.749  -6.195
  152    HB1  RCY  21           HB1      RCY  21  60.090   1.177  -6.697
  153    HB2  RCY  21           HB2      RCY  21  61.421   2.191  -7.251
  154    HA   RCY  21           HA       RCY  21  60.564   2.349  -9.349
  155    HN1  RCY  21           HN1      RCY  21  58.273   1.646  -7.692
  156    H    THR  22           HN       THR  22  61.777   0.955 -10.661
  157    HA   THR  22           HA       THR  22  60.857  -1.856 -10.926
  158    HB   THR  22           HB       THR  22  59.611  -0.481 -12.607
  159    HG1  THR  22           HG1      THR  22  61.220  -1.793 -14.313
  160   HG21  THR  22          HG21      THR  22  60.763   0.682 -14.341
  161   HG22  THR  22          HG22      THR  22  62.313  -0.020 -13.879
  162   HG23  THR  22          HG23      THR  22  61.541   1.176 -12.838
  163    HA   PRO  23           HA       PRO  23  65.206  -2.784 -10.850
  164    HB2  PRO  23           HB2      PRO  23  64.475  -4.514 -13.193
  165    HB3  PRO  23           HB1      PRO  23  65.449  -4.912 -11.763
  166    HG2  PRO  23           HG2      PRO  23  62.893  -5.679 -12.006
  167    HG3  PRO  23           HG1      PRO  23  63.611  -5.261 -10.443
  168    HD2  PRO  23           HD2      PRO  23  61.590  -3.784 -12.011
  169    HD3  PRO  23           HD1      PRO  23  61.991  -3.653 -10.285
  170    H    ARG  24           HN       ARG  24  66.934  -1.761 -11.809
  171    HA   ARG  24           HA       ARG  24  66.659  -0.902 -14.665
  172    HE   ARG  24           HE       ARG  24  65.916   2.528 -15.052
  173    HB2  ARG  24           HB2      ARG  24  66.302   1.054 -13.244
  174    HB3  ARG  24           HB1      ARG  24  67.777   0.700 -12.344
  175    HG2  ARG  24           HG2      ARG  24  69.166   1.222 -14.184
  176    HG3  ARG  24           HG1      ARG  24  67.832   1.109 -15.332
  177    HD2  ARG  24           HD2      ARG  24  67.850   3.169 -13.125
  178    HD3  ARG  24           HD1      ARG  24  68.613   3.477 -14.685
  179   HH11  ARG  24          HH21      ARG  24  67.839   5.226 -14.099
  180   HH12  ARG  24          HH22      ARG  24  66.665   6.404 -14.585
  181   HH21  ARG  24          HH11      ARG  24  64.372   4.050 -15.693
  182   HH22  ARG  24          HH12      ARG  24  64.703   5.738 -15.488
  183    H    LYS  25           HN       LYS  25  68.033  -2.525 -15.456
  184    HA   LYS  25           HA       LYS  25  70.708  -2.839 -14.213
  185    HB2  LYS  25           HB2      LYS  25  70.952  -4.685 -15.893
  186    HB3  LYS  25           HB1      LYS  25  69.561  -4.895 -14.828
  187    HG2  LYS  25           HG2      LYS  25  68.064  -4.011 -16.537
  188    HG3  LYS  25           HG1      LYS  25  69.431  -3.658 -17.593
  189    HD2  LYS  25           HD2      LYS  25  69.991  -6.161 -17.432
  190    HD3  LYS  25           HD1      LYS  25  68.376  -6.360 -16.752
  191    HE2  LYS  25           HE2      LYS  25  67.377  -5.364 -18.750
  192    HE3  LYS  25           HE1      LYS  25  68.977  -5.059 -19.425
  193    HZ1  LYS  25           HZ1      LYS  25  68.483  -7.036 -20.411
  194    HZ2  LYS  25           HZ2      LYS  25  67.538  -7.591 -19.113
  195    HZ3  LYS  25           HZ3      LYS  25  69.233  -7.615 -19.004
  196    H    GLY  26           HN       GLY  26  72.430  -3.262 -16.178
  197    HA2  GLY  26           HA2      GLY  26  72.156  -1.462 -18.436
  198    HA3  GLY  26           HA1      GLY  26  73.198  -0.786 -17.182
  199    HA   PRO  27           HA       PRO  27  75.257  -3.934 -20.344
  200    HB2  PRO  27           HB2      PRO  27  76.914  -1.443 -20.546
  201    HB3  PRO  27           HB1      PRO  27  76.526  -2.641 -21.797
  202    HG2  PRO  27           HG2      PRO  27  75.282  -0.277 -21.662
  203    HG3  PRO  27           HG1      PRO  27  74.459  -1.748 -22.203
  204    HD2  PRO  27           HD2      PRO  27  74.103  -0.234 -19.686
  205    HD3  PRO  27           HD1      PRO  27  72.997  -1.375 -20.481
  206    HA   PRO  28           HA       PRO  28  77.723  -4.892 -16.647
  207    HB2  PRO  28           HB2      PRO  28  79.157  -6.556 -18.684
  208    HB3  PRO  28           HB1      PRO  28  78.569  -7.008 -17.072
  209    HG2  PRO  28           HG2      PRO  28  77.281  -7.741 -19.289
  210    HG3  PRO  28           HG1      PRO  28  76.414  -7.325 -17.801
  211    HD2  PRO  28           HD2      PRO  28  76.644  -5.776 -20.335
  212    HD3  PRO  28           HD1      PRO  28  75.350  -5.763 -19.116
  213    H    LYS  29           HN       LYS  29  79.445  -3.707 -15.906
  214    HA   LYS  29           HA       LYS  29  81.897  -3.379 -17.369
  215    HB2  LYS  29           HB2      LYS  29  80.255  -1.796 -18.583
  216    HB3  LYS  29           HB1      LYS  29  80.314  -0.817 -17.119
  217    HG2  LYS  29           HG2      LYS  29  82.052   0.144 -18.315
  218    HG3  LYS  29           HG1      LYS  29  82.936  -1.104 -17.435
  219    HD2  LYS  29           HD2      LYS  29  82.462  -2.627 -19.451
  220    HD3  LYS  29           HD1      LYS  29  82.001  -1.155 -20.307
  221    HE2  LYS  29           HE2      LYS  29  84.695  -1.927 -19.204
  222    HE3  LYS  29           HE1      LYS  29  84.284  -1.364 -20.824
  223    HZ1  LYS  29           HZ1      LYS  29  85.369   0.370 -19.552
  224    HZ2  LYS  29           HZ2      LYS  29  84.183   0.261 -18.340
  225    HZ3  LYS  29           HZ3      LYS  29  83.767   0.808 -19.894
  226    H1U  RCY  30           H1U      RCY  30  77.690   0.508  -8.236
  227    H1S  RCY  30           H1S      RCY  30  77.050  -2.379 -11.148
  228    HB1  RCY  30           HB1      RCY  30  79.228  -0.784 -12.790
  229    HB2  RCY  30           HB2      RCY  30  80.097  -1.314 -11.350
  230    HA   RCY  30           HA       RCY  30  81.644  -0.881 -13.239
  231    HN1  RCY  30           HN1      RCY  30  79.739  -2.331 -14.803
  232    H    LYS  31           HN       LYS  31  83.608  -2.117 -13.278
  233    HA   LYS  31           HA       LYS  31  83.537  -4.788 -11.979
  234    HB2  LYS  31           HB2      LYS  31  86.054  -4.685 -12.593
  235    HB3  LYS  31           HB1      LYS  31  84.894  -4.842 -13.913
  236    HG2  LYS  31           HG2      LYS  31  85.010  -2.477 -14.391
  237    HG3  LYS  31           HG1      LYS  31  85.983  -2.185 -12.949
  238    HD2  LYS  31           HD2      LYS  31  87.865  -3.314 -13.857
  239    HD3  LYS  31           HD1      LYS  31  86.902  -4.054 -15.136
  240    HE2  LYS  31           HE2      LYS  31  88.264  -2.150 -15.977
  241    HE3  LYS  31           HE1      LYS  31  86.534  -1.864 -16.167
  242    HZ1  LYS  31           HZ1      LYS  31  86.879   0.017 -15.065
  243    HZ2  LYS  31           HZ2      LYS  31  88.447  -0.439 -14.595
  244    HZ3  LYS  31           HZ3      LYS  31  87.106  -0.923 -13.671
  245    H    GLN  32           HN       GLN  32  84.303  -1.501 -11.322
  246    HA   GLN  32           HA       GLN  32  85.310  -0.457  -9.467
  247    HB2  GLN  32           HB2      GLN  32  83.944  -2.875  -8.272
  248    HB3  GLN  32           HB1      GLN  32  84.729  -1.649  -7.276
  249    HG2  GLN  32           HG2      GLN  32  82.686  -0.903  -9.370
  250    HG3  GLN  32           HG1      GLN  32  82.206  -1.352  -7.733
  251   HE21  GLN  32          HE21      GLN  32  85.271   0.070  -7.602
  252   HE22  GLN  32          HE22      GLN  32  84.799   1.654  -7.215
  253    H    ARG  33           HN       ARG  33  87.537  -0.593  -9.841
  254    HA   ARG  33           HA       ARG  33  89.088  -2.985  -9.590
  255    HE   ARG  33           HE       ARG  33  91.344  -0.485 -13.921
  256    HB2  ARG  33           HB2      ARG  33  89.759  -0.044  -9.506
  257    HB3  ARG  33           HB1      ARG  33  91.003  -1.263  -9.222
  258    HG2  ARG  33           HG2      ARG  33  90.494  -2.306 -11.392
  259    HG3  ARG  33           HG1      ARG  33  89.226  -1.113 -11.677
  260    HD2  ARG  33           HD2      ARG  33  90.763   0.648 -11.922
  261    HD3  ARG  33           HD1      ARG  33  92.045  -0.231 -11.090
  262   HH11  ARG  33          HH21      ARG  33  92.790  -1.885 -11.122
  263   HH12  ARG  33          HH22      ARG  33  93.827  -2.940 -12.023
  264   HH21  ARG  33          HH11      ARG  33  92.690  -1.854 -15.113
  265   HH22  ARG  33          HH12      ARG  33  93.771  -2.923 -14.282
  266    H    GLN  34           HN       GLN  34  91.074  -2.726  -7.831
  267    HA   GLN  34           HA       GLN  34  90.067  -3.544  -5.357
  268    HB2  GLN  34           HB2      GLN  34  92.655  -2.069  -5.931
  269    HB3  GLN  34           HB1      GLN  34  92.298  -2.909  -4.422
  270    HG2  GLN  34           HG2      GLN  34  92.141  -5.030  -5.547
  271    HG3  GLN  34           HG1      GLN  34  92.208  -4.258  -7.131
  272   HE21  GLN  34          HE21      GLN  34  94.246  -3.417  -4.313
  273   HE22  GLN  34          HE22      GLN  34  95.714  -3.867  -5.038
  274    H    THR  35           HN       THR  35  91.955  -0.636  -5.017
  275    HA   THR  35           HA       THR  35  89.581   0.940  -4.202
  276    HB   THR  35           HB       THR  35  90.327   1.325  -1.983
  277    HG1  THR  35           HG1      THR  35  92.605  -0.158  -2.017
  278   HG21  THR  35          HG21      THR  35  89.376  -0.961  -2.392
  279   HG22  THR  35          HG22      THR  35  90.466  -0.890  -1.008
  280   HG23  THR  35          HG23      THR  35  91.025  -1.571  -2.536
  281    H    ARG  36           HN       ARG  36  90.209   2.223  -6.058
  282    HA   ARG  36           HA       ARG  36  92.685   3.290  -6.691
  283    HE   ARG  36           HE       ARG  36  91.972   5.771 -10.177
  284    HB2  ARG  36           HB2      ARG  36  89.990   4.674  -6.721
  285    HB3  ARG  36           HB1      ARG  36  91.433   5.325  -7.497
  286    HG2  ARG  36           HG2      ARG  36  90.651   2.503  -8.115
  287    HG3  ARG  36           HG1      ARG  36  89.722   3.807  -8.856
  288    HD2  ARG  36           HD2      ARG  36  92.721   3.921  -8.929
  289    HD3  ARG  36           HD1      ARG  36  91.870   2.879 -10.069
  290   HH11  ARG  36          HH21      ARG  36  90.042   2.971 -10.744
  291   HH12  ARG  36          HH22      ARG  36  89.090   3.715 -11.985
  292   HH21  ARG  36          HH11      ARG  36  90.740   6.759 -11.794
  293   HH22  ARG  36          HH12      ARG  36  89.485   5.860 -12.580
  294    H    GLN  37           HN       GLN  37  90.491   4.370  -4.135
  295    HA   GLN  37           HA       GLN  37  92.456   5.255  -2.350
  296    HB2  GLN  37           HB2      GLN  37  92.158   7.075  -4.585
  297    HB3  GLN  37           HB1      GLN  37  91.643   7.875  -3.104
  298    HG2  GLN  37           HG2      GLN  37  93.747   7.407  -2.027
  299    HG3  GLN  37           HG1      GLN  37  94.251   6.353  -3.348
  300   HE21  GLN  37          HE21      GLN  37  92.523   9.220  -4.288
  301   HE22  GLN  37          HE22      GLN  37  93.867  10.102  -4.833
  302    H1U  RCY  38           H1U      RCY  38  86.535   3.253   4.129
  303    H1S  RCY  38           H1S      RCY  38  87.303   1.866   0.031
  304    HB1  RCY  38           HB1      RCY  38  87.061   4.923  -3.290
  305    HB2  RCY  38           HB2      RCY  38  86.072   5.125  -1.845
  306    HA   RCY  38           HA       RCY  38  87.985   6.453  -1.426
  307    HN1  RCY  38           HN1      RCY  38  89.473   4.452  -2.957
  308    H    LYS  39           HN       LYS  39  89.184   3.139  -0.839
  309    HA   LYS  39           HA       LYS  39  88.142   3.009   1.851
  310    HB2  LYS  39           HB2      LYS  39  90.372   1.477   0.480
  311    HB3  LYS  39           HB1      LYS  39  89.781   1.110   2.100
  312    HG2  LYS  39           HG2      LYS  39  87.425   1.157   0.799
  313    HG3  LYS  39           HG1      LYS  39  88.468   0.674  -0.539
  314    HD2  LYS  39           HD2      LYS  39  89.437  -1.079   1.083
  315    HD3  LYS  39           HD1      LYS  39  88.033  -0.738   2.094
  316    HE2  LYS  39           HE2      LYS  39  86.573  -1.212   0.096
  317    HE3  LYS  39           HE1      LYS  39  88.019  -1.742  -0.765
  318    HZ1  LYS  39           HZ1      LYS  39  87.729  -3.716   0.165
  319    HZ2  LYS  39           HZ2      LYS  39  86.463  -3.143   1.144
  320    HZ3  LYS  39           HZ3      LYS  39  88.073  -3.025   1.676
  321    H    SER  40           HN       SER  40  90.365   2.252   3.386
  322    HA   SER  40           HA       SER  40  92.051   3.181   4.723
  323    HG   SER  40           HG       SER  40  93.352   2.402   2.553
  324    HB2  SER  40           HB2      SER  40  92.669   5.149   2.532
  325    HB3  SER  40           HB1      SER  40  93.772   4.351   3.650
  326    H    LYS  41           HN       LYS  41  91.042   6.041   2.825
  327    HA   LYS  41           HA       LYS  41  90.700   7.558   5.306
  328    HB2  LYS  41           HB2      LYS  41  90.148   9.438   3.790
  329    HB3  LYS  41           HB1      LYS  41  91.655   8.652   3.327
  330    HG2  LYS  41           HG2      LYS  41  90.719   8.556   1.254
  331    HG3  LYS  41           HG1      LYS  41  89.823   7.184   1.907
  332    HD2  LYS  41           HD2      LYS  41  88.087   8.507   1.091
  333    HD3  LYS  41           HD1      LYS  41  88.172   9.048   2.768
  334    HE2  LYS  41           HE2      LYS  41  88.073  10.957   1.176
  335    HE3  LYS  41           HE1      LYS  41  89.566  10.952   2.114
  336    HZ1  LYS  41           HZ1      LYS  41  90.806  10.370   0.320
  337    HZ2  LYS  41           HZ2      LYS  41  89.575  11.218  -0.486
  338    HZ3  LYS  41           HZ3      LYS  41  89.547   9.520  -0.435
  339    HA   PRO  42           HA       PRO  42  86.353   6.399   5.433
  340    HB2  PRO  42           HB2      PRO  42  85.666   7.755   7.686
  341    HB3  PRO  42           HB1      PRO  42  86.640   6.273   7.730
  342    HG2  PRO  42           HG2      PRO  42  87.512   9.107   7.961
  343    HG3  PRO  42           HG1      PRO  42  88.085   7.674   8.830
  344    HD2  PRO  42           HD2      PRO  42  89.411   8.807   6.683
  345    HD3  PRO  42           HD1      PRO  42  89.576   7.105   7.168
  346    HA   PRO  43           HA       PRO  43  84.171   9.779   3.577
  347    HB2  PRO  43           HB2      PRO  43  81.618   9.391   4.532
  348    HB3  PRO  43           HB1      PRO  43  82.356   8.396   3.262
  349    HG2  PRO  43           HG2      PRO  43  82.033   7.821   6.162
  350    HG3  PRO  43           HG1      PRO  43  81.869   6.739   4.769
  351    HD2  PRO  43           HD2      PRO  43  84.095   6.769   6.353
  352    HD3  PRO  43           HD1      PRO  43  84.151   6.355   4.625
  353    H    LYS  44           HN       LYS  44  82.912  11.790   4.082
  354    HA   LYS  44           HA       LYS  44  82.691  12.543   6.919
  355    HB2  LYS  44           HB2      LYS  44  85.061  13.014   6.427
  356    HB3  LYS  44           HB1      LYS  44  84.582  13.995   5.042
  357    HG2  LYS  44           HG2      LYS  44  83.442  15.577   6.477
  358    HG3  LYS  44           HG1      LYS  44  83.701  14.550   7.888
  359    HD2  LYS  44           HD2      LYS  44  86.139  14.830   7.653
  360    HD3  LYS  44           HD1      LYS  44  85.887  15.853   6.238
  361    HE2  LYS  44           HE2      LYS  44  86.254  17.184   8.312
  362    HE3  LYS  44           HE1      LYS  44  84.673  17.487   7.592
  363    HZ1  LYS  44           HZ1      LYS  44  84.804  15.320   9.522
  364    HZ2  LYS  44           HZ2      LYS  44  83.606  16.502   9.290
  365    HZ3  LYS  44           HZ3      LYS  44  85.021  16.880  10.152
  366    H    LYS  45           HN       LYS  45  83.099  14.538   3.995
  367    HA   LYS  45           HA       LYS  45  81.646  16.112   3.043
  368    HB2  LYS  45           HB2      LYS  45  80.476  13.738   2.744
  369    HB3  LYS  45           HB1      LYS  45  79.298  14.433   3.856
  370    HG2  LYS  45           HG2      LYS  45  79.011  16.369   2.365
  371    HG3  LYS  45           HG1      LYS  45  80.210  15.702   1.257
  372    HD2  LYS  45           HD2      LYS  45  78.007  15.136   0.416
  373    HD3  LYS  45           HD1      LYS  45  78.762  13.661   1.021
  374    HE2  LYS  45           HE2      LYS  45  77.396  13.574   2.908
  375    HE3  LYS  45           HE1      LYS  45  77.065  15.306   2.872
  376    HZ1  LYS  45           HZ1      LYS  45  76.145  14.223   0.477
  377    HZ2  LYS  45           HZ2      LYS  45  75.227  14.878   1.748
  378    HZ3  LYS  45           HZ3      LYS  45  75.581  13.216   1.720
  379    H    GLY  46           HN       GLY  46  78.731  16.138   4.220
  380    HA2  GLY  46           HA2      GLY  46  78.724  16.875   6.912
  381    HA3  GLY  46           HA1      GLY  46  79.236  18.326   6.051
  382    H    VAL  47           HN       VAL  47  77.708  18.395   3.819
  383    HA   VAL  47           HA       VAL  47  75.251  19.432   4.613
  384    HB   VAL  47           HB       VAL  47  74.474  19.049   2.284
  385   HG11  VAL  47          HG11      VAL  47  77.385  19.876   2.519
  386   HG12  VAL  47          HG12      VAL  47  75.995  20.927   2.789
  387   HG13  VAL  47          HG13      VAL  47  76.310  20.278   1.180
  388   HG21  VAL  47          HG21      VAL  47  75.943  17.836   0.724
  389   HG22  VAL  47          HG22      VAL  47  75.428  16.772   2.032
  390   HG23  VAL  47          HG23      VAL  47  77.051  17.461   2.043
  391    H    GLN  48           HN       GLN  48  76.180  16.153   4.689
  392    HA   GLN  48           HA       GLN  48  73.613  15.358   5.763
  393    HB2  GLN  48           HB2      GLN  48  73.406  15.411   3.131
  394    HB3  GLN  48           HB1      GLN  48  74.296  13.891   3.228
  395    HG2  GLN  48           HG2      GLN  48  71.714  14.506   4.698
  396    HG3  GLN  48           HG1      GLN  48  71.852  13.501   3.255
  397   HE21  GLN  48          HE21      GLN  48  71.495  13.172   6.500
  398   HE22  GLN  48          HE22      GLN  48  72.345  11.725   6.754
  399    H    GLY  49           HN       GLY  49  76.765  14.462   4.462
  400    HA2  GLY  49           HA2      GLY  49  78.364  13.145   5.689
  401    HA3  GLY  49           HA1      GLY  49  77.046  12.504   6.671
  402    H1U  RCY  50           H1U      RCY  50  79.622   6.153   3.766
  403    H1S  RCY  50           H1S      RCY  50  75.870   7.423   2.466
  404    HB1  RCY  50           HB1      RCY  50  77.697  10.345   0.760
  405    HB2  RCY  50           HB2      RCY  50  76.922  11.628   1.688
  406    HA   RCY  50           HA       RCY  50  77.735   9.417   3.407
  407    HN1  RCY  50           HN1      RCY  50  78.795  12.165   3.657
  408    H    GLY  51           HN       GLY  51  79.526  11.627   1.234
  409    HA2  GLY  51           HA2      GLY  51  82.053  10.262   1.791
  410    HA3  GLY  51           HA1      GLY  51  81.386   9.896   0.200
  411    H    ASP  52           HN       ASP  52  83.592  11.045  -0.272
  412    HA   ASP  52           HA       ASP  52  83.600  13.949  -0.003
  413    HB2  ASP  52           HB2      ASP  52  85.598  13.756  -1.562
  414    HB3  ASP  52           HB1      ASP  52  85.740  12.856  -0.052
  415    H    ASP  53           HN       ASP  53  81.740  12.006  -1.858
  416    HA   ASP  53           HA       ASP  53  81.230  14.156  -3.794
  417    HB2  ASP  53           HB2      ASP  53  81.557  12.766  -5.773
  418    HB3  ASP  53           HB1      ASP  53  83.060  12.821  -4.850
  419    H    ILE  54           HN       ILE  54  79.139  13.981  -4.704
  420    HA   ILE  54           HA       ILE  54  77.417  11.900  -3.433
  421    HB   ILE  54           HB       ILE  54  76.647  14.540  -4.706
  422   HG12  ILE  54          HG12      ILE  54  76.738  13.770  -1.774
  423   HG13  ILE  54          HG11      ILE  54  78.004  14.696  -2.582
  424   HG21  ILE  54          HG21      ILE  54  75.081  12.492  -3.108
  425   HG22  ILE  54          HG22      ILE  54  74.837  12.911  -4.803
  426   HG23  ILE  54          HG23      ILE  54  74.476  14.091  -3.543
  427   HD11  ILE  54          HD11      ILE  54  76.242  16.365  -3.260
  428   HD12  ILE  54          HD12      ILE  54  76.505  16.269  -1.519
  429   HD13  ILE  54          HD13      ILE  54  75.099  15.489  -2.243
  430    HA   PRO  55           HA       PRO  55  77.331  10.529  -7.780
  431    HB2  PRO  55           HB2      PRO  55  76.747   7.925  -7.300
  432    HB3  PRO  55           HB1      PRO  55  78.380   8.585  -7.079
  433    HG2  PRO  55           HG2      PRO  55  76.314   7.943  -5.044
  434    HG3  PRO  55           HG1      PRO  55  78.074   7.771  -4.963
  435    HD2  PRO  55           HD2      PRO  55  76.625   9.867  -3.825
  436    HD3  PRO  55           HD1      PRO  55  78.363   9.911  -4.190
  437    H    GLY  56           HN       GLY  56  74.874  10.654  -5.407
  438    HA2  GLY  56           HA2      GLY  56  72.763   9.586  -7.166
  439    HA3  GLY  56           HA1      GLY  56  72.529  10.221  -5.537
  440    H    MET  57           HN       MET  57  74.448  12.420  -7.014
  441    HA   MET  57           HA       MET  57  73.952  14.672  -7.528
  442    HB2  MET  57           HB2      MET  57  72.908  14.874  -9.744
  443    HB3  MET  57           HB1      MET  57  74.072  13.552  -9.725
  444    HG2  MET  57           HG2      MET  57  72.332  11.906  -9.548
  445    HG3  MET  57           HG1      MET  57  71.112  13.140  -9.229
  446    HE1  MET  57           HE1      MET  57  70.344  11.514 -12.730
  447    HE2  MET  57           HE2      MET  57  70.124  11.380 -10.986
  448    HE3  MET  57           HE3      MET  57  71.561  10.696 -11.743
  449    H    GLU  58           HN       GLU  58  72.011  13.327  -5.633
  450    HA   GLU  58           HA       GLU  58  70.124  15.488  -5.466
  451    HB2  GLU  58           HB2      GLU  58  69.127  14.281  -7.403
  452    HB3  GLU  58           HB1      GLU  58  68.990  12.834  -6.406
  453    HG2  GLU  58           HG2      GLU  58  67.405  13.847  -4.957
  454    HG3  GLU  58           HG1      GLU  58  67.770  15.464  -5.561
  455    H    GLY  59           HN       GLY  59  69.305  12.108  -4.815
  456    HA2  GLY  59           HA2      GLY  59  70.320  12.016  -2.135
  457    HA3  GLY  59           HA1      GLY  59  68.627  12.515  -2.108
  458    H1U  RCY  60           H1U      RCY  60  75.334  10.516  -0.510
  459    H1S  RCY  60           H1S      RCY  60  73.055   6.718  -2.397
  460    HB1  RCY  60           HB1      RCY  60  70.210   6.276  -2.108
  461    HB2  RCY  60           HB2      RCY  60  71.100   7.632  -1.417
  462    HA   RCY  60           HA       RCY  60  68.753   8.019  -3.285
  463    HN1  RCY  60           HN1      RCY  60  70.362   9.868  -1.618
  464    H    GLY  61           HN       GLY  61  68.566   9.497  -0.239
  465    HA2  GLY  61           HA2      GLY  61  66.177   8.716   0.661
  466    HA3  GLY  61           HA1      GLY  61  67.082   7.239   0.985
  467    H    THR  62           HN       THR  62  68.195  10.604   1.300
  468    HA   THR  62           HA       THR  62  69.491  11.449   3.129
  469    HB   THR  62           HB       THR  62  67.496  12.559   3.598
  470    HG1  THR  62           HG1      THR  62  68.217  12.600   5.580
  471   HG21  THR  62          HG21      THR  62  65.449  11.392   4.388
  472   HG22  THR  62          HG22      THR  62  66.309   9.856   4.285
  473   HG23  THR  62          HG23      THR  62  65.995  10.789   2.823
  474    H    ASP  63           HN       ASP  63  67.578   9.835   5.500
  475    HA   ASP  63           HA       ASP  63  69.885   8.658   6.747
  476    HB2  ASP  63           HB2      ASP  63  66.971   7.924   7.163
  477    HB3  ASP  63           HB1      ASP  63  68.300   7.634   8.286
  478    H    ILE  64           HN       ILE  64  67.145   7.179   4.984
  479    HA   ILE  64           HA       ILE  64  67.903   4.504   5.030
  480    HB   ILE  64           HB       ILE  64  66.510   6.233   3.015
  481   HG12  ILE  64          HG12      ILE  64  64.687   4.659   3.466
  482   HG13  ILE  64          HG11      ILE  64  65.774   3.637   4.406
  483   HG21  ILE  64          HG21      ILE  64  66.175   4.069   1.657
  484   HG22  ILE  64          HG22      ILE  64  67.596   3.461   2.506
  485   HG23  ILE  64          HG23      ILE  64  67.726   4.890   1.481
  486   HD11  ILE  64          HD11      ILE  64  65.348   6.540   5.111
  487   HD12  ILE  64          HD12      ILE  64  65.984   5.247   6.128
  488   HD13  ILE  64          HD13      ILE  64  64.270   5.281   5.714
  489    H    THR  65           HN       THR  65  69.220   7.097   3.000
  490    HA   THR  65           HA       THR  65  70.860   5.498   1.318
  491    HB   THR  65           HB       THR  65  71.389   8.288   2.389
  492    HG1  THR  65           HG1      THR  65  69.873   7.222   0.289
  493   HG21  THR  65          HG21      THR  65  72.687   8.437   0.190
  494   HG22  THR  65          HG22      THR  65  72.587   6.678   0.131
  495   HG23  THR  65          HG23      THR  65  73.426   7.469   1.465
  496    H    VAL  66           HN       VAL  66  71.417   6.793   4.573
  497    HA   VAL  66           HA       VAL  66  74.148   5.712   4.651
  498    HB   VAL  66           HB       VAL  66  72.570   6.724   7.020
  499   HG11  VAL  66          HG11      VAL  66  75.505   7.001   6.332
  500   HG12  VAL  66          HG12      VAL  66  74.862   5.637   7.247
  501   HG13  VAL  66          HG13      VAL  66  74.734   7.272   7.895
  502   HG21  VAL  66          HG21      VAL  66  73.599   8.978   6.403
  503   HG22  VAL  66          HG22      VAL  66  72.266   8.445   5.379
  504   HG23  VAL  66          HG23      VAL  66  73.929   8.290   4.813
  505    H    ILE  67           HN       ILE  67  71.109   5.084   6.451
  506    HA   ILE  67           HA       ILE  67  71.995   2.239   6.730
  507    HB   ILE  67           HB       ILE  67  70.796   3.971   8.919
  508   HG12  ILE  67          HG12      ILE  67  73.225   4.330   8.471
  509   HG13  ILE  67          HG11      ILE  67  72.934   3.608  10.054
  510   HG21  ILE  67          HG21      ILE  67  69.930   1.683   9.014
  511   HG22  ILE  67          HG22      ILE  67  71.091   1.931  10.317
  512   HG23  ILE  67          HG23      ILE  67  71.565   1.036   8.873
  513   HD11  ILE  67          HD11      ILE  67  74.466   2.062   9.401
  514   HD12  ILE  67          HD12      ILE  67  74.291   2.475   7.696
  515   HD13  ILE  67          HD13      ILE  67  73.138   1.382   8.462
  516    H1U  RCY  68           H1U      RCY  68  72.224  -3.385   6.835
  517    H1S  RCY  68           H1S      RCY  68  69.846  -0.439   5.427
  518    HB1  RCY  68           HB1      RCY  68  68.930   1.941   3.411
  519    HB2  RCY  68           HB2      RCY  68  67.274   1.352   3.519
  520    HA   RCY  68           HA       RCY  68  67.644   2.126   5.690
  521    HN1  RCY  68           HN1      RCY  68  70.487   1.271   5.414
  522    HA   PRO  69           HA       PRO  69  66.400  -1.293   8.192
  523    HB2  PRO  69           HB2      PRO  69  64.517  -1.823   5.910
  524    HB3  PRO  69           HB1      PRO  69  64.189  -1.799   7.654
  525    HG2  PRO  69           HG2      PRO  69  63.586   0.266   6.040
  526    HG3  PRO  69           HG1      PRO  69  64.054   0.480   7.733
  527    HD2  PRO  69           HD2      PRO  69  65.543   1.209   5.305
  528    HD3  PRO  69           HD1      PRO  69  65.819   1.719   6.984
  529    H    TRP  70           HN       TRP  70  66.455  -2.075   4.691
  530    HA   TRP  70           HA       TRP  70  67.266  -4.829   5.256
  531    HD1  TRP  70           HD1      TRP  70  64.863  -2.234   3.670
  532    HE1  TRP  70           HE1      TRP  70  65.050  -0.160   2.152
  533    HE3  TRP  70           HE3      TRP  70  69.030  -3.475   0.992
  534    HZ2  TRP  70           HZ2      TRP  70  66.745   0.843   0.073
  535    HZ3  TRP  70           HZ3      TRP  70  69.907  -1.947  -0.747
  536    HH2  TRP  70           HH2      TRP  70  68.774   0.207  -1.211
  537    HB2  TRP  70           HB2      TRP  70  67.614  -4.740   2.637
  538    HB3  TRP  70           HB1      TRP  70  65.987  -4.746   3.312
  539    H    GLU  71           HN       GLU  71  69.108  -3.168   6.452
  540    HA   GLU  71           HA       GLU  71  71.523  -3.620   4.749
  541    HB2  GLU  71           HB2      GLU  71  72.428  -1.504   5.272
  542    HB3  GLU  71           HB1      GLU  71  70.738  -1.158   4.944
  543    HG2  GLU  71           HG2      GLU  71  71.016  -0.031   6.958
  544    HG3  GLU  71           HG1      GLU  71  70.461  -1.602   7.536
  545    H    ALA  72           HN       ALA  72  69.927  -3.919   7.757
  546    HA   ALA  72           HA       ALA  72  72.317  -4.250   9.390
  547    HB1  ALA  72           HB1      ALA  72  69.397  -4.913   9.831
  548    HB2  ALA  72           HB2      ALA  72  70.311  -3.572  10.520
  549    HB3  ALA  72           HB3      ALA  72  70.644  -5.224  11.039
  550    H1U  RCY  73           H1U      RCY  73  74.877  -4.263   3.426
  551    H1S  RCY  73           H1S      RCY  73  72.217  -7.311   3.933
  552    HB1  RCY  73           HB1      RCY  73  70.761  -9.345   5.841
  553    HB2  RCY  73           HB2      RCY  73  72.242  -8.554   5.307
  554    HA   RCY  73           HA       RCY  73  71.097  -8.741   8.001
  555    HN1  RCY  73           HN1      RCY  73  71.105  -6.098   6.939
  556    H    ASN  74           HN       ASN  74  73.753  -6.855   6.535
  557    HA   ASN  74           HA       ASN  74  76.073  -7.278   6.532
  558    HB2  ASN  74           HB2      ASN  74  75.414  -8.117   9.373
  559    HB3  ASN  74           HB1      ASN  74  76.986  -7.580   8.779
  560   HD21  ASN  74          HD21      ASN  74  75.886  -6.116  10.870
  561   HD22  ASN  74          HD22      ASN  74  75.334  -4.612  10.308
  562    H    HIS  75           HN       HIS  75  75.269  -9.259   5.109
  563    HA   HIS  75           HA       HIS  75  76.905 -11.508   5.822
  564    HD1  HIS  75           HD1      HIS  75  73.407 -13.705   4.597
  565    HD2  HIS  75           HD2      HIS  75  76.762 -14.458   6.958
  566    HE1  HIS  75           HE1      HIS  75  74.034 -16.126   4.198
  567    HE2  HIS  75           HE2      HIS  75  76.075 -16.597   5.629
  568    HB2  HIS  75           HB2      HIS  75  75.178 -12.062   7.416
  569    HB3  HIS  75           HB1      HIS  75  73.914 -11.803   6.214
  570    H1U  RCY  76           H1U      RCY  76  80.829  -6.137  -0.337
  571    H1S  RCY  76           H1S      RCY  76  77.700  -8.707   0.211
  572    HB1  RCY  76           HB1      RCY  76  76.315 -10.830   0.173
  573    HB2  RCY  76           HB2      RCY  76  77.970 -10.835   0.778
  574    HA   RCY  76           HA       RCY  76  75.626 -12.438   1.666
  575    HN1  RCY  76           HN1      RCY  76  77.637 -11.771   3.751
  576    H    GLU  77           HN       GLU  77  77.384 -12.842  -0.415
  577    HA   GLU  77           HA       GLU  77  78.654 -15.338   0.352
  578    HB2  GLU  77           HB2      GLU  77  78.695 -13.727  -2.218
  579    HB3  GLU  77           HB1      GLU  77  79.477 -15.299  -2.040
  580    HG2  GLU  77           HG2      GLU  77  77.279 -16.271  -1.363
  581    HG3  GLU  77           HG1      GLU  77  76.524 -14.708  -1.680
  582    H    LEU  78           HN       LEU  78  81.050 -15.665  -0.389
  583    HA   LEU  78           HA       LEU  78  83.304 -15.164  -0.034
  584    HG   LEU  78           HG       LEU  78  82.868 -14.574  -2.336
  585    HB2  LEU  78           HB2      LEU  78  82.170 -12.499  -0.840
  586    HB3  LEU  78           HB1      LEU  78  83.842 -12.607  -0.297
  587   HD11  LEU  78          HD11      LEU  78  82.094 -12.452  -3.245
  588   HD12  LEU  78          HD12      LEU  78  83.539 -12.953  -4.123
  589   HD13  LEU  78          HD13      LEU  78  83.647 -11.696  -2.890
  590   HD21  LEU  78          HD21      LEU  78  85.116 -14.810  -1.389
  591   HD22  LEU  78          HD22      LEU  78  85.489 -13.137  -1.806
  592   HD23  LEU  78          HD23      LEU  78  85.236 -14.329  -3.082
  593    H    HIS  79           HN       HIS  79  81.425 -12.527   1.507
  594    HA   HIS  79           HA       HIS  79  81.430 -11.736   3.692
  595    HD1  HIS  79           HD1      HIS  79  84.331 -12.912   5.643
  596    HD2  HIS  79           HD2      HIS  79  82.891 -16.486   4.045
  597    HE1  HIS  79           HE1      HIS  79  86.204 -14.602   5.868
  598    HE2  HIS  79           HE2      HIS  79  85.340 -16.782   4.899
  599    HB2  HIS  79           HB2      HIS  79  81.492 -13.294   5.409
  600    HB3  HIS  79           HB1      HIS  79  81.162 -14.335   4.030
  601    H    GLU  80           HN       GLU  80  84.436 -13.101   2.473
  602    HA   GLU  80           HA       GLU  80  86.674 -12.520   2.951
  603    HB2  GLU  80           HB2      GLU  80  85.490  -9.737   3.019
  604    HB3  GLU  80           HB1      GLU  80  87.101 -10.214   2.478
  605    HG2  GLU  80           HG2      GLU  80  85.979 -11.603   0.681
  606    HG3  GLU  80           HG1      GLU  80  84.457 -10.840   1.142
  607    H    LEU  81           HN       LEU  81  86.623  -9.634   4.457
  608    HA   LEU  81           HA       LEU  81  87.039 -10.904   7.116
  609    HG   LEU  81           HG       LEU  81  90.136  -9.138   6.407
  610    HB2  LEU  81           HB2      LEU  81  87.926  -8.306   5.863
  611    HB3  LEU  81           HB1      LEU  81  88.003  -8.539   7.608
  612   HD11  LEU  81          HD11      LEU  81  89.056 -10.269   8.578
  613   HD12  LEU  81          HD12      LEU  81  90.574 -10.849   7.893
  614   HD13  LEU  81          HD13      LEU  81  89.067 -11.690   7.532
  615   HD21  LEU  81          HD21      LEU  81  88.646 -11.577   5.440
  616   HD22  LEU  81          HD22      LEU  81  90.225 -10.981   4.931
  617   HD23  LEU  81          HD23      LEU  81  88.760 -10.130   4.439
  618    H    ALA  82           HN       ALA  82  84.494  -9.619   5.557
  619    HA   ALA  82           HA       ALA  82  83.534  -7.631   7.405
  620    HB1  ALA  82           HB1      ALA  82  81.745  -9.408   5.748
  621    HB2  ALA  82           HB2      ALA  82  82.714  -8.138   5.002
  622    HB3  ALA  82           HB3      ALA  82  81.497  -7.724   6.210
  623    H    GLN  83           HN       GLN  83  83.754  -8.497   9.536
  624    HA   GLN  83           HA       GLN  83  82.348 -11.017  10.171
  625    HB2  GLN  83           HB2      GLN  83  83.510  -9.205  12.271
  626    HB3  GLN  83           HB1      GLN  83  83.444 -10.966  12.228
  627    HG2  GLN  83           HG2      GLN  83  85.662 -10.702  11.676
  628    HG3  GLN  83           HG1      GLN  83  84.976 -10.566  10.057
  629   HE21  GLN  83          HE21      GLN  83  87.463  -9.265  11.026
  630   HE22  GLN  83          HE22      GLN  83  87.215  -7.593  10.866
  631    H    TYR  84           HN       TYR  84  82.301  -7.902  11.915
  632    HA   TYR  84           HA       TYR  84  79.396  -8.288  12.379
  633    HD1  TYR  84           HD2      TYR  84  81.124  -9.577  13.935
  634    HD2  TYR  84           HD1      TYR  84  78.956  -6.349  15.759
  635    HE1  TYR  84           HE2      TYR  84  80.397 -11.095  15.756
  636    HE2  TYR  84           HE1      TYR  84  78.228  -7.867  17.580
  637    HH   TYR  84           HH       TYR  84  79.643 -10.834  18.174
  638    HB2  TYR  84           HB2      TYR  84  81.596  -6.779  13.691
  639    HB3  TYR  84           HB1      TYR  84  80.018  -5.994  13.716
  640    H    GLY  85           HN       GLY  85  80.694  -7.404   9.768
  641    HA2  GLY  85           HA2      GLY  85  79.716  -6.070   8.043
  642    HA3  GLY  85           HA1      GLY  85  78.821  -5.178   9.275
  643    H    ILE  86           HN       ILE  86  80.756  -4.258  10.956
  644    HA   ILE  86           HA       ILE  86  82.205  -2.411  11.131
  645    HB   ILE  86           HB       ILE  86  83.620  -3.713   8.794
  646   HG12  ILE  86          HG12      ILE  86  83.168  -5.497  10.343
  647   HG13  ILE  86          HG11      ILE  86  84.836  -4.996  10.624
  648   HG21  ILE  86          HG21      ILE  86  85.569  -2.687   9.666
  649   HG22  ILE  86          HG22      ILE  86  84.805  -2.366  11.222
  650   HG23  ILE  86          HG23      ILE  86  84.328  -1.441   9.798
  651   HD11  ILE  86          HD11      ILE  86  82.392  -4.398  12.288
  652   HD12  ILE  86          HD12      ILE  86  83.845  -3.407  12.412
  653   HD13  ILE  86          HD13      ILE  86  83.916  -5.126  12.796
  654    H1U  RCY  87           H1U      RCY  87  77.239  -1.191   3.481
  655    H1S  RCY  87           H1S      RCY  87  77.479   1.095   7.243
  656    HB1  RCY  87           HB1      RCY  87  79.512   1.189  10.043
  657    HB2  RCY  87           HB2      RCY  87  78.564   0.261   8.881
  658    HA   RCY  87           HA       RCY  87  80.501  -0.210   7.546
  659    HN1  RCY  87           HN1      RCY  87  80.734  -0.804  10.404
  Start of MODEL   37
    1    HA   MET   1           HA       MET   1  57.739  -8.789  13.967
    2    HB2  MET   1           HB2      MET   1  59.820 -10.255  13.843
    3    HB3  MET   1           HB1      MET   1  58.882 -10.146  12.353
    4    HG2  MET   1           HG2      MET   1  60.422  -8.622  11.370
    5    HG3  MET   1           HG1      MET   1  61.208  -8.301  12.916
    6    HE1  MET   1           HE1      MET   1  63.882  -9.076  12.100
    7    HE2  MET   1           HE2      MET   1  62.810  -8.540  10.808
    8    HE3  MET   1           HE3      MET   1  63.785  -9.991  10.590
    9    H    ASN   2           HN       ASN   2  58.773  -9.234  16.055
   10    HA   ASN   2           HA       ASN   2  59.741  -8.466  18.049
   11    HB2  ASN   2           HB2      ASN   2  61.837  -7.750  15.991
   12    HB3  ASN   2           HB1      ASN   2  62.084  -7.468  17.714
   13   HD21  ASN   2          HD21      ASN   2  60.282 -10.229  16.344
   14   HD22  ASN   2          HD22      ASN   2  61.371 -11.416  16.881
   15    H    LEU   3           HN       LEU   3  60.525  -6.395  19.178
   16    HA   LEU   3           HA       LEU   3  59.928  -4.200  19.774
   17    HG   LEU   3           HG       LEU   3  61.747  -2.898  19.571
   18    HB2  LEU   3           HB2      LEU   3  61.429  -4.186  17.411
   19    HB3  LEU   3           HB1      LEU   3  60.075  -3.119  17.053
   20   HD11  LEU   3          HD11      LEU   3  62.725  -0.881  18.399
   21   HD12  LEU   3          HD12      LEU   3  61.977  -1.463  16.912
   22   HD13  LEU   3          HD13      LEU   3  63.215  -2.430  17.714
   23   HD21  LEU   3          HD21      LEU   3  60.676  -0.697  19.736
   24   HD22  LEU   3          HD22      LEU   3  59.443  -1.954  19.634
   25   HD23  LEU   3          HD23      LEU   3  59.826  -0.976  18.217
   26    H    GLU   4           HN       GLU   4  58.607  -2.238  18.079
   27    HA   GLU   4           HA       GLU   4  55.869  -3.350  18.236
   28    HB2  GLU   4           HB2      GLU   4  56.543  -1.090  19.235
   29    HB3  GLU   4           HB1      GLU   4  56.637  -0.502  17.575
   30    HG2  GLU   4           HG2      GLU   4  54.182  -1.853  18.725
   31    HG3  GLU   4           HG1      GLU   4  54.406  -0.104  18.701
   32    HA   PRO   5           HA       PRO   5  55.697  -4.364  13.876
   33    HB2  PRO   5           HB2      PRO   5  52.967  -3.165  14.234
   34    HB3  PRO   5           HB1      PRO   5  53.436  -4.662  13.403
   35    HG2  PRO   5           HG2      PRO   5  52.395  -4.683  15.864
   36    HG3  PRO   5           HG1      PRO   5  53.635  -5.843  15.361
   37    HD2  PRO   5           HD2      PRO   5  53.863  -3.578  17.251
   38    HD3  PRO   5           HD1      PRO   5  54.894  -5.016  17.087
   39    HA   PRO   6           HA       PRO   6  56.359   0.001  12.644
   40    HB2  PRO   6           HB2      PRO   6  58.416  -0.446  10.926
   41    HB3  PRO   6           HB1      PRO   6  58.640  -0.375  12.684
   42    HG2  PRO   6           HG2      PRO   6  58.552  -2.728  10.886
   43    HG3  PRO   6           HG1      PRO   6  59.488  -2.468  12.365
   44    HD2  PRO   6           HD2      PRO   6  57.121  -3.963  12.184
   45    HD3  PRO   6           HD1      PRO   6  57.837  -3.343  13.687
   46    H    LYS   7           HN       LYS   7  55.309   1.014  10.973
   47    HA   LYS   7           HA       LYS   7  54.831  -0.512   8.448
   48    HB2  LYS   7           HB2      LYS   7  52.521   0.245   8.408
   49    HB3  LYS   7           HB1      LYS   7  52.813  -0.567   9.946
   50    HG2  LYS   7           HG2      LYS   7  53.428   1.840  10.792
   51    HG3  LYS   7           HG1      LYS   7  52.494   2.369   9.392
   52    HD2  LYS   7           HD2      LYS   7  51.529   0.592  11.650
   53    HD3  LYS   7           HD1      LYS   7  50.997   2.237  11.297
   54    HE2  LYS   7           HE2      LYS   7  50.252   1.383   9.020
   55    HE3  LYS   7           HE1      LYS   7  50.538  -0.247   9.630
   56    HZ1  LYS   7           HZ1      LYS   7  48.340   1.477  10.107
   57    HZ2  LYS   7           HZ2      LYS   7  49.076   1.045  11.576
   58    HZ3  LYS   7           HZ3      LYS   7  48.523  -0.160  10.513
   59    H    ALA   8           HN       ALA   8  55.582   2.429  10.067
   60    HA   ALA   8           HA       ALA   8  55.513   3.917   7.466
   61    HB1  ALA   8           HB1      ALA   8  55.295   5.949   8.739
   62    HB2  ALA   8           HB2      ALA   8  55.611   5.101  10.252
   63    HB3  ALA   8           HB3      ALA   8  54.107   4.812   9.376
   64    H    GLU   9           HN       GLU   9  57.213   6.015   8.291
   65    HA   GLU   9           HA       GLU   9  59.699   5.043   9.381
   66    HB2  GLU   9           HB2      GLU   9  60.996   5.230   7.210
   67    HB3  GLU   9           HB1      GLU   9  59.935   3.825   7.315
   68    HG2  GLU   9           HG2      GLU   9  58.192   5.064   6.058
   69    HG3  GLU   9           HG1      GLU   9  59.291   6.437   5.914
   70    H1U  RCY  10           H1U      RCY  10  57.814  11.008   4.351
   71    H1S  RCY  10           H1S      RCY  10  58.221  11.771   8.914
   72    HB1  RCY  10           HB1      RCY  10  60.539   9.001  10.156
   73    HB2  RCY  10           HB2      RCY  10  59.106   9.423  11.094
   74    HA   RCY  10           HA       RCY  10  57.799   9.736   9.093
   75    HN1  RCY  10           HN1      RCY  10  57.713   7.383   9.167
   76    H    ARG  11           HN       ARG  11  57.763   9.472   6.643
   77    HA   ARG  11           HA       ARG  11  60.341   9.976   5.299
   78    HE   ARG  11           HE       ARG  11  60.016   7.525   0.656
   79    HB2  ARG  11           HB2      ARG  11  58.302   8.525   4.457
   80    HB3  ARG  11           HB1      ARG  11  57.683  10.079   3.899
   81    HG2  ARG  11           HG2      ARG  11  59.850  10.462   2.708
   82    HG3  ARG  11           HG1      ARG  11  60.354   8.838   3.176
   83    HD2  ARG  11           HD2      ARG  11  57.714   8.741   2.014
   84    HD3  ARG  11           HD1      ARG  11  58.822   9.564   0.915
   85   HH11  ARG  11          HH21      ARG  11  57.709   7.429   3.216
   86   HH12  ARG  11          HH22      ARG  11  57.838   5.717   3.446
   87   HH21  ARG  11          HH11      ARG  11  60.198   5.291   0.942
   88   HH22  ARG  11          HH12      ARG  11  59.248   4.507   2.159
   89    H    SER  12           HN       SER  12  59.134  11.984   7.167
   90    HA   SER  12           HA       SER  12  58.271  14.177   5.406
   91    HG   SER  12           HG       SER  12  58.129  16.130   6.641
   92    HB2  SER  12           HB2      SER  12  57.527  13.694   7.875
   93    HB3  SER  12           HB1      SER  12  59.021  14.523   8.301
   94    H    ALA  13           HN       ALA  13  59.618  15.723   4.587
   95    HA   ALA  13           HA       ALA  13  62.483  15.648   5.449
   96    HB1  ALA  13           HB1      ALA  13  61.300  16.779   2.895
   97    HB2  ALA  13           HB2      ALA  13  61.987  15.161   3.041
   98    HB3  ALA  13           HB3      ALA  13  63.013  16.578   3.264
   99    H    THR  14           HN       THR  14  62.988  18.226   4.118
  100    HA   THR  14           HA       THR  14  61.325  20.233   5.404
  101    HB   THR  14           HB       THR  14  64.136  19.922   6.486
  102    HG1  THR  14           HG1      THR  14  61.643  19.010   7.450
  103   HG21  THR  14          HG21      THR  14  62.950  22.182   6.473
  104   HG22  THR  14          HG22      THR  14  63.487  21.605   8.051
  105   HG23  THR  14          HG23      THR  14  61.789  21.472   7.594
  106    H    ARG  15           HN       ARG  15  64.588  19.554   4.111
  107    HA   ARG  15           HA       ARG  15  64.211  21.612   2.066
  108    HE   ARG  15           HE       ARG  15  66.816  22.216   7.303
  109    HB2  ARG  15           HB2      ARG  15  66.447  22.725   2.843
  110    HB3  ARG  15           HB1      ARG  15  64.948  23.171   3.657
  111    HG2  ARG  15           HG2      ARG  15  65.424  21.802   5.533
  112    HG3  ARG  15           HG1      ARG  15  66.679  20.914   4.668
  113    HD2  ARG  15           HD2      ARG  15  68.197  22.716   4.772
  114    HD3  ARG  15           HD1      ARG  15  66.924  23.883   5.127
  115   HH11  ARG  15          HH21      ARG  15  69.342  23.852   5.622
  116   HH12  ARG  15          HH22      ARG  15  70.332  24.049   7.029
  117   HH21  ARG  15          HH11      ARG  15  68.094  22.464   9.151
  118   HH22  ARG  15          HH12      ARG  15  69.626  23.263   9.027
  119    H    VAL  16           HN       VAL  16  66.460  19.395   3.708
  120    HA   VAL  16           HA       VAL  16  68.070  19.123   1.253
  121    HB   VAL  16           HB       VAL  16  69.111  19.089   3.539
  122   HG11  VAL  16          HG11      VAL  16  68.069  16.284   3.823
  123   HG12  VAL  16          HG12      VAL  16  67.088  17.638   4.385
  124   HG13  VAL  16          HG13      VAL  16  68.693  17.369   5.065
  125   HG21  VAL  16          HG21      VAL  16  70.280  18.080   1.634
  126   HG22  VAL  16          HG22      VAL  16  69.394  16.573   1.865
  127   HG23  VAL  16          HG23      VAL  16  70.553  17.109   3.081
  128    H    MET  17           HN       MET  17  67.424  17.757  -0.324
  129    HA   MET  17           HA       MET  17  66.380  15.952  -1.394
  130    HB2  MET  17           HB2      MET  17  67.867  14.940   0.798
  131    HB3  MET  17           HB1      MET  17  66.327  14.083   0.823
  132    HG2  MET  17           HG2      MET  17  66.602  13.441  -1.517
  133    HG3  MET  17           HG1      MET  17  68.088  14.384  -1.628
  134    HE1  MET  17           HE1      MET  17  70.025  11.238  -1.715
  135    HE2  MET  17           HE2      MET  17  69.759  12.888  -2.274
  136    HE3  MET  17           HE3      MET  17  68.568  11.639  -2.633
  137    H    GLY  18           HN       GLY  18  64.243  16.375  -1.747
  138    HA2  GLY  18           HA2      GLY  18  62.307  15.452   0.281
  139    HA3  GLY  18           HA1      GLY  18  62.208  17.158  -0.157
  140    H    GLY  19           HN       GLY  19  59.968  16.168  -0.799
  141    HA2  GLY  19           HA2      GLY  19  58.644  16.184  -2.812
  142    HA3  GLY  19           HA1      GLY  19  60.073  15.701  -3.726
  143    HA   PRO  20           HA       PRO  20  57.006  12.127  -2.157
  144    HB2  PRO  20           HB2      PRO  20  56.533  12.117  -5.117
  145    HB3  PRO  20           HB1      PRO  20  55.411  11.741  -3.795
  146    HG2  PRO  20           HG2      PRO  20  55.336  14.077  -5.093
  147    HG3  PRO  20           HG1      PRO  20  54.958  13.944  -3.368
  148    HD2  PRO  20           HD2      PRO  20  57.338  15.140  -4.673
  149    HD3  PRO  20           HD1      PRO  20  56.657  15.455  -3.062
  150    H1U  RCY  21           H1U      RCY  21  62.454   9.038   2.210
  151    H1S  RCY  21           H1S      RCY  21  60.792   7.162  -0.953
  152    HB1  RCY  21           HB1      RCY  21  58.813   7.515  -2.458
  153    HB2  RCY  21           HB2      RCY  21  59.674   8.974  -1.967
  154    HA   RCY  21           HA       RCY  21  59.814   9.437  -4.547
  155    HN1  RCY  21           HN1      RCY  21  57.139   9.833  -3.285
  156    H    THR  22           HN       THR  22  59.762   7.928  -6.198
  157    HA   THR  22           HA       THR  22  57.347   6.182  -6.419
  158    HB   THR  22           HB       THR  22  57.080   6.764  -8.754
  159    HG1  THR  22           HG1      THR  22  58.463   8.203  -9.735
  160   HG21  THR  22          HG21      THR  22  57.459   9.333  -7.198
  161   HG22  THR  22          HG22      THR  22  56.079   8.256  -6.981
  162   HG23  THR  22          HG23      THR  22  56.344   9.049  -8.534
  163    HA   PRO  23           HA       PRO  23  61.094   3.545  -6.901
  164    HB2  PRO  23           HB2      PRO  23  58.960   1.470  -6.768
  165    HB3  PRO  23           HB1      PRO  23  60.479   1.585  -5.859
  166    HG2  PRO  23           HG2      PRO  23  58.116   2.110  -4.731
  167    HG3  PRO  23           HG1      PRO  23  59.585   2.993  -4.285
  168    HD2  PRO  23           HD2      PRO  23  57.277   3.901  -5.957
  169    HD3  PRO  23           HD1      PRO  23  58.324   4.841  -4.870
  170    H    ARG  24           HN       ARG  24  61.693   3.693  -9.055
  171    HA   ARG  24           HA       ARG  24  60.751   1.796 -10.952
  172    HE   ARG  24           HE       ARG  24  56.412   4.098 -10.416
  173    HB2  ARG  24           HB2      ARG  24  59.154   4.210 -10.762
  174    HB3  ARG  24           HB1      ARG  24  59.918   4.123 -12.348
  175    HG2  ARG  24           HG2      ARG  24  58.939   2.013 -12.825
  176    HG3  ARG  24           HG1      ARG  24  58.500   1.745 -11.137
  177    HD2  ARG  24           HD2      ARG  24  57.386   4.136 -12.565
  178    HD3  ARG  24           HD1      ARG  24  56.673   2.551 -12.866
  179   HH11  ARG  24          HH21      ARG  24  56.546   0.961 -11.841
  180   HH12  ARG  24          HH22      ARG  24  55.623   0.206 -10.585
  181   HH21  ARG  24          HH11      ARG  24  55.206   3.129  -8.768
  182   HH22  ARG  24          HH12      ARG  24  54.864   1.433  -8.845
  183    H    LYS  25           HN       LYS  25  62.780   4.197  -9.877
  184    HA   LYS  25           HA       LYS  25  64.044   4.906 -12.408
  185    HB2  LYS  25           HB2      LYS  25  65.801   5.905 -10.946
  186    HB3  LYS  25           HB1      LYS  25  64.182   6.440 -10.504
  187    HG2  LYS  25           HG2      LYS  25  64.884   5.840  -8.403
  188    HG3  LYS  25           HG1      LYS  25  64.361   4.243  -8.939
  189    HD2  LYS  25           HD2      LYS  25  66.489   3.658  -8.333
  190    HD3  LYS  25           HD1      LYS  25  66.874   4.262  -9.945
  191    HE2  LYS  25           HE2      LYS  25  68.407   5.358  -8.490
  192    HE3  LYS  25           HE1      LYS  25  67.167   6.561  -8.845
  193    HZ1  LYS  25           HZ1      LYS  25  67.289   6.700  -6.580
  194    HZ2  LYS  25           HZ2      LYS  25  67.640   5.050  -6.373
  195    HZ3  LYS  25           HZ3      LYS  25  66.057   5.545  -6.740
  196    H    GLY  26           HN       GLY  26  66.108   4.127 -13.137
  197    HA2  GLY  26           HA2      GLY  26  67.758   2.491 -13.478
  198    HA3  GLY  26           HA1      GLY  26  67.633   2.135 -11.755
  199    HA   PRO  27           HA       PRO  27  64.457  -0.541 -14.441
  200    HB2  PRO  27           HB2      PRO  27  66.467  -1.234 -16.529
  201    HB3  PRO  27           HB1      PRO  27  64.737  -0.878 -16.703
  202    HG2  PRO  27           HG2      PRO  27  66.610   0.859 -17.459
  203    HG3  PRO  27           HG1      PRO  27  65.074   1.390 -16.753
  204    HD2  PRO  27           HD2      PRO  27  67.789   1.278 -15.488
  205    HD3  PRO  27           HD1      PRO  27  66.483   2.461 -15.252
  206    HA   PRO  28           HA       PRO  28  66.056  -4.332 -12.828
  207    HB2  PRO  28           HB2      PRO  28  65.607  -5.897 -15.300
  208    HB3  PRO  28           HB1      PRO  28  64.841  -6.063 -13.710
  209    HG2  PRO  28           HG2      PRO  28  63.541  -5.089 -15.846
  210    HG3  PRO  28           HG1      PRO  28  63.202  -4.548 -14.194
  211    HD2  PRO  28           HD2      PRO  28  64.746  -3.154 -16.355
  212    HD3  PRO  28           HD1      PRO  28  63.680  -2.468 -15.108
  213    H    LYS  29           HN       LYS  29  68.135  -4.966 -12.511
  214    HA   LYS  29           HA       LYS  29  69.930  -6.266 -14.065
  215    HB2  LYS  29           HB2      LYS  29  69.913  -4.769 -15.904
  216    HB3  LYS  29           HB1      LYS  29  69.936  -3.347 -14.860
  217    HG2  LYS  29           HG2      LYS  29  72.211  -3.664 -14.286
  218    HG3  LYS  29           HG1      LYS  29  72.211  -5.331 -14.862
  219    HD2  LYS  29           HD2      LYS  29  73.287  -4.223 -16.616
  220    HD3  LYS  29           HD1      LYS  29  71.614  -4.243 -17.175
  221    HE2  LYS  29           HE2      LYS  29  72.384  -2.000 -17.487
  222    HE3  LYS  29           HE1      LYS  29  71.348  -1.965 -16.061
  223    HZ1  LYS  29           HZ1      LYS  29  73.395  -2.240 -14.709
  224    HZ2  LYS  29           HZ2      LYS  29  73.328  -0.774 -15.566
  225    HZ3  LYS  29           HZ3      LYS  29  74.313  -2.041 -16.122
  226    H1U  RCY  30           H1U      RCY  30  73.592  -3.765  -5.000
  227    H1S  RCY  30           H1S      RCY  30  71.624  -2.295  -9.077
  228    HB1  RCY  30           HB1      RCY  30  71.737  -5.281  -8.588
  229    HB2  RCY  30           HB2      RCY  30  70.431  -6.229  -9.296
  230    HA   RCY  30           HA       RCY  30  72.647  -4.879 -10.865
  231    HN1  RCY  30           HN1      RCY  30  70.862  -6.855 -12.114
  232    H    LYS  31           HN       LYS  31  71.261  -7.955  -9.715
  233    HA   LYS  31           HA       LYS  31  73.713  -9.045  -8.840
  234    HB2  LYS  31           HB2      LYS  31  72.593 -11.167  -8.740
  235    HB3  LYS  31           HB1      LYS  31  71.384  -9.939  -8.364
  236    HG2  LYS  31           HG2      LYS  31  70.976  -9.991 -10.979
  237    HG3  LYS  31           HG1      LYS  31  71.692 -11.597 -10.845
  238    HD2  LYS  31           HD2      LYS  31  69.295 -10.579  -9.290
  239    HD3  LYS  31           HD1      LYS  31  69.256 -11.749 -10.609
  240    HE2  LYS  31           HE2      LYS  31  70.482 -12.086  -7.866
  241    HE3  LYS  31           HE1      LYS  31  69.201 -13.046  -8.607
  242    HZ1  LYS  31           HZ1      LYS  31  72.088 -13.056  -9.161
  243    HZ2  LYS  31           HZ2      LYS  31  71.003 -13.496 -10.392
  244    HZ3  LYS  31           HZ3      LYS  31  71.034 -14.365  -8.932
  245    H    GLN  32           HN       GLN  32  74.183 -11.454 -10.089
  246    HA   GLN  32           HA       GLN  32  75.666 -12.172 -11.785
  247    HB2  GLN  32           HB2      GLN  32  74.544 -12.331 -13.971
  248    HB3  GLN  32           HB1      GLN  32  73.441 -12.766 -12.669
  249    HG2  GLN  32           HG2      GLN  32  72.377 -10.598 -12.747
  250    HG3  GLN  32           HG1      GLN  32  73.590  -9.988 -13.872
  251   HE21  GLN  32          HE21      GLN  32  72.413 -13.277 -14.266
  252   HE22  GLN  32          HE22      GLN  32  71.481 -12.978 -15.653
  253    H    ARG  33           HN       ARG  33  76.384  -9.597 -10.938
  254    HA   ARG  33           HA       ARG  33  76.579  -7.515 -12.738
  255    HE   ARG  33           HE       ARG  33  77.822  -5.040  -7.967
  256    HB2  ARG  33           HB2      ARG  33  78.732  -8.652 -10.939
  257    HB3  ARG  33           HB1      ARG  33  78.903  -7.123 -11.801
  258    HG2  ARG  33           HG2      ARG  33  77.012  -6.173 -10.651
  259    HG3  ARG  33           HG1      ARG  33  76.587  -7.733  -9.948
  260    HD2  ARG  33           HD2      ARG  33  78.617  -7.751  -8.618
  261    HD3  ARG  33           HD1      ARG  33  79.198  -6.289  -9.414
  262   HH11  ARG  33          HH21      ARG  33  76.831  -8.336  -8.164
  263   HH12  ARG  33          HH22      ARG  33  75.619  -8.184  -6.936
  264   HH21  ARG  33          HH11      ARG  33  76.246  -4.822  -6.361
  265   HH22  ARG  33          HH12      ARG  33  75.288  -6.194  -5.915
  266    H    GLN  34           HN       GLN  34  77.994  -6.967 -14.465
  267    HA   GLN  34           HA       GLN  34  79.596  -9.204 -15.627
  268    HB2  GLN  34           HB2      GLN  34  77.868  -7.378 -17.310
  269    HB3  GLN  34           HB1      GLN  34  78.676  -8.867 -17.802
  270    HG2  GLN  34           HG2      GLN  34  77.218 -10.169 -16.308
  271    HG3  GLN  34           HG1      GLN  34  76.420  -8.686 -15.784
  272   HE21  GLN  34          HE21      GLN  34  76.291 -11.195 -18.098
  273   HE22  GLN  34          HE22      GLN  34  75.203 -10.466 -19.177
  274    H    THR  35           HN       THR  35  78.919  -5.754 -15.410
  275    HA   THR  35           HA       THR  35  81.597  -5.169 -16.606
  276    HB   THR  35           HB       THR  35  79.399  -3.177 -16.003
  277    HG1  THR  35           HG1      THR  35  79.902  -4.670 -18.360
  278   HG21  THR  35          HG21      THR  35  81.778  -3.165 -17.883
  279   HG22  THR  35          HG22      THR  35  81.642  -2.257 -16.377
  280   HG23  THR  35          HG23      THR  35  80.590  -1.869 -17.738
  281    H    ARG  36           HN       ARG  36  79.474  -3.945 -13.989
  282    HA   ARG  36           HA       ARG  36  81.368  -2.509 -12.526
  283    HE   ARG  36           HE       ARG  36  79.648  -1.568  -8.817
  284    HB2  ARG  36           HB2      ARG  36  78.995  -4.160 -11.664
  285    HB3  ARG  36           HB1      ARG  36  79.985  -3.309 -10.478
  286    HG2  ARG  36           HG2      ARG  36  79.146  -1.716 -12.839
  287    HG3  ARG  36           HG1      ARG  36  77.859  -2.170 -11.721
  288    HD2  ARG  36           HD2      ARG  36  80.451  -0.826 -10.901
  289    HD3  ARG  36           HD1      ARG  36  78.916   0.013 -11.128
  290   HH11  ARG  36          HH21      ARG  36  77.083  -0.635 -10.923
  291   HH12  ARG  36          HH22      ARG  36  75.846  -0.847  -9.728
  292   HH21  ARG  36          HH11      ARG  36  78.049  -1.850  -7.245
  293   HH22  ARG  36          HH12      ARG  36  76.393  -1.535  -7.646
  294    H    GLN  37           HN       GLN  37  80.370  -5.720 -11.389
  295    HA   GLN  37           HA       GLN  37  81.618  -7.382 -10.294
  296    HB2  GLN  37           HB2      GLN  37  83.725  -6.479 -12.282
  297    HB3  GLN  37           HB1      GLN  37  83.700  -8.021 -11.425
  298    HG2  GLN  37           HG2      GLN  37  81.391  -8.393 -12.477
  299    HG3  GLN  37           HG1      GLN  37  81.773  -7.035 -13.535
  300   HE21  GLN  37          HE21      GLN  37  81.444  -9.383 -14.875
  301   HE22  GLN  37          HE22      GLN  37  82.934 -10.051 -15.338
  302    H1U  RCY  38           H1U      RCY  38  82.381  -4.007  -2.818
  303    H1S  RCY  38           H1S      RCY  38  81.850  -7.177  -5.473
  304    HB1  RCY  38           HB1      RCY  38  83.734  -5.355  -6.822
  305    HB2  RCY  38           HB2      RCY  38  85.212  -6.061  -6.167
  306    HA   RCY  38           HA       RCY  38  85.316  -5.030  -8.548
  307    HN1  RCY  38           HN1      RCY  38  84.380  -7.505  -9.737
  308    H    LYS  39           HN       LYS  39  85.583  -8.357  -9.315
  309    HA   LYS  39           HA       LYS  39  87.465  -9.733  -9.547
  310    HB2  LYS  39           HB2      LYS  39  88.387  -7.272 -10.188
  311    HB3  LYS  39           HB1      LYS  39  89.363  -7.574  -8.752
  312    HG2  LYS  39           HG2      LYS  39  90.645  -8.458 -10.544
  313    HG3  LYS  39           HG1      LYS  39  89.888  -9.867  -9.799
  314    HD2  LYS  39           HD2      LYS  39  88.009  -8.960 -11.669
  315    HD3  LYS  39           HD1      LYS  39  89.563  -8.822 -12.492
  316    HE2  LYS  39           HE2      LYS  39  90.084 -11.154 -11.968
  317    HE3  LYS  39           HE1      LYS  39  88.582 -11.306 -11.056
  318    HZ1  LYS  39           HZ1      LYS  39  89.018 -11.316 -13.915
  319    HZ2  LYS  39           HZ2      LYS  39  87.697 -10.378 -13.403
  320    HZ3  LYS  39           HZ3      LYS  39  87.777 -12.027 -13.002
  321    H    SER  40           HN       SER  40  86.476  -8.301  -6.742
  322    HA   SER  40           HA       SER  40  88.585  -9.538  -5.046
  323    HG   SER  40           HG       SER  40  88.315  -7.148  -5.545
  324    HB2  SER  40           HB2      SER  40  86.184  -7.954  -4.113
  325    HB3  SER  40           HB1      SER  40  87.679  -8.270  -3.238
  326    H    LYS  41           HN       LYS  41  88.038 -11.144  -3.485
  327    HA   LYS  41           HA       LYS  41  86.016 -13.013  -4.303
  328    HB2  LYS  41           HB2      LYS  41  86.545 -13.783  -1.740
  329    HB3  LYS  41           HB1      LYS  41  87.583 -14.185  -3.105
  330    HG2  LYS  41           HG2      LYS  41  88.013 -11.538  -1.790
  331    HG3  LYS  41           HG1      LYS  41  88.549 -12.975  -0.919
  332    HD2  LYS  41           HD2      LYS  41  89.833 -13.691  -2.916
  333    HD3  LYS  41           HD1      LYS  41  89.330 -12.220  -3.751
  334    HE2  LYS  41           HE2      LYS  41  90.992 -12.380  -1.220
  335    HE3  LYS  41           HE1      LYS  41  91.549 -11.869  -2.814
  336    HZ1  LYS  41           HZ1      LYS  41  91.107  -9.902  -1.662
  337    HZ2  LYS  41           HZ2      LYS  41  89.657 -10.494  -1.004
  338    HZ3  LYS  41           HZ3      LYS  41  89.750 -10.113  -2.657
  339    HA   PRO  42           HA       PRO  42  82.439 -11.437  -2.271
  340    HB2  PRO  42           HB2      PRO  42  81.184 -13.739  -1.445
  341    HB3  PRO  42           HB1      PRO  42  81.227 -13.197  -3.134
  342    HG2  PRO  42           HG2      PRO  42  82.881 -15.261  -1.772
  343    HG3  PRO  42           HG1      PRO  42  82.184 -15.264  -3.401
  344    HD2  PRO  42           HD2      PRO  42  84.818 -14.702  -2.923
  345    HD3  PRO  42           HD1      PRO  42  83.920 -14.014  -4.294
  346    HA   PRO  43           HA       PRO  43  83.197 -11.219   2.093
  347    HB2  PRO  43           HB2      PRO  43  80.738 -10.547   3.059
  348    HB3  PRO  43           HB1      PRO  43  81.734  -9.426   2.109
  349    HG2  PRO  43           HG2      PRO  43  79.415 -11.080   1.247
  350    HG3  PRO  43           HG1      PRO  43  79.844  -9.418   0.807
  351    HD2  PRO  43           HD2      PRO  43  80.338 -11.588  -0.813
  352    HD3  PRO  43           HD1      PRO  43  81.300 -10.094  -0.854
  353    H    LYS  44           HN       LYS  44  83.206 -12.576   3.881
  354    HA   LYS  44           HA       LYS  44  81.042 -14.537   4.268
  355    HB2  LYS  44           HB2      LYS  44  83.153 -15.323   2.700
  356    HB3  LYS  44           HB1      LYS  44  83.725 -15.803   4.296
  357    HG2  LYS  44           HG2      LYS  44  81.007 -16.531   3.163
  358    HG3  LYS  44           HG1      LYS  44  82.410 -17.601   3.155
  359    HD2  LYS  44           HD2      LYS  44  82.521 -17.327   5.665
  360    HD3  LYS  44           HD1      LYS  44  80.975 -16.482   5.577
  361    HE2  LYS  44           HE2      LYS  44  80.508 -18.799   6.072
  362    HE3  LYS  44           HE1      LYS  44  80.030 -18.504   4.400
  363    HZ1  LYS  44           HZ1      LYS  44  81.708 -20.463   5.246
  364    HZ2  LYS  44           HZ2      LYS  44  82.776 -19.280   4.660
  365    HZ3  LYS  44           HZ3      LYS  44  81.564 -19.908   3.649
  366    H    LYS  45           HN       LYS  45  84.199 -13.279   5.276
  367    HA   LYS  45           HA       LYS  45  83.262 -13.278   8.075
  368    HB2  LYS  45           HB2      LYS  45  85.277 -15.153   7.004
  369    HB3  LYS  45           HB1      LYS  45  85.829 -14.255   8.416
  370    HG2  LYS  45           HG2      LYS  45  83.101 -15.525   8.417
  371    HG3  LYS  45           HG1      LYS  45  84.527 -16.499   8.772
  372    HD2  LYS  45           HD2      LYS  45  85.145 -15.005  10.598
  373    HD3  LYS  45           HD1      LYS  45  83.806 -13.926  10.205
  374    HE2  LYS  45           HE2      LYS  45  82.247 -15.889  10.600
  375    HE3  LYS  45           HE1      LYS  45  83.636 -16.765  11.244
  376    HZ1  LYS  45           HZ1      LYS  45  82.010 -15.010  12.605
  377    HZ2  LYS  45           HZ2      LYS  45  83.465 -14.166  12.369
  378    HZ3  LYS  45           HZ3      LYS  45  83.472 -15.675  13.150
  379    H    GLY  46           HN       GLY  46  83.349 -10.962   7.546
  380    HA2  GLY  46           HA2      GLY  46  84.431  -8.897   7.892
  381    HA3  GLY  46           HA1      GLY  46  85.898  -9.787   8.301
  382    H    VAL  47           HN       VAL  47  87.406 -10.235   6.662
  383    HA   VAL  47           HA       VAL  47  88.577  -9.675   4.699
  384    HB   VAL  47           HB       VAL  47  85.830 -10.393   3.642
  385   HG11  VAL  47          HG11      VAL  47  88.439  -9.822   2.230
  386   HG12  VAL  47          HG12      VAL  47  86.839  -9.169   1.876
  387   HG13  VAL  47          HG13      VAL  47  87.204 -10.855   1.510
  388   HG21  VAL  47          HG21      VAL  47  87.020 -12.536   3.098
  389   HG22  VAL  47          HG22      VAL  47  86.935 -12.209   4.829
  390   HG23  VAL  47          HG23      VAL  47  88.436 -11.918   3.950
  391    H    GLN  48           HN       GLN  48  88.954  -7.456   5.048
  392    HA   GLN  48           HA       GLN  48  87.257  -5.651   3.392
  393    HB2  GLN  48           HB2      GLN  48  88.251  -4.898   6.156
  394    HB3  GLN  48           HB1      GLN  48  87.192  -3.956   5.110
  395    HG2  GLN  48           HG2      GLN  48  85.592  -4.929   6.462
  396    HG3  GLN  48           HG1      GLN  48  85.716  -6.184   5.229
  397   HE21  GLN  48          HE21      GLN  48  85.615  -5.841   8.518
  398   HE22  GLN  48          HE22      GLN  48  86.531  -7.194   8.979
  399    H    GLY  49           HN       GLY  49  88.799  -3.326   4.327
  400    HA2  GLY  49           HA2      GLY  49  90.837  -2.239   3.891
  401    HA3  GLY  49           HA1      GLY  49  91.614  -3.822   3.909
  402    H1U  RCY  50           H1U      RCY  50  83.198  -2.588  -2.146
  403    H1S  RCY  50           H1S      RCY  50  85.952  -5.502  -1.819
  404    HB1  RCY  50           HB1      RCY  50  88.359  -3.247  -1.712
  405    HB2  RCY  50           HB2      RCY  50  87.730  -3.135  -0.068
  406    HA   RCY  50           HA       RCY  50  90.435  -4.358  -0.529
  407    HN1  RCY  50           HN1      RCY  50  88.983  -3.763   1.784
  408    H    GLY  51           HN       GLY  51  89.638  -1.180   0.808
  409    HA2  GLY  51           HA2      GLY  51  90.298   0.974   0.123
  410    HA3  GLY  51           HA1      GLY  51  91.839   0.185  -0.216
  411    H    ASP  52           HN       ASP  52  88.755   1.154  -1.626
  412    HA   ASP  52           HA       ASP  52  89.400   0.221  -4.298
  413    HB2  ASP  52           HB2      ASP  52  87.070   0.754  -3.303
  414    HB3  ASP  52           HB1      ASP  52  87.454   2.439  -3.658
  415    H    ASP  53           HN       ASP  53  89.183   2.158  -6.078
  416    HA   ASP  53           HA       ASP  53  90.644   4.578  -5.329
  417    HB2  ASP  53           HB2      ASP  53  91.967   2.360  -6.897
  418    HB3  ASP  53           HB1      ASP  53  92.486   4.039  -7.051
  419    H    ILE  54           HN       ILE  54  88.111   3.848  -6.642
  420    HA   ILE  54           HA       ILE  54  88.584   5.060  -9.343
  421    HB   ILE  54           HB       ILE  54  86.437   3.137  -8.403
  422   HG12  ILE  54          HG12      ILE  54  87.386   1.828 -10.379
  423   HG13  ILE  54          HG11      ILE  54  88.709   2.995 -10.401
  424   HG21  ILE  54          HG21      ILE  54  85.787   3.316 -10.909
  425   HG22  ILE  54          HG22      ILE  54  86.667   4.843 -10.879
  426   HG23  ILE  54          HG23      ILE  54  85.270   4.610  -9.829
  427   HD11  ILE  54          HD11      ILE  54  88.149   1.943  -7.720
  428   HD12  ILE  54          HD12      ILE  54  89.686   2.084  -8.573
  429   HD13  ILE  54          HD13      ILE  54  88.639   0.695  -8.866
  430    HA   PRO  55           HA       PRO  55  86.032   8.073  -6.983
  431    HB2  PRO  55           HB2      PRO  55  87.434  10.297  -7.597
  432    HB3  PRO  55           HB1      PRO  55  87.985   9.162  -6.348
  433    HG2  PRO  55           HG2      PRO  55  88.950   9.514  -9.133
  434    HG3  PRO  55           HG1      PRO  55  89.854   9.115  -7.664
  435    HD2  PRO  55           HD2      PRO  55  89.023   7.271  -9.608
  436    HD3  PRO  55           HD1      PRO  55  89.542   6.866  -7.957
  437    H    GLY  56           HN       GLY  56  85.599   7.035  -9.771
  438    HA2  GLY  56           HA2      GLY  56  85.042   9.392 -11.411
  439    HA3  GLY  56           HA1      GLY  56  84.626   7.726 -11.818
  440    H    MET  57           HN       MET  57  83.468   7.859  -8.838
  441    HA   MET  57           HA       MET  57  80.735   8.409  -9.761
  442    HB2  MET  57           HB2      MET  57  80.094   7.698  -7.465
  443    HB3  MET  57           HB1      MET  57  81.118   6.509  -8.268
  444    HG2  MET  57           HG2      MET  57  83.037   7.991  -7.096
  445    HG3  MET  57           HG1      MET  57  81.728   8.275  -5.949
  446    HE1  MET  57           HE1      MET  57  80.133   6.597  -5.436
  447    HE2  MET  57           HE2      MET  57  81.035   6.091  -4.009
  448    HE3  MET  57           HE3      MET  57  80.424   4.879  -5.133
  449    H    GLU  58           HN       GLU  58  81.516  10.758 -10.162
  450    HA   GLU  58           HA       GLU  58  82.112  12.578  -8.105
  451    HB2  GLU  58           HB2      GLU  58  80.350  13.056 -10.529
  452    HB3  GLU  58           HB1      GLU  58  81.142  14.307  -9.569
  453    HG2  GLU  58           HG2      GLU  58  83.315  13.584 -10.233
  454    HG3  GLU  58           HG1      GLU  58  82.689  12.074 -10.895
  455    H    GLY  59           HN       GLY  59  79.111  10.962  -8.825
  456    HA2  GLY  59           HA2      GLY  59  77.209  12.658  -7.662
  457    HA3  GLY  59           HA1      GLY  59  77.108  10.898  -7.597
  458    H1U  RCY  60           H1U      RCY  60  73.940   7.505   0.186
  459    H1S  RCY  60           H1S      RCY  60  74.979   8.803  -3.571
  460    HB1  RCY  60           HB1      RCY  60  77.169  11.702  -1.997
  461    HB2  RCY  60           HB2      RCY  60  78.184  10.832  -3.147
  462    HA   RCY  60           HA       RCY  60  77.136  13.651  -3.302
  463    HN1  RCY  60           HN1      RCY  60  76.942  13.432  -5.629
  464    H    GLY  61           HN       GLY  61  79.792  12.257  -5.124
  465    HA2  GLY  61           HA2      GLY  61  82.066  12.876  -5.067
  466    HA3  GLY  61           HA1      GLY  61  81.669  14.053  -3.814
  467    H    THR  62           HN       THR  62  83.449  11.354  -4.332
  468    HA   THR  62           HA       THR  62  83.001  10.182  -1.633
  469    HB   THR  62           HB       THR  62  84.863   8.575  -2.601
  470    HG1  THR  62           HG1      THR  62  84.545  10.293  -4.562
  471   HG21  THR  62          HG21      THR  62  83.080   7.237  -3.688
  472   HG22  THR  62          HG22      THR  62  82.022   8.648  -3.656
  473   HG23  THR  62          HG23      THR  62  82.549   7.906  -2.145
  474    H    ASP  63           HN       ASP  63  83.981  11.783  -0.311
  475    HA   ASP  63           HA       ASP  63  86.580  12.900  -0.870
  476    HB2  ASP  63           HB2      ASP  63  86.496  13.448   1.646
  477    HB3  ASP  63           HB1      ASP  63  85.220  14.134   0.640
  478    H    ILE  64           HN       ILE  64  85.558   9.844   0.266
  479    HA   ILE  64           HA       ILE  64  88.352   9.216   1.117
  480    HB   ILE  64           HB       ILE  64  85.772   8.189   2.297
  481   HG12  ILE  64          HG12      ILE  64  86.478  10.400   3.120
  482   HG13  ILE  64          HG11      ILE  64  86.695   9.180   4.375
  483   HG21  ILE  64          HG21      ILE  64  87.334   6.345   2.145
  484   HG22  ILE  64          HG22      ILE  64  87.324   6.909   3.816
  485   HG23  ILE  64          HG23      ILE  64  88.652   7.353   2.743
  486   HD11  ILE  64          HD11      ILE  64  89.111   8.997   3.238
  487   HD12  ILE  64          HD12      ILE  64  88.766  10.184   4.496
  488   HD13  ILE  64          HD13      ILE  64  88.748  10.666   2.799
  489    H    THR  65           HN       THR  65  85.329   7.913  -0.187
  490    HA   THR  65           HA       THR  65  85.078   6.370  -1.956
  491    HB   THR  65           HB       THR  65  87.955   5.555  -1.884
  492    HG1  THR  65           HG1      THR  65  87.366   7.793  -3.389
  493   HG21  THR  65          HG21      THR  65  86.149   6.271  -4.203
  494   HG22  THR  65          HG22      THR  65  86.190   4.663  -3.480
  495   HG23  THR  65          HG23      THR  65  87.634   5.322  -4.248
  496    H    VAL  66           HN       VAL  66  87.440   5.501   0.553
  497    HA   VAL  66           HA       VAL  66  86.417   2.749   0.670
  498    HB   VAL  66           HB       VAL  66  88.192   3.961   2.775
  499   HG11  VAL  66          HG11      VAL  66  87.461   1.600   2.930
  500   HG12  VAL  66          HG12      VAL  66  89.205   1.717   2.689
  501   HG13  VAL  66          HG13      VAL  66  88.154   1.288   1.339
  502   HG21  VAL  66          HG21      VAL  66  88.925   3.358  -0.098
  503   HG22  VAL  66          HG22      VAL  66  90.125   3.356   1.195
  504   HG23  VAL  66          HG23      VAL  66  89.239   4.833   0.817
  505    H    ILE  67           HN       ILE  67  86.777   5.289   3.171
  506    HA   ILE  67           HA       ILE  67  84.027   4.629   4.117
  507    HB   ILE  67           HB       ILE  67  86.518   4.852   5.829
  508   HG12  ILE  67          HG12      ILE  67  84.513   2.595   5.556
  509   HG13  ILE  67          HG11      ILE  67  86.027   2.662   4.652
  510   HG21  ILE  67          HG21      ILE  67  84.851   4.347   7.690
  511   HG22  ILE  67          HG22      ILE  67  83.577   4.752   6.540
  512   HG23  ILE  67          HG23      ILE  67  84.760   5.973   7.011
  513   HD11  ILE  67          HD11      ILE  67  86.153   1.313   6.784
  514   HD12  ILE  67          HD12      ILE  67  85.878   2.811   7.674
  515   HD13  ILE  67          HD13      ILE  67  87.327   2.625   6.685
  516    H1U  RCY  68           H1U      RCY  68  78.384   4.868   4.290
  517    H1S  RCY  68           H1S      RCY  68  80.360   8.327   1.597
  518    HB1  RCY  68           HB1      RCY  68  82.684  10.062   2.617
  519    HB2  RCY  68           HB2      RCY  68  81.559   8.954   3.401
  520    HA   RCY  68           HA       RCY  68  84.530   9.160   3.695
  521    HN1  RCY  68           HN1      RCY  68  83.307   6.625   3.210
  522    HA   PRO  69           HA       PRO  69  83.645  10.025   7.912
  523    HB2  PRO  69           HB2      PRO  69  82.815  12.689   7.719
  524    HB3  PRO  69           HB1      PRO  69  84.497  12.137   7.804
  525    HG2  PRO  69           HG2      PRO  69  82.891  12.943   5.444
  526    HG3  PRO  69           HG1      PRO  69  84.613  13.187   5.781
  527    HD2  PRO  69           HD2      PRO  69  83.748  11.289   4.044
  528    HD3  PRO  69           HD1      PRO  69  85.200  11.056   5.045
  529    H    TRP  70           HN       TRP  70  81.114  11.501   5.827
  530    HA   TRP  70           HA       TRP  70  79.101  11.419   7.859
  531    HD1  TRP  70           HD1      TRP  70  76.053  10.573   6.272
  532    HE1  TRP  70           HE1      TRP  70  75.207   9.167   4.285
  533    HE3  TRP  70           HE3      TRP  70  79.882  11.311   2.976
  534    HZ2  TRP  70           HZ2      TRP  70  76.045   8.448   1.642
  535    HZ3  TRP  70           HZ3      TRP  70  79.834  10.258   0.737
  536    HH2  TRP  70           HH2      TRP  70  77.924   8.829   0.064
  537    HB2  TRP  70           HB2      TRP  70  77.952  12.579   6.302
  538    HB3  TRP  70           HB1      TRP  70  79.309  12.350   5.205
  539    H    GLU  71           HN       GLU  71  80.634   8.888   6.352
  540    HA   GLU  71           HA       GLU  71  78.247   7.099   6.540
  541    HB2  GLU  71           HB2      GLU  71  79.087   5.989   4.747
  542    HB3  GLU  71           HB1      GLU  71  80.212   7.328   4.575
  543    HG2  GLU  71           HG2      GLU  71  81.628   5.439   4.679
  544    HG3  GLU  71           HG1      GLU  71  81.659   6.066   6.328
  545    H    ALA  72           HN       ALA  72  81.108   8.009   8.152
  546    HA   ALA  72           HA       ALA  72  81.822   5.531   9.397
  547    HB1  ALA  72           HB1      ALA  72  83.170   7.706   9.334
  548    HB2  ALA  72           HB2      ALA  72  83.163   6.836  10.868
  549    HB3  ALA  72           HB3      ALA  72  82.142   8.259  10.656
  550    H1U  RCY  73           H1U      RCY  73  77.014   4.225   4.891
  551    H1S  RCY  73           H1S      RCY  73  75.291   4.763   9.029
  552    HB1  RCY  73           HB1      RCY  73  76.138   5.063  11.608
  553    HB2  RCY  73           HB2      RCY  73  77.040   4.568  10.176
  554    HA   RCY  73           HA       RCY  73  77.916   6.860  11.952
  555    HN1  RCY  73           HN1      RCY  73  78.901   6.016   9.467
  556    H    ASN  74           HN       ASN  74  79.799   4.057  11.151
  557    HA   ASN  74           HA       ASN  74  80.559   3.498  13.834
  558    HB2  ASN  74           HB2      ASN  74  79.340   1.298  14.097
  559    HB3  ASN  74           HB1      ASN  74  78.291   2.711  14.210
  560   HD21  ASN  74          HD21      ASN  74  76.353   1.855  13.327
  561   HD22  ASN  74          HD22      ASN  74  76.239   1.223  11.756
  562    H    HIS  75           HN       HIS  75  82.028   1.604  13.887
  563    HA   HIS  75           HA       HIS  75  83.620   1.264  11.617
  564    HD1  HIS  75           HD1      HIS  75  84.707  -0.466  10.558
  565    HD2  HIS  75           HD2      HIS  75  86.475  -0.670  14.331
  566    HE1  HIS  75           HE1      HIS  75  87.171  -0.911  10.171
  567    HE2  HIS  75           HE2      HIS  75  88.258  -1.037  12.460
  568    HB2  HIS  75           HB2      HIS  75  83.802   0.303  14.123
  569    HB3  HIS  75           HB1      HIS  75  83.218  -1.159  13.329
  570    H1U  RCY  76           H1U      RCY  76  79.046   2.370   6.017
  571    H1S  RCY  76           H1S      RCY  76  79.936  -1.185   8.571
  572    HB1  RCY  76           HB1      RCY  76  80.550  -3.805  10.140
  573    HB2  RCY  76           HB2      RCY  76  81.971  -3.145  10.950
  574    HA   RCY  76           HA       RCY  76  79.894  -1.200  10.053
  575    HN1  RCY  76           HN1      RCY  76  80.928  -0.830  12.678
  576    H    GLU  77           HN       GLU  77  77.863  -1.075  10.948
  577    HA   GLU  77           HA       GLU  77  76.976  -2.155  13.380
  578    HB2  GLU  77           HB2      GLU  77  74.685  -2.278  12.122
  579    HB3  GLU  77           HB1      GLU  77  75.451  -0.707  12.342
  580    HG2  GLU  77           HG2      GLU  77  74.659  -1.031  10.008
  581    HG3  GLU  77           HG1      GLU  77  76.410  -0.827  10.088
  582    H    LEU  78           HN       LEU  78  75.631  -4.090  13.777
  583    HA   LEU  78           HA       LEU  78  75.564  -6.444  13.820
  584    HG   LEU  78           HG       LEU  78  73.386  -6.877  13.288
  585    HB2  LEU  78           HB2      LEU  78  74.921  -5.624  10.994
  586    HB3  LEU  78           HB1      LEU  78  74.990  -7.336  11.412
  587   HD11  LEU  78          HD11      LEU  78  73.757  -4.526  13.650
  588   HD12  LEU  78          HD12      LEU  78  72.101  -4.702  13.070
  589   HD13  LEU  78          HD13      LEU  78  73.365  -4.149  11.972
  590   HD21  LEU  78          HD21      LEU  78  72.728  -7.643  10.939
  591   HD22  LEU  78          HD22      LEU  78  72.289  -5.966  10.618
  592   HD23  LEU  78          HD23      LEU  78  71.451  -6.871  11.878
  593    H    HIS  79           HN       HIS  79  76.473  -7.626  10.944
  594    HA   HIS  79           HA       HIS  79  79.332  -7.286  10.978
  595    HD1  HIS  79           HD1      HIS  79  81.000  -7.936  10.511
  596    HD2  HIS  79           HD2      HIS  79  80.984 -10.965  13.379
  597    HE1  HIS  79           HE1      HIS  79  83.383  -8.779  10.675
  598    HE2  HIS  79           HE2      HIS  79  83.387 -10.624  12.417
  599    HB2  HIS  79           HB2      HIS  79  78.795  -8.676  13.103
  600    HB3  HIS  79           HB1      HIS  79  78.449  -9.993  11.985
  601    H    GLU  80           HN       GLU  80  79.064 -10.490  10.413
  602    HA   GLU  80           HA       GLU  80  78.841 -10.060   7.512
  603    HB2  GLU  80           HB2      GLU  80  79.431 -12.477   7.371
  604    HB3  GLU  80           HB1      GLU  80  80.592 -11.552   8.324
  605    HG2  GLU  80           HG2      GLU  80  79.166 -12.226  10.369
  606    HG3  GLU  80           HG1      GLU  80  78.443 -13.431   9.303
  607    H    LEU  81           HN       LEU  81  76.574 -10.443   9.858
  608    HA   LEU  81           HA       LEU  81  74.871 -12.354   8.363
  609    HG   LEU  81           HG       LEU  81  74.869  -9.661  10.676
  610    HB2  LEU  81           HB2      LEU  81  73.213 -11.786  10.229
  611    HB3  LEU  81           HB1      LEU  81  74.686 -12.617  10.727
  612   HD11  LEU  81          HD11      LEU  81  73.671  -9.416  12.822
  613   HD12  LEU  81          HD12      LEU  81  73.185 -11.110  12.743
  614   HD13  LEU  81          HD13      LEU  81  72.580  -9.963  11.548
  615   HD21  LEU  81          HD21      LEU  81  76.207 -10.040  12.629
  616   HD22  LEU  81          HD22      LEU  81  76.605 -11.339  11.505
  617   HD23  LEU  81          HD23      LEU  81  75.524 -11.649  12.864
  618    H    ALA  82           HN       ALA  82  75.405  -8.969   8.705
  619    HA   ALA  82           HA       ALA  82  72.842  -7.959   7.990
  620    HB1  ALA  82           HB1      ALA  82  75.063  -6.747   8.740
  621    HB2  ALA  82           HB2      ALA  82  73.925  -5.909   7.689
  622    HB3  ALA  82           HB3      ALA  82  75.367  -6.658   7.005
  623    H    GLN  83           HN       GLN  83  75.115  -9.764   6.181
  624    HA   GLN  83           HA       GLN  83  74.935  -8.912   3.559
  625    HB2  GLN  83           HB2      GLN  83  76.128 -10.957   4.198
  626    HB3  GLN  83           HB1      GLN  83  74.598 -11.757   4.548
  627    HG2  GLN  83           HG2      GLN  83  73.959 -11.788   2.270
  628    HG3  GLN  83           HG1      GLN  83  75.160 -10.573   1.829
  629   HE21  GLN  83          HE21      GLN  83  75.962 -13.256   3.997
  630   HE22  GLN  83          HE22      GLN  83  76.980 -14.066   2.905
  631    H    TYR  84           HN       TYR  84  72.333 -10.042   5.550
  632    HA   TYR  84           HA       TYR  84  70.517 -10.784   3.442
  633    HD1  TYR  84           HD2      TYR  84  71.567 -12.333   6.568
  634    HD2  TYR  84           HD1      TYR  84  67.904 -12.093   4.337
  635    HE1  TYR  84           HE2      TYR  84  71.421 -14.808   6.541
  636    HE2  TYR  84           HE1      TYR  84  67.759 -14.569   4.310
  637    HH   TYR  84           HH       TYR  84  69.712 -16.526   4.522
  638    HB2  TYR  84           HB2      TYR  84  70.340 -10.225   6.370
  639    HB3  TYR  84           HB1      TYR  84  68.839 -10.128   5.455
  640    H    GLY  85           HN       GLY  85  68.294  -9.030   4.489
  641    HA2  GLY  85           HA2      GLY  85  68.244  -7.090   2.478
  642    HA3  GLY  85           HA1      GLY  85  67.325  -6.958   3.975
  643    H    ILE  86           HN       ILE  86  68.985  -6.387   5.926
  644    HA   ILE  86           HA       ILE  86  69.900  -3.734   5.327
  645    HB   ILE  86           HB       ILE  86  70.864  -3.758   7.633
  646   HG12  ILE  86          HG12      ILE  86  71.509  -6.198   7.535
  647   HG13  ILE  86          HG11      ILE  86  70.653  -5.740   9.008
  648   HG21  ILE  86          HG21      ILE  86  68.706  -4.057   8.786
  649   HG22  ILE  86          HG22      ILE  86  68.075  -4.930   7.389
  650   HG23  ILE  86          HG23      ILE  86  68.480  -3.219   7.251
  651   HD11  ILE  86          HD11      ILE  86  68.552  -6.400   7.419
  652   HD12  ILE  86          HD12      ILE  86  69.352  -7.546   8.494
  653   HD13  ILE  86          HD13      ILE  86  69.780  -7.495   6.784
  654    H1U  RCY  87           H1U      RCY  87  76.775  -1.970  -3.170
  655    H1S  RCY  87           H1S      RCY  87  74.594  -4.476  -0.697
  656    HB1  RCY  87           HB1      RCY  87  72.821  -4.317   1.643
  657    HB2  RCY  87           HB2      RCY  87  72.719  -6.077   1.646
  658    HA   RCY  87           HA       RCY  87  73.688  -6.171   3.881
  659    HN1  RCY  87           HN1      RCY  87  71.172  -4.983   3.424
  Start of MODEL   38
    1    HA   MET   1           HA       MET   1  77.830 -17.622  -8.791
    2    HB2  MET   1           HB2      MET   1  77.996 -18.700 -11.609
    3    HB3  MET   1           HB1      MET   1  76.590 -17.790 -11.054
    4    HG2  MET   1           HG2      MET   1  78.276 -16.325 -12.148
    5    HG3  MET   1           HG1      MET   1  78.017 -15.891 -10.458
    6    HE1  MET   1           HE1      MET   1  81.557 -17.952 -12.434
    7    HE2  MET   1           HE2      MET   1  80.827 -16.472 -13.053
    8    HE3  MET   1           HE3      MET   1  79.859 -17.939 -12.929
    9    H    ASN   2           HN       ASN   2  76.118 -19.543 -10.962
   10    HA   ASN   2           HA       ASN   2  75.372 -21.660  -9.084
   11    HB2  ASN   2           HB2      ASN   2  73.513 -19.343  -9.667
   12    HB3  ASN   2           HB1      ASN   2  72.937 -20.903  -9.078
   13   HD21  ASN   2          HD21      ASN   2  74.845 -18.042  -8.198
   14   HD22  ASN   2          HD22      ASN   2  74.913 -18.385  -6.537
   15    H    LEU   3           HN       LEU   3  75.000 -19.984 -12.133
   16    HA   LEU   3           HA       LEU   3  74.301 -20.752 -14.239
   17    HG   LEU   3           HG       LEU   3  76.732 -22.030 -12.523
   18    HB2  LEU   3           HB2      LEU   3  74.871 -23.517 -13.149
   19    HB3  LEU   3           HB1      LEU   3  74.987 -22.965 -14.821
   20   HD11  LEU   3          HD11      LEU   3  77.147 -24.359 -13.411
   21   HD12  LEU   3          HD12      LEU   3  78.506 -23.253 -13.612
   22   HD13  LEU   3          HD13      LEU   3  77.468 -23.634 -14.986
   23   HD21  LEU   3          HD21      LEU   3  76.507 -21.234 -15.427
   24   HD22  LEU   3          HD22      LEU   3  78.011 -21.012 -14.533
   25   HD23  LEU   3          HD23      LEU   3  76.541 -20.192 -14.005
   26    H    GLU   4           HN       GLU   4  72.126 -20.155 -12.872
   27    HA   GLU   4           HA       GLU   4  70.303 -22.489 -13.285
   28    HB2  GLU   4           HB2      GLU   4  68.967 -21.716 -11.363
   29    HB3  GLU   4           HB1      GLU   4  70.618 -22.090 -10.870
   30    HG2  GLU   4           HG2      GLU   4  70.299 -20.013  -9.856
   31    HG3  GLU   4           HG1      GLU   4  71.042 -19.542 -11.386
   32    HA   PRO   5           HA       PRO   5  68.173 -19.956 -16.253
   33    HB2  PRO   5           HB2      PRO   5  65.749 -20.933 -14.777
   34    HB3  PRO   5           HB1      PRO   5  66.062 -20.895 -16.523
   35    HG2  PRO   5           HG2      PRO   5  66.276 -23.145 -15.087
   36    HG3  PRO   5           HG1      PRO   5  67.318 -22.807 -16.477
   37    HD2  PRO   5           HD2      PRO   5  68.009 -22.856 -13.603
   38    HD3  PRO   5           HD1      PRO   5  69.071 -23.003 -15.019
   39    HA   PRO   6           HA       PRO   6  67.207 -16.208 -14.063
   40    HB2  PRO   6           HB2      PRO   6  65.576 -14.952 -15.872
   41    HB3  PRO   6           HB1      PRO   6  67.331 -15.103 -16.087
   42    HG2  PRO   6           HG2      PRO   6  65.137 -16.697 -17.310
   43    HG3  PRO   6           HG1      PRO   6  66.647 -16.114 -18.030
   44    HD2  PRO   6           HD2      PRO   6  66.302 -18.699 -17.188
   45    HD3  PRO   6           HD1      PRO   6  67.884 -17.888 -17.206
   46    H    LYS   7           HN       LYS   7  65.340 -14.947 -13.149
   47    HA   LYS   7           HA       LYS   7  62.810 -16.539 -13.021
   48    HB2  LYS   7           HB2      LYS   7  62.780 -15.688 -10.542
   49    HB3  LYS   7           HB1      LYS   7  63.758 -17.096 -10.952
   50    HG2  LYS   7           HG2      LYS   7  65.755 -15.696 -11.143
   51    HG3  LYS   7           HG1      LYS   7  64.797 -14.249 -10.830
   52    HD2  LYS   7           HD2      LYS   7  64.368 -14.882  -8.586
   53    HD3  LYS   7           HD1      LYS   7  64.867 -16.549  -8.875
   54    HE2  LYS   7           HE2      LYS   7  67.190 -15.720  -9.318
   55    HE3  LYS   7           HE1      LYS   7  66.658 -14.103  -8.858
   56    HZ1  LYS   7           HZ1      LYS   7  67.400 -16.266  -7.197
   57    HZ2  LYS   7           HZ2      LYS   7  65.798 -15.811  -6.860
   58    HZ3  LYS   7           HZ3      LYS   7  67.047 -14.663  -6.766
   59    H    ALA   8           HN       ALA   8  63.508 -14.124 -14.560
   60    HA   ALA   8           HA       ALA   8  62.462 -12.098 -15.108
   61    HB1  ALA   8           HB1      ALA   8  60.433 -13.590 -14.315
   62    HB2  ALA   8           HB2      ALA   8  60.216 -11.856 -14.538
   63    HB3  ALA   8           HB3      ALA   8  60.449 -12.513 -12.919
   64    H    GLU   9           HN       GLU   9  61.865 -12.362 -11.586
   65    HA   GLU   9           HA       GLU   9  62.742 -11.074  -9.822
   66    HB2  GLU   9           HB2      GLU   9  64.848 -11.135 -11.470
   67    HB3  GLU   9           HB1      GLU   9  64.438  -9.431 -11.665
   68    HG2  GLU   9           HG2      GLU   9  64.399  -9.265  -9.129
   69    HG3  GLU   9           HG1      GLU   9  65.099 -10.884  -9.092
   70    H1U  RCY  10           H1U      RCY  10  60.065  -7.674  -8.039
   71    H1S  RCY  10           H1S      RCY  10  59.685  -5.394 -11.529
   72    HB1  RCY  10           HB1      RCY  10  58.662  -8.836 -13.166
   73    HB2  RCY  10           HB2      RCY  10  60.247  -8.330 -13.750
   74    HA   RCY  10           HA       RCY  10  60.593  -7.326 -11.400
   75    HN1  RCY  10           HN1      RCY  10  60.591 -10.269 -11.894
   76    H    ARG  11           HN       ARG  11  57.695  -7.140 -11.719
   77    HA   ARG  11           HA       ARG  11  56.819  -7.167  -9.079
   78    HE   ARG  11           HE       ARG  11  52.869  -7.702 -10.959
   79    HB2  ARG  11           HB2      ARG  11  54.478  -7.384 -10.047
   80    HB3  ARG  11           HB1      ARG  11  55.455  -6.082 -10.718
   81    HG2  ARG  11           HG2      ARG  11  54.755  -7.014 -12.703
   82    HG3  ARG  11           HG1      ARG  11  56.157  -8.047 -12.422
   83    HD2  ARG  11           HD2      ARG  11  54.090  -9.344 -12.974
   84    HD3  ARG  11           HD1      ARG  11  54.754  -9.750 -11.391
   85   HH11  ARG  11          HH21      ARG  11  53.027 -10.909 -12.215
   86   HH12  ARG  11          HH22      ARG  11  51.410 -11.316 -11.744
   87   HH21  ARG  11          HH11      ARG  11  50.757  -8.215 -10.337
   88   HH22  ARG  11          HH12      ARG  11  50.125  -9.790 -10.681
   89    H    SER  12           HN       SER  12  55.348  -8.652  -7.940
   90    HA   SER  12           HA       SER  12  54.686 -11.265  -8.735
   91    HG   SER  12           HG       SER  12  56.362 -13.447  -7.451
   92    HB2  SER  12           HB2      SER  12  56.851 -12.063  -8.955
   93    HB3  SER  12           HB1      SER  12  57.496 -10.943  -7.759
   94    H    ALA  13           HN       ALA  13  56.054  -9.434  -5.999
   95    HA   ALA  13           HA       ALA  13  53.638 -10.018  -4.426
   96    HB1  ALA  13           HB1      ALA  13  55.041 -11.989  -3.957
   97    HB2  ALA  13           HB2      ALA  13  54.908 -10.969  -2.524
   98    HB3  ALA  13           HB3      ALA  13  56.379 -10.935  -3.497
   99    H    THR  14           HN       THR  14  54.640  -7.589  -5.442
  100    HA   THR  14           HA       THR  14  54.984  -6.104  -2.927
  101    HB   THR  14           HB       THR  14  57.017  -5.653  -5.115
  102    HG1  THR  14           HG1      THR  14  57.349  -7.736  -4.396
  103   HG21  THR  14          HG21      THR  14  58.161  -4.384  -3.470
  104   HG22  THR  14          HG22      THR  14  57.212  -5.081  -2.158
  105   HG23  THR  14          HG23      THR  14  56.464  -3.941  -3.277
  106    H    ARG  15           HN       ARG  15  52.793  -6.062  -4.576
  107    HA   ARG  15           HA       ARG  15  52.697  -4.312  -6.744
  108    HE   ARG  15           HE       ARG  15  49.673  -6.484  -2.217
  109    HB2  ARG  15           HB2      ARG  15  50.374  -3.641  -5.674
  110    HB3  ARG  15           HB1      ARG  15  50.634  -5.283  -6.263
  111    HG2  ARG  15           HG2      ARG  15  51.151  -6.065  -4.023
  112    HG3  ARG  15           HG1      ARG  15  51.085  -4.419  -3.392
  113    HD2  ARG  15           HD2      ARG  15  48.746  -4.273  -3.687
  114    HD3  ARG  15           HD1      ARG  15  48.713  -5.644  -4.795
  115   HH11  ARG  15          HH21      ARG  15  46.873  -5.491  -3.967
  116   HH12  ARG  15          HH22      ARG  15  45.773  -6.397  -2.982
  117   HH21  ARG  15          HH11      ARG  15  48.253  -7.673  -0.921
  118   HH22  ARG  15          HH12      ARG  15  46.554  -7.632  -1.258
  119    H    VAL  16           HN       VAL  16  52.450  -3.407  -3.288
  120    HA   VAL  16           HA       VAL  16  53.750  -0.836  -3.897
  121    HB   VAL  16           HB       VAL  16  50.929  -0.991  -2.787
  122   HG11  VAL  16          HG11      VAL  16  51.174   1.544  -2.784
  123   HG12  VAL  16          HG12      VAL  16  52.907   1.292  -2.991
  124   HG13  VAL  16          HG13      VAL  16  52.095   0.695  -1.543
  125   HG21  VAL  16          HG21      VAL  16  50.544   0.587  -4.766
  126   HG22  VAL  16          HG22      VAL  16  50.866  -1.098  -5.176
  127   HG23  VAL  16          HG23      VAL  16  52.144   0.107  -5.332
  128    H    MET  17           HN       MET  17  54.801  -0.016  -2.070
  129    HA   MET  17           HA       MET  17  55.318  -1.809   0.095
  130    HB2  MET  17           HB2      MET  17  56.412   0.185   1.161
  131    HB3  MET  17           HB1      MET  17  56.946  -0.111  -0.492
  132    HG2  MET  17           HG2      MET  17  54.654   1.545  -0.680
  133    HG3  MET  17           HG1      MET  17  55.667   2.236   0.589
  134    HE1  MET  17           HE1      MET  17  57.984   2.506   0.521
  135    HE2  MET  17           HE2      MET  17  58.917   3.096  -0.852
  136    HE3  MET  17           HE3      MET  17  58.781   1.363  -0.567
  137    H    GLY  18           HN       GLY  18  54.736   1.171   1.527
  138    HA2  GLY  18           HA2      GLY  18  51.963   0.505   2.341
  139    HA3  GLY  18           HA1      GLY  18  53.186   0.606   3.609
  140    H    GLY  19           HN       GLY  19  50.763   2.353   2.647
  141    HA2  GLY  19           HA2      GLY  19  50.252   4.642   2.718
  142    HA3  GLY  19           HA1      GLY  19  51.774   4.849   3.588
  143    HA   PRO  20           HA       PRO  20  51.967   6.449  -0.914
  144    HB2  PRO  20           HB2      PRO  20  51.801   9.143  -0.395
  145    HB3  PRO  20           HB1      PRO  20  50.395   8.130  -0.774
  146    HG2  PRO  20           HG2      PRO  20  51.368   9.101   1.863
  147    HG3  PRO  20           HG1      PRO  20  49.710   8.932   1.260
  148    HD2  PRO  20           HD2      PRO  20  50.862   7.128   2.970
  149    HD3  PRO  20           HD1      PRO  20  49.599   6.684   1.800
  150    H1U  RCY  21           H1U      RCY  21  59.977   2.343  -0.645
  151    H1S  RCY  21           H1S      RCY  21  58.122   5.766  -2.526
  152    HB1  RCY  21           HB1      RCY  21  56.255   7.073  -2.451
  153    HB2  RCY  21           HB2      RCY  21  56.326   6.243  -0.897
  154    HA   RCY  21           HA       RCY  21  55.907   8.396   0.258
  155    HN1  RCY  21           HN1      RCY  21  53.730   7.981  -1.738
  156    H    THR  22           HN       THR  22  56.508  10.492   0.124
  157    HA   THR  22           HA       THR  22  56.064  11.955  -2.439
  158    HB   THR  22           HB       THR  22  56.447  13.986  -0.923
  159    HG1  THR  22           HG1      THR  22  57.281  12.300   0.724
  160   HG21  THR  22          HG21      THR  22  54.132  12.077  -0.566
  161   HG22  THR  22          HG22      THR  22  54.217  13.500  -1.605
  162   HG23  THR  22          HG23      THR  22  54.143  13.690   0.147
  163    HA   PRO  23           HA       PRO  23  60.562  11.294  -2.910
  164    HB2  PRO  23           HB2      PRO  23  60.026  13.288  -5.078
  165    HB3  PRO  23           HB1      PRO  23  60.936  11.766  -5.144
  166    HG2  PRO  23           HG2      PRO  23  58.482  11.959  -6.154
  167    HG3  PRO  23           HG1      PRO  23  59.033  10.485  -5.341
  168    HD2  PRO  23           HD2      PRO  23  57.132  12.572  -4.366
  169    HD3  PRO  23           HD1      PRO  23  57.187  10.834  -3.998
  170    H    ARG  24           HN       ARG  24  62.036  13.508  -4.001
  171    HA   ARG  24           HA       ARG  24  62.983  15.578  -3.410
  172    HE   ARG  24           HE       ARG  24  59.127  18.632  -2.240
  173    HB2  ARG  24           HB2      ARG  24  60.394  16.072  -2.902
  174    HB3  ARG  24           HB1      ARG  24  60.984  16.070  -1.240
  175    HG2  ARG  24           HG2      ARG  24  62.893  17.601  -2.284
  176    HG3  ARG  24           HG1      ARG  24  61.645  17.935  -3.485
  177    HD2  ARG  24           HD2      ARG  24  61.544  18.423  -0.505
  178    HD3  ARG  24           HD1      ARG  24  61.337  19.593  -1.809
  179   HH11  ARG  24          HH21      ARG  24  60.854  17.444   0.497
  180   HH12  ARG  24          HH22      ARG  24  59.448  16.786   1.266
  181   HH21  ARG  24          HH11      ARG  24  57.281  17.780  -1.252
  182   HH22  ARG  24          HH12      ARG  24  57.425  16.977   0.276
  183    H    LYS  25           HN       LYS  25  63.012  16.634  -0.680
  184    HA   LYS  25           HA       LYS  25  64.360  16.377   1.193
  185    HB2  LYS  25           HB2      LYS  25  62.314  14.591   1.365
  186    HB3  LYS  25           HB1      LYS  25  63.686  13.488   1.441
  187    HG2  LYS  25           HG2      LYS  25  63.157  15.862   3.249
  188    HG3  LYS  25           HG1      LYS  25  63.148  14.158   3.705
  189    HD2  LYS  25           HD2      LYS  25  65.554  14.007   3.095
  190    HD3  LYS  25           HD1      LYS  25  65.550  15.733   2.729
  191    HE2  LYS  25           HE2      LYS  25  66.390  15.454   4.982
  192    HE3  LYS  25           HE1      LYS  25  64.777  16.158   5.086
  193    HZ1  LYS  25           HZ1      LYS  25  65.131  14.302   6.642
  194    HZ2  LYS  25           HZ2      LYS  25  65.366  13.258   5.323
  195    HZ3  LYS  25           HZ3      LYS  25  63.861  14.011   5.556
  196    H    GLY  26           HN       GLY  26  65.843  16.186  -1.096
  197    HA2  GLY  26           HA2      GLY  26  67.304  13.768  -1.464
  198    HA3  GLY  26           HA1      GLY  26  67.887  15.372  -1.912
  199    HA   PRO  27           HA       PRO  27  69.756  13.325   2.204
  200    HB2  PRO  27           HB2      PRO  27  72.007  12.816   0.294
  201    HB3  PRO  27           HB1      PRO  27  71.463  11.846   1.676
  202    HG2  PRO  27           HG2      PRO  27  70.911  11.148  -0.841
  203    HG3  PRO  27           HG1      PRO  27  69.780  10.847   0.487
  204    HD2  PRO  27           HD2      PRO  27  69.603  12.843  -1.709
  205    HD3  PRO  27           HD1      PRO  27  68.303  12.088  -0.762
  206    HA   PRO  28           HA       PRO  28  71.906  17.058   3.227
  207    HB2  PRO  28           HB2      PRO  28  74.329  15.329   3.635
  208    HB3  PRO  28           HB1      PRO  28  73.664  16.597   4.685
  209    HG2  PRO  28           HG2      PRO  28  73.272  13.995   5.177
  210    HG3  PRO  28           HG1      PRO  28  72.050  15.221   5.550
  211    HD2  PRO  28           HD2      PRO  28  72.014  13.140   3.451
  212    HD3  PRO  28           HD1      PRO  28  70.662  14.057   4.150
  213    H    LYS  29           HN       LYS  29  73.767  18.438   2.480
  214    HA   LYS  29           HA       LYS  29  74.066  18.584  -0.271
  215    HB2  LYS  29           HB2      LYS  29  76.156  19.871   0.143
  216    HB3  LYS  29           HB1      LYS  29  74.839  20.370   1.200
  217    HG2  LYS  29           HG2      LYS  29  76.130  19.925   2.991
  218    HG3  LYS  29           HG1      LYS  29  76.189  18.230   2.505
  219    HD2  LYS  29           HD2      LYS  29  78.050  18.918   0.882
  220    HD3  LYS  29           HD1      LYS  29  78.108  20.445   1.765
  221    HE2  LYS  29           HE2      LYS  29  79.759  18.940   2.721
  222    HE3  LYS  29           HE1      LYS  29  78.447  19.143   3.881
  223    HZ1  LYS  29           HZ1      LYS  29  78.051  16.981   3.812
  224    HZ2  LYS  29           HZ2      LYS  29  79.390  16.774   2.787
  225    HZ3  LYS  29           HZ3      LYS  29  77.844  17.021   2.129
  226    H1U  RCY  30           H1U      RCY  30  75.743   9.974  -5.443
  227    H1S  RCY  30           H1S      RCY  30  73.627  12.685  -2.994
  228    HB1  RCY  30           HB1      RCY  30  74.716  13.778  -1.118
  229    HB2  RCY  30           HB2      RCY  30  75.960  13.441  -2.322
  230    HA   RCY  30           HA       RCY  30  76.764  14.969  -0.518
  231    HN1  RCY  30           HN1      RCY  30  74.410  16.577  -1.281
  232    H    LYS  31           HN       LYS  31  78.723  15.468  -1.365
  233    HA   LYS  31           HA       LYS  31  78.852  17.071  -3.860
  234    HB2  LYS  31           HB2      LYS  31  81.314  17.192  -3.274
  235    HB3  LYS  31           HB1      LYS  31  80.235  17.918  -2.083
  236    HG2  LYS  31           HG2      LYS  31  80.815  15.031  -1.706
  237    HG3  LYS  31           HG1      LYS  31  82.168  16.129  -1.430
  238    HD2  LYS  31           HD2      LYS  31  80.956  17.352   0.232
  239    HD3  LYS  31           HD1      LYS  31  79.439  16.560  -0.197
  240    HE2  LYS  31           HE2      LYS  31  81.865  15.203   1.016
  241    HE3  LYS  31           HE1      LYS  31  80.362  15.577   1.859
  242    HZ1  LYS  31           HZ1      LYS  31  79.832  13.502   1.228
  243    HZ2  LYS  31           HZ2      LYS  31  80.941  13.479  -0.059
  244    HZ3  LYS  31           HZ3      LYS  31  79.435  14.243  -0.245
  245    H    GLN  32           HN       GLN  32  78.303  14.029  -3.550
  246    HA   GLN  32           HA       GLN  32  80.609  12.806  -4.871
  247    HB2  GLN  32           HB2      GLN  32  77.920  11.899  -3.929
  248    HB3  GLN  32           HB1      GLN  32  78.700  10.947  -5.191
  249    HG2  GLN  32           HG2      GLN  32  80.162  11.752  -2.671
  250    HG3  GLN  32           HG1      GLN  32  79.206  10.272  -2.761
  251   HE21  GLN  32          HE21      GLN  32  79.807   9.595  -5.515
  252   HE22  GLN  32          HE22      GLN  32  81.448   9.169  -5.594
  253    H    ARG  33           HN       ARG  33  79.941  11.429  -6.955
  254    HA   ARG  33           HA       ARG  33  78.071  12.805  -8.740
  255    HE   ARG  33           HE       ARG  33  81.405  16.479  -8.527
  256    HB2  ARG  33           HB2      ARG  33  80.864  13.561  -8.676
  257    HB3  ARG  33           HB1      ARG  33  80.492  12.823 -10.232
  258    HG2  ARG  33           HG2      ARG  33  78.708  14.379 -10.640
  259    HG3  ARG  33           HG1      ARG  33  78.783  14.990  -8.987
  260    HD2  ARG  33           HD2      ARG  33  81.329  15.137 -10.482
  261    HD3  ARG  33           HD1      ARG  33  80.042  16.170 -11.103
  262   HH11  ARG  33          HH21      ARG  33  78.631  17.103 -10.477
  263   HH12  ARG  33          HH22      ARG  33  78.156  18.510  -9.586
  264   HH21  ARG  33          HH11      ARG  33  80.802  18.314  -7.352
  265   HH22  ARG  33          HH12      ARG  33  79.385  19.196  -7.817
  266    H    GLN  34           HN       GLN  34  79.854  10.138  -7.753
  267    HA   GLN  34           HA       GLN  34  78.579   8.375  -9.620
  268    HB2  GLN  34           HB2      GLN  34  80.859   7.617 -10.654
  269    HB3  GLN  34           HB1      GLN  34  80.048   9.029 -11.330
  270    HG2  GLN  34           HG2      GLN  34  81.518  10.535 -10.286
  271    HG3  GLN  34           HG1      GLN  34  82.033   9.346  -9.088
  272   HE21  GLN  34          HE21      GLN  34  83.509  10.966 -11.342
  273   HE22  GLN  34          HE22      GLN  34  84.444   9.776 -12.110
  274    H    THR  35           HN       THR  35  81.864   7.569  -8.972
  275    HA   THR  35           HA       THR  35  81.436   6.512  -6.296
  276    HB   THR  35           HB       THR  35  80.173   4.837  -7.577
  277    HG1  THR  35           HG1      THR  35  82.098   3.141  -7.218
  278   HG21  THR  35          HG21      THR  35  81.066   3.667  -9.421
  279   HG22  THR  35          HG22      THR  35  82.717   4.164  -9.048
  280   HG23  THR  35          HG23      THR  35  81.569   5.334  -9.699
  281    H    ARG  36           HN       ARG  36  83.386   4.268  -7.033
  282    HA   ARG  36           HA       ARG  36  85.718   4.022  -6.929
  283    HE   ARG  36           HE       ARG  36  89.694   4.292  -9.629
  284    HB2  ARG  36           HB2      ARG  36  85.243   4.921  -9.325
  285    HB3  ARG  36           HB1      ARG  36  85.889   6.445  -8.719
  286    HG2  ARG  36           HG2      ARG  36  87.932   5.165  -7.949
  287    HG3  ARG  36           HG1      ARG  36  87.302   3.767  -8.820
  288    HD2  ARG  36           HD2      ARG  36  87.358   4.979 -10.921
  289    HD3  ARG  36           HD1      ARG  36  87.809   6.470 -10.094
  290   HH11  ARG  36          HH21      ARG  36  88.680   6.862 -11.691
  291   HH12  ARG  36          HH22      ARG  36  90.246   7.092 -12.396
  292   HH21  ARG  36          HH11      ARG  36  91.744   4.576 -10.539
  293   HH22  ARG  36          HH12      ARG  36  91.980   5.797 -11.744
  294    H    GLN  37           HN       GLN  37  84.524   5.638  -4.867
  295    HA   GLN  37           HA       GLN  37  86.919   7.191  -4.096
  296    HB2  GLN  37           HB2      GLN  37  84.940   8.593  -5.288
  297    HB3  GLN  37           HB1      GLN  37  84.324   8.594  -3.636
  298    HG2  GLN  37           HG2      GLN  37  85.683  10.512  -3.682
  299    HG3  GLN  37           HG1      GLN  37  86.752   9.295  -2.982
  300   HE21  GLN  37          HE21      GLN  37  87.694  11.632  -4.458
  301   HE22  GLN  37          HE22      GLN  37  88.482  11.063  -5.850
  302    H1U  RCY  38           H1U      RCY  38  83.393   2.373  -4.270
  303    H1S  RCY  38           H1S      RCY  38  81.822   6.725  -2.857
  304    HB1  RCY  38           HB1      RCY  38  83.613   6.738   0.896
  305    HB2  RCY  38           HB2      RCY  38  83.775   5.575  -0.420
  306    HA   RCY  38           HA       RCY  38  85.687   7.705   0.483
  307    HN1  RCY  38           HN1      RCY  38  86.212   8.225  -1.742
  308    H    LYS  39           HN       LYS  39  87.891   6.746   0.483
  309    HA   LYS  39           HA       LYS  39  87.758   3.886   1.222
  310    HB2  LYS  39           HB2      LYS  39  89.911   3.558  -0.206
  311    HB3  LYS  39           HB1      LYS  39  88.353   3.547  -1.034
  312    HG2  LYS  39           HG2      LYS  39  88.625   5.867  -1.694
  313    HG3  LYS  39           HG1      LYS  39  90.101   6.006  -0.739
  314    HD2  LYS  39           HD2      LYS  39  91.059   4.131  -2.170
  315    HD3  LYS  39           HD1      LYS  39  89.661   4.339  -3.225
  316    HE2  LYS  39           HE2      LYS  39  90.267   6.748  -3.484
  317    HE3  LYS  39           HE1      LYS  39  91.720   6.454  -2.528
  318    HZ1  LYS  39           HZ1      LYS  39  91.226   5.892  -5.274
  319    HZ2  LYS  39           HZ2      LYS  39  91.708   4.491  -4.444
  320    HZ3  LYS  39           HZ3      LYS  39  92.692   5.875  -4.420
  321    H    SER  40           HN       SER  40  88.944   3.615   3.050
  322    HA   SER  40           HA       SER  40  91.540   4.493   3.566
  323    HG   SER  40           HG       SER  40  91.533   6.403   2.605
  324    HB2  SER  40           HB2      SER  40  89.485   6.599   4.030
  325    HB3  SER  40           HB1      SER  40  90.720   6.417   5.273
  326    H    LYS  41           HN       LYS  41  88.652   5.009   5.618
  327    HA   LYS  41           HA       LYS  41  89.721   3.656   7.871
  328    HB2  LYS  41           HB2      LYS  41  86.776   3.788   7.203
  329    HB3  LYS  41           HB1      LYS  41  87.525   3.764   8.799
  330    HG2  LYS  41           HG2      LYS  41  87.680   5.999   6.757
  331    HG3  LYS  41           HG1      LYS  41  86.852   6.044   8.314
  332    HD2  LYS  41           HD2      LYS  41  89.157   5.508   9.345
  333    HD3  LYS  41           HD1      LYS  41  89.820   5.966   7.775
  334    HE2  LYS  41           HE2      LYS  41  88.448   8.126   8.011
  335    HE3  LYS  41           HE1      LYS  41  88.242   7.675   9.703
  336    HZ1  LYS  41           HZ1      LYS  41  90.179   8.721   9.987
  337    HZ2  LYS  41           HZ2      LYS  41  90.573   8.673   8.335
  338    HZ3  LYS  41           HZ3      LYS  41  90.885   7.328   9.325
  339    HA   PRO  42           HA       PRO  42  89.233  -0.468   6.080
  340    HB2  PRO  42           HB2      PRO  42  90.640  -1.840   7.953
  341    HB3  PRO  42           HB1      PRO  42  91.430  -0.838   6.719
  342    HG2  PRO  42           HG2      PRO  42  90.899  -0.233   9.582
  343    HG3  PRO  42           HG1      PRO  42  92.309   0.160   8.586
  344    HD2  PRO  42           HD2      PRO  42  90.282   1.954   9.193
  345    HD3  PRO  42           HD1      PRO  42  91.360   2.099   7.788
  346    HA   PRO  43           HA       PRO  43  85.870  -2.143   8.445
  347    HB2  PRO  43           HB2      PRO  43  85.972  -4.781   7.768
  348    HB3  PRO  43           HB1      PRO  43  85.478  -3.517   6.623
  349    HG2  PRO  43           HG2      PRO  43  88.104  -4.896   6.887
  350    HG3  PRO  43           HG1      PRO  43  87.210  -4.440   5.427
  351    HD2  PRO  43           HD2      PRO  43  89.322  -2.985   6.407
  352    HD3  PRO  43           HD1      PRO  43  88.001  -2.268   5.458
  353    H    LYS  44           HN       LYS  44  85.322  -3.735  10.189
  354    HA   LYS  44           HA       LYS  44  85.789  -4.883  12.179
  355    HB2  LYS  44           HB2      LYS  44  87.404  -6.101  10.480
  356    HB3  LYS  44           HB1      LYS  44  88.654  -5.228  11.366
  357    HG2  LYS  44           HG2      LYS  44  87.673  -6.151  13.499
  358    HG3  LYS  44           HG1      LYS  44  86.625  -7.164  12.506
  359    HD2  LYS  44           HD2      LYS  44  88.631  -8.147  11.423
  360    HD3  LYS  44           HD1      LYS  44  89.658  -7.172  12.475
  361    HE2  LYS  44           HE2      LYS  44  88.874  -8.302  14.437
  362    HE3  LYS  44           HE1      LYS  44  87.574  -9.089  13.543
  363    HZ1  LYS  44           HZ1      LYS  44  89.329 -10.193  12.199
  364    HZ2  LYS  44           HZ2      LYS  44  89.315 -10.656  13.833
  365    HZ3  LYS  44           HZ3      LYS  44  90.489  -9.566  13.267
  366    H    LYS  45           HN       LYS  45  85.719  -2.301  12.566
  367    HA   LYS  45           HA       LYS  45  87.729  -1.823  14.622
  368    HB2  LYS  45           HB2      LYS  45  89.063  -1.063  12.767
  369    HB3  LYS  45           HB1      LYS  45  87.708  -0.158  12.091
  370    HG2  LYS  45           HG2      LYS  45  87.786   1.471  13.798
  371    HG3  LYS  45           HG1      LYS  45  88.744   0.438  14.859
  372    HD2  LYS  45           HD2      LYS  45  89.901   1.179  12.203
  373    HD3  LYS  45           HD1      LYS  45  89.881   2.405  13.471
  374    HE2  LYS  45           HE2      LYS  45  91.040  -0.383  13.763
  375    HE3  LYS  45           HE1      LYS  45  91.982   1.086  13.506
  376    HZ1  LYS  45           HZ1      LYS  45  90.564   0.177  15.886
  377    HZ2  LYS  45           HZ2      LYS  45  90.545   1.847  15.575
  378    HZ3  LYS  45           HZ3      LYS  45  92.024   1.031  15.752
  379    H    GLY  46           HN       GLY  46  85.946   0.559  12.670
  380    HA2  GLY  46           HA2      GLY  46  84.109   1.912  13.236
  381    HA3  GLY  46           HA1      GLY  46  83.694   0.720  14.468
  382    H    VAL  47           HN       VAL  47  84.872   3.847  13.968
  383    HA   VAL  47           HA       VAL  47  86.622   4.167  16.206
  384    HB   VAL  47           HB       VAL  47  85.844   6.615  16.043
  385   HG11  VAL  47          HG11      VAL  47  87.040   6.938  13.915
  386   HG12  VAL  47          HG12      VAL  47  86.853   5.225  13.542
  387   HG13  VAL  47          HG13      VAL  47  87.854   5.726  14.905
  388   HG21  VAL  47          HG21      VAL  47  84.432   7.220  14.211
  389   HG22  VAL  47          HG22      VAL  47  83.608   5.891  15.026
  390   HG23  VAL  47          HG23      VAL  47  84.497   5.593  13.533
  391    H    GLN  48           HN       GLN  48  83.472   3.192  16.238
  392    HA   GLN  48           HA       GLN  48  81.847   3.089  17.926
  393    HB2  GLN  48           HB2      GLN  48  84.070   2.491  19.176
  394    HB3  GLN  48           HB1      GLN  48  83.912   4.104  19.871
  395    HG2  GLN  48           HG2      GLN  48  81.513   3.446  20.483
  396    HG3  GLN  48           HG1      GLN  48  81.979   1.790  20.092
  397   HE21  GLN  48          HE21      GLN  48  84.755   2.079  21.073
  398   HE22  GLN  48          HE22      GLN  48  84.661   2.153  22.766
  399    H    GLY  49           HN       GLY  49  82.458   5.652  16.467
  400    HA2  GLY  49           HA2      GLY  49  81.101   7.483  18.402
  401    HA3  GLY  49           HA1      GLY  49  82.435   8.063  17.401
  402    H1U  RCY  50           H1U      RCY  50  77.351   2.279  10.087
  403    H1S  RCY  50           H1S      RCY  50  80.707   5.049  12.248
  404    HB1  RCY  50           HB1      RCY  50  80.990   7.185  12.576
  405    HB2  RCY  50           HB2      RCY  50  79.238   7.380  12.550
  406    HA   RCY  50           HA       RCY  50  80.658   9.333  13.499
  407    HN1  RCY  50           HN1      RCY  50  82.070   8.445  15.191
  408    H    GLY  51           HN       GLY  51  78.101   7.139  14.196
  409    HA2  GLY  51           HA2      GLY  51  75.867   7.537  14.795
  410    HA3  GLY  51           HA1      GLY  51  76.551   8.529  16.082
  411    H    ASP  52           HN       ASP  52  76.969  10.804  15.602
  412    HA   ASP  52           HA       ASP  52  74.903  12.241  14.476
  413    HB2  ASP  52           HB2      ASP  52  76.995  13.096  15.730
  414    HB3  ASP  52           HB1      ASP  52  77.753  13.180  14.140
  415    H    ASP  53           HN       ASP  53  74.614  13.327  12.411
  416    HA   ASP  53           HA       ASP  53  75.372  11.630  10.152
  417    HB2  ASP  53           HB2      ASP  53  73.987  14.310   9.978
  418    HB3  ASP  53           HB1      ASP  53  73.860  12.941   8.872
  419    H    ILE  54           HN       ILE  54  77.748  12.410  11.013
  420    HA   ILE  54           HA       ILE  54  78.843  14.881  10.395
  421    HB   ILE  54           HB       ILE  54  80.837  13.244   9.473
  422   HG12  ILE  54          HG12      ILE  54  80.682  11.162  10.856
  423   HG13  ILE  54          HG11      ILE  54  79.021  11.595  11.260
  424   HG21  ILE  54          HG21      ILE  54  81.144  14.720  11.339
  425   HG22  ILE  54          HG22      ILE  54  81.505  13.096  11.925
  426   HG23  ILE  54          HG23      ILE  54  79.955  13.847  12.305
  427   HD11  ILE  54          HD11      ILE  54  79.985  11.321   8.406
  428   HD12  ILE  54          HD12      ILE  54  78.320  11.409   8.980
  429   HD13  ILE  54          HD13      ILE  54  79.291   9.975   9.309
  430    HA   PRO  55           HA       PRO  55  77.825  14.807   5.975
  431    HB2  PRO  55           HB2      PRO  55  78.020  17.478   5.538
  432    HB3  PRO  55           HB1      PRO  55  76.620  16.749   6.348
  433    HG2  PRO  55           HG2      PRO  55  78.929  18.206   7.520
  434    HG3  PRO  55           HG1      PRO  55  77.223  18.221   7.994
  435    HD2  PRO  55           HD2      PRO  55  79.204  16.751   9.282
  436    HD3  PRO  55           HD1      PRO  55  77.465  16.396   9.368
  437    H    GLY  56           HN       GLY  56  80.102  13.710   5.978
  438    HA2  GLY  56           HA2      GLY  56  81.794  15.209   4.144
  439    HA3  GLY  56           HA1      GLY  56  82.545  14.978   5.723
  440    H    MET  57           HN       MET  57  81.442  12.395   6.281
  441    HA   MET  57           HA       MET  57  82.083  10.156   5.967
  442    HB2  MET  57           HB2      MET  57  81.633  10.975   3.080
  443    HB3  MET  57           HB1      MET  57  81.760   9.311   3.653
  444    HG2  MET  57           HG2      MET  57  79.789   9.588   5.050
  445    HG3  MET  57           HG1      MET  57  79.701  11.303   4.648
  446    HE1  MET  57           HE1      MET  57  76.670  10.494   2.647
  447    HE2  MET  57           HE2      MET  57  77.508  11.539   3.791
  448    HE3  MET  57           HE3      MET  57  77.081   9.895   4.259
  449    H    GLU  58           HN       GLU  58  83.409  10.878   2.827
  450    HA   GLU  58           HA       GLU  58  85.615  10.801   2.038
  451    HB2  GLU  58           HB2      GLU  58  85.680  12.763   3.769
  452    HB3  GLU  58           HB1      GLU  58  86.553  11.617   4.784
  453    HG2  GLU  58           HG2      GLU  58  88.250  12.758   3.581
  454    HG3  GLU  58           HG1      GLU  58  88.065  11.221   2.737
  455    H    GLY  59           HN       GLY  59  84.458   8.411   3.138
  456    HA2  GLY  59           HA2      GLY  59  86.524   6.593   3.138
  457    HA3  GLY  59           HA1      GLY  59  86.459   7.110   4.824
  458    H1U  RCY  60           H1U      RCY  60  76.392   4.483   0.771
  459    H1S  RCY  60           H1S      RCY  60  80.380   6.967   1.814
  460    HB1  RCY  60           HB1      RCY  60  81.827   3.370   2.750
  461    HB2  RCY  60           HB2      RCY  60  82.966   4.301   1.776
  462    HA   RCY  60           HA       RCY  60  83.230   4.033   4.778
  463    HN1  RCY  60           HN1      RCY  60  85.503   4.644   3.003
  464    H    GLY  61           HN       GLY  61  84.016   2.608   1.625
  465    HA2  GLY  61           HA2      GLY  61  85.837   0.663   2.080
  466    HA3  GLY  61           HA1      GLY  61  84.451   0.012   2.957
  467    H    THR  62           HN       THR  62  85.160   1.458  -0.250
  468    HA   THR  62           HA       THR  62  82.936   0.077  -1.513
  469    HB   THR  62           HB       THR  62  84.292   0.772  -3.640
  470    HG1  THR  62           HG1      THR  62  85.504   2.742  -2.292
  471   HG21  THR  62          HG21      THR  62  83.244   2.802  -1.647
  472   HG22  THR  62          HG22      THR  62  82.299   1.956  -2.872
  473   HG23  THR  62          HG23      THR  62  83.527   3.125  -3.357
  474    H    ASP  63           HN       ASP  63  83.583  -2.107  -0.605
  475    HA   ASP  63           HA       ASP  63  85.914  -3.509  -1.253
  476    HB2  ASP  63           HB2      ASP  63  84.256  -4.556   0.147
  477    HB3  ASP  63           HB1      ASP  63  83.049  -4.480  -1.133
  478    H    ILE  64           HN       ILE  64  82.964  -3.165  -3.263
  479    HA   ILE  64           HA       ILE  64  84.512  -4.236  -5.552
  480    HB   ILE  64           HB       ILE  64  81.604  -4.070  -4.923
  481   HG12  ILE  64          HG12      ILE  64  82.882  -6.174  -4.683
  482   HG13  ILE  64          HG11      ILE  64  81.654  -6.322  -5.941
  483   HG21  ILE  64          HG21      ILE  64  81.423  -4.640  -7.539
  484   HG22  ILE  64          HG22      ILE  64  82.822  -3.568  -7.599
  485   HG23  ILE  64          HG23      ILE  64  81.295  -2.988  -6.933
  486   HD11  ILE  64          HD11      ILE  64  83.364  -7.069  -7.236
  487   HD12  ILE  64          HD12      ILE  64  84.591  -6.386  -6.169
  488   HD13  ILE  64          HD13      ILE  64  83.796  -5.364  -7.367
  489    H    THR  65           HN       THR  65  81.887  -1.905  -5.673
  490    HA   THR  65           HA       THR  65  83.359   0.478  -5.986
  491    HB   THR  65           HB       THR  65  84.229  -0.862  -8.031
  492    HG1  THR  65           HG1      THR  65  84.643   1.220  -8.202
  493   HG21  THR  65          HG21      THR  65  81.592  -0.027  -9.233
  494   HG22  THR  65          HG22      THR  65  81.815  -1.632  -8.537
  495   HG23  THR  65          HG23      THR  65  82.807  -1.116  -9.901
  496    H    VAL  66           HN       VAL  66  80.673  -1.449  -7.209
  497    HA   VAL  66           HA       VAL  66  78.818   0.737  -6.439
  498    HB   VAL  66           HB       VAL  66  77.465   0.218  -8.531
  499   HG11  VAL  66          HG11      VAL  66  80.157   1.547  -8.544
  500   HG12  VAL  66          HG12      VAL  66  78.555   2.276  -8.654
  501   HG13  VAL  66          HG13      VAL  66  79.241   1.438 -10.047
  502   HG21  VAL  66          HG21      VAL  66  79.540  -1.738  -8.804
  503   HG22  VAL  66          HG22      VAL  66  79.652  -0.621 -10.164
  504   HG23  VAL  66          HG23      VAL  66  78.143  -1.479  -9.848
  505    H    ILE  67           HN       ILE  67  79.439  -2.667  -7.170
  506    HA   ILE  67           HA       ILE  67  77.103  -3.341  -5.431
  507    HB   ILE  67           HB       ILE  67  77.809  -4.707  -8.042
  508   HG12  ILE  67          HG12      ILE  67  75.324  -3.150  -7.275
  509   HG13  ILE  67          HG11      ILE  67  76.663  -2.456  -8.189
  510   HG21  ILE  67          HG21      ILE  67  75.607  -5.900  -7.538
  511   HG22  ILE  67          HG22      ILE  67  75.751  -5.269  -5.897
  512   HG23  ILE  67          HG23      ILE  67  76.979  -6.364  -6.531
  513   HD11  ILE  67          HD11      ILE  67  76.348  -4.027  -9.989
  514   HD12  ILE  67          HD12      ILE  67  74.769  -3.335  -9.616
  515   HD13  ILE  67          HD13      ILE  67  75.179  -4.953  -9.047
  516    H1U  RCY  68           H1U      RCY  68  74.180  -1.305  -1.439
  517    H1S  RCY  68           H1S      RCY  68  78.359  -3.338  -2.706
  518    HB1  RCY  68           HB1      RCY  68  80.822  -3.910  -2.453
  519    HB2  RCY  68           HB2      RCY  68  81.170  -5.499  -1.773
  520    HA   RCY  68           HA       RCY  68  80.672  -5.856  -4.094
  521    HN1  RCY  68           HN1      RCY  68  78.644  -3.785  -3.740
  522    HA   PRO  69           HA       PRO  69  78.120  -9.385  -3.357
  523    HB2  PRO  69           HB2      PRO  69  79.794 -10.842  -1.647
  524    HB3  PRO  69           HB1      PRO  69  79.865 -10.861  -3.418
  525    HG2  PRO  69           HG2      PRO  69  81.543  -9.377  -1.477
  526    HG3  PRO  69           HG1      PRO  69  81.976 -10.089  -3.040
  527    HD2  PRO  69           HD2      PRO  69  81.626  -7.411  -2.721
  528    HD3  PRO  69           HD1      PRO  69  81.230  -8.242  -4.243
  529    H    TRP  70           HN       TRP  70  79.186  -7.355  -0.806
  530    HA   TRP  70           HA       TRP  70  77.714  -8.718   1.323
  531    HD1  TRP  70           HD1      TRP  70  76.620  -8.161   3.089
  532    HE1  TRP  70           HE1      TRP  70  76.987  -8.348   5.633
  533    HE3  TRP  70           HE3      TRP  70  81.174  -5.887   3.492
  534    HZ2  TRP  70           HZ2      TRP  70  78.955  -7.626   7.585
  535    HZ3  TRP  70           HZ3      TRP  70  82.270  -5.650   5.699
  536    HH2  TRP  70           HH2      TRP  70  81.170  -6.515   7.744
  537    HB2  TRP  70           HB2      TRP  70  79.784  -7.033   1.424
  538    HB3  TRP  70           HB1      TRP  70  78.505  -5.828   1.509
  539    H    GLU  71           HN       GLU  71  76.798  -6.930  -1.332
  540    HA   GLU  71           HA       GLU  71  74.690  -5.327  -0.121
  541    HB2  GLU  71           HB2      GLU  71  75.563  -6.008  -2.906
  542    HB3  GLU  71           HB1      GLU  71  73.923  -5.399  -2.680
  543    HG2  GLU  71           HG2      GLU  71  74.888  -3.464  -1.399
  544    HG3  GLU  71           HG1      GLU  71  76.498  -4.039  -1.835
  545    H    ALA  72           HN       ALA  72  74.877  -8.497  -1.706
  546    HA   ALA  72           HA       ALA  72  72.091  -9.018  -1.882
  547    HB1  ALA  72           HB1      ALA  72  72.684 -11.329  -2.100
  548    HB2  ALA  72           HB2      ALA  72  74.195 -11.092  -1.223
  549    HB3  ALA  72           HB3      ALA  72  73.998 -10.416  -2.839
  550    H1U  RCY  73           H1U      RCY  73  73.910  -5.675   5.222
  551    H1S  RCY  73           H1S      RCY  73  69.918  -7.066   4.572
  552    HB1  RCY  73           HB1      RCY  73  68.801 -10.237   2.413
  553    HB2  RCY  73           HB2      RCY  73  68.866  -9.377   0.876
  554    HA   RCY  73           HA       RCY  73  71.249  -8.899   2.503
  555    HN1  RCY  73           HN1      RCY  73  70.644  -9.037  -0.239
  556    H    ASN  74           HN       ASN  74  72.919 -10.465   2.922
  557    HA   ASN  74           HA       ASN  74  72.157 -13.327   2.698
  558    HB2  ASN  74           HB2      ASN  74  74.476 -12.328   2.052
  559    HB3  ASN  74           HB1      ASN  74  74.774 -12.296   3.790
  560   HD21  ASN  74          HD21      ASN  74  72.713 -14.826   3.505
  561   HD22  ASN  74          HD22      ASN  74  73.814 -16.093   3.256
  562    H    HIS  75           HN       HIS  75  70.476 -12.441   4.461
  563    HA   HIS  75           HA       HIS  75  69.736 -12.820   6.660
  564    HD1  HIS  75           HD1      HIS  75  69.460 -15.202   5.591
  565    HD2  HIS  75           HD2      HIS  75  73.586 -15.727   5.904
  566    HE1  HIS  75           HE1      HIS  75  70.077 -17.020   3.939
  567    HE2  HIS  75           HE2      HIS  75  72.586 -17.349   4.120
  568    HB2  HIS  75           HB2      HIS  75  72.461 -13.775   7.492
  569    HB3  HIS  75           HB1      HIS  75  70.874 -14.346   8.002
  570    H1U  RCY  76           H1U      RCY  76  77.250  -4.042   4.293
  571    H1S  RCY  76           H1S      RCY  76  73.987  -6.413   5.124
  572    HB1  RCY  76           HB1      RCY  76  71.781  -7.617   5.844
  573    HB2  RCY  76           HB2      RCY  76  73.012  -8.862   5.637
  574    HA   RCY  76           HA       RCY  76  72.447  -9.394   8.167
  575    HN1  RCY  76           HN1      RCY  76  70.996 -10.336   5.756
  576    H    GLU  77           HN       GLU  77  69.279  -9.591   7.036
  577    HA   GLU  77           HA       GLU  77  68.276  -7.053   8.007
  578    HB2  GLU  77           HB2      GLU  77  66.041  -8.336   7.953
  579    HB3  GLU  77           HB1      GLU  77  66.897  -8.157   6.421
  580    HG2  GLU  77           HG2      GLU  77  67.750 -10.394   6.532
  581    HG3  GLU  77           HG1      GLU  77  67.227 -10.578   8.207
  582    H    LEU  78           HN       LEU  78  68.866 -10.202   9.454
  583    HA   LEU  78           HA       LEU  78  67.351  -9.653  11.873
  584    HG   LEU  78           HG       LEU  78  70.069 -11.274  10.194
  585    HB2  LEU  78           HB2      LEU  78  68.549 -11.651  12.769
  586    HB3  LEU  78           HB1      LEU  78  67.769 -11.958  11.222
  587   HD11  LEU  78          HD11      LEU  78  71.378 -10.486  11.931
  588   HD12  LEU  78          HD12      LEU  78  71.847 -12.186  11.960
  589   HD13  LEU  78          HD13      LEU  78  70.655 -11.580  13.110
  590   HD21  LEU  78          HD21      LEU  78  69.499 -13.852  11.670
  591   HD22  LEU  78          HD22      LEU  78  70.919 -13.656  10.643
  592   HD23  LEU  78          HD23      LEU  78  69.303 -13.520   9.949
  593    H    HIS  79           HN       HIS  79  69.553  -7.770  10.886
  594    HA   HIS  79           HA       HIS  79  71.822  -7.760  12.500
  595    HD1  HIS  79           HD1      HIS  79  72.650  -5.687   9.470
  596    HD2  HIS  79           HD2      HIS  79  73.399  -5.292  13.554
  597    HE1  HIS  79           HE1      HIS  79  75.117  -5.159   9.697
  598    HE2  HIS  79           HE2      HIS  79  75.586  -4.916  12.178
  599    HB2  HIS  79           HB2      HIS  79  70.564  -5.941  10.805
  600    HB3  HIS  79           HB1      HIS  79  70.592  -5.100  12.351
  601    H    GLU  80           HN       GLU  80  72.127  -6.088  14.407
  602    HA   GLU  80           HA       GLU  80  70.112  -6.818  16.463
  603    HB2  GLU  80           HB2      GLU  80  72.665  -7.123  16.747
  604    HB3  GLU  80           HB1      GLU  80  72.715  -5.374  16.966
  605    HG2  GLU  80           HG2      GLU  80  72.494  -6.250  19.163
  606    HG3  GLU  80           HG1      GLU  80  70.872  -5.711  18.729
  607    H    LEU  81           HN       LEU  81  71.771  -3.923  15.170
  608    HA   LEU  81           HA       LEU  81  70.081  -2.150  16.774
  609    HG   LEU  81           HG       LEU  81  71.069  -1.122  13.428
  610    HB2  LEU  81           HB2      LEU  81  71.299  -0.344  15.785
  611    HB3  LEU  81           HB1      LEU  81  72.471  -1.627  16.072
  612   HD11  LEU  81          HD11      LEU  81  72.753   0.628  14.143
  613   HD12  LEU  81          HD12      LEU  81  73.165  -0.218  12.651
  614   HD13  LEU  81          HD13      LEU  81  73.971  -0.648  14.160
  615   HD21  LEU  81          HD21      LEU  81  73.095  -3.131  14.405
  616   HD22  LEU  81          HD22      LEU  81  73.020  -2.687  12.700
  617   HD23  LEU  81          HD23      LEU  81  71.618  -3.415  13.484
  618    H    ALA  82           HN       ALA  82  69.133  -4.065  14.468
  619    HA   ALA  82           HA       ALA  82  68.040  -2.491  12.380
  620    HB1  ALA  82           HB1      ALA  82  67.115  -5.059  13.682
  621    HB2  ALA  82           HB2      ALA  82  67.937  -4.859  12.135
  622    HB3  ALA  82           HB3      ALA  82  66.260  -4.344  12.315
  623    H    GLN  83           HN       GLN  83  67.323  -0.518  13.421
  624    HA   GLN  83           HA       GLN  83  64.541  -0.715  14.394
  625    HB2  GLN  83           HB2      GLN  83  66.201  -0.829  16.384
  626    HB3  GLN  83           HB1      GLN  83  66.529   0.866  16.027
  627    HG2  GLN  83           HG2      GLN  83  64.762   1.242  17.423
  628    HG3  GLN  83           HG1      GLN  83  63.803   0.869  15.990
  629   HE21  GLN  83          HE21      GLN  83  65.600  -1.136  18.409
  630   HE22  GLN  83          HE22      GLN  83  64.307  -2.197  18.698
  631    H    TYR  84           HN       TYR  84  66.879   0.750  12.546
  632    HA   TYR  84           HA       TYR  84  65.148   3.148  12.159
  633    HD1  TYR  84           HD2      TYR  84  67.977   2.357  14.810
  634    HD2  TYR  84           HD1      TYR  84  65.739   5.769  13.471
  635    HE1  TYR  84           HE2      TYR  84  67.476   2.952  17.165
  636    HE2  TYR  84           HE1      TYR  84  65.237   6.364  15.825
  637    HH   TYR  84           HH       TYR  84  66.810   5.481  18.318
  638    HB2  TYR  84           HB2      TYR  84  68.163   3.184  12.501
  639    HB3  TYR  84           HB1      TYR  84  67.203   4.557  11.951
  640    H    GLY  85           HN       GLY  85  65.447   0.685  10.610
  641    HA2  GLY  85           HA2      GLY  85  65.303   1.409   8.019
  642    HA3  GLY  85           HA1      GLY  85  67.049   1.488   8.256
  643    H    ILE  86           HN       ILE  86  65.710  -0.842  10.283
  644    HA   ILE  86           HA       ILE  86  66.074  -3.174  10.285
  645    HB   ILE  86           HB       ILE  86  64.849  -2.911   7.523
  646   HG12  ILE  86          HG12      ILE  86  62.809  -3.503   9.279
  647   HG13  ILE  86          HG11      ILE  86  63.783  -2.366  10.213
  648   HG21  ILE  86          HG21      ILE  86  64.001  -5.144   7.948
  649   HG22  ILE  86          HG22      ILE  86  64.636  -5.116   9.594
  650   HG23  ILE  86          HG23      ILE  86  65.744  -5.155   8.222
  651   HD11  ILE  86          HD11      ILE  86  62.076  -1.191   8.857
  652   HD12  ILE  86          HD12      ILE  86  62.768  -1.892   7.394
  653   HD13  ILE  86          HD13      ILE  86  63.710  -0.754   8.358
  654    H1U  RCY  87           H1U      RCY  87  75.998   2.430   7.663
  655    H1S  RCY  87           H1S      RCY  87  72.654  -0.878   6.530
  656    HB1  RCY  87           HB1      RCY  87  71.032  -2.579  10.034
  657    HB2  RCY  87           HB2      RCY  87  70.564  -1.257   8.967
  658    HA   RCY  87           HA       RCY  87  69.644  -2.958   7.365
  659    HN1  RCY  87           HN1      RCY  87  68.465  -2.395   9.984
  Start of MODEL   39
    1    HA   MET   1           HA       MET   1  59.592   8.341  23.821
    2    HB2  MET   1           HB2      MET   1  57.654   9.139  21.639
    3    HB3  MET   1           HB1      MET   1  57.545   9.488  23.364
    4    HG2  MET   1           HG2      MET   1  59.806  10.727  23.032
    5    HG3  MET   1           HG1      MET   1  59.401  10.690  21.316
    6    HE1  MET   1           HE1      MET   1  55.982  10.751  21.966
    7    HE2  MET   1           HE2      MET   1  56.988  11.091  20.560
    8    HE3  MET   1           HE3      MET   1  55.926  12.343  21.199
    9    H    ASN   2           HN       ASN   2  57.535   7.454  21.047
   10    HA   ASN   2           HA       ASN   2  56.845   4.938  22.477
   11    HB2  ASN   2           HB2      ASN   2  54.963   6.326  21.751
   12    HB3  ASN   2           HB1      ASN   2  55.562   6.304  20.091
   13   HD21  ASN   2          HD21      ASN   2  56.156   3.315  21.626
   14   HD22  ASN   2          HD22      ASN   2  54.824   2.462  21.009
   15    H    LEU   3           HN       LEU   3  56.638   5.351  18.999
   16    HA   LEU   3           HA       LEU   3  57.238   3.609  17.445
   17    HG   LEU   3           HG       LEU   3  59.971   4.710  19.491
   18    HB2  LEU   3           HB2      LEU   3  59.707   3.988  16.930
   19    HB3  LEU   3           HB1      LEU   3  58.680   5.419  16.887
   20   HD11  LEU   3          HD11      LEU   3  61.959   6.132  18.719
   21   HD12  LEU   3          HD12      LEU   3  61.393   5.842  17.074
   22   HD13  LEU   3          HD13      LEU   3  61.887   4.487  18.088
   23   HD21  LEU   3          HD21      LEU   3  58.346   6.703  18.796
   24   HD22  LEU   3          HD22      LEU   3  59.856   7.436  18.256
   25   HD23  LEU   3          HD23      LEU   3  59.660   6.963  19.944
   26    H    GLU   4           HN       GLU   4  56.832   2.164  19.718
   27    HA   GLU   4           HA       GLU   4  59.050   0.816  20.838
   28    HB2  GLU   4           HB2      GLU   4  57.432  -1.027  21.311
   29    HB3  GLU   4           HB1      GLU   4  56.790   0.557  21.743
   30    HG2  GLU   4           HG2      GLU   4  55.730   0.604  19.416
   31    HG3  GLU   4           HG1      GLU   4  56.136  -1.109  19.305
   32    HA   PRO   5           HA       PRO   5  61.036  -1.637  17.759
   33    HB2  PRO   5           HB2      PRO   5  60.138  -3.970  19.428
   34    HB3  PRO   5           HB1      PRO   5  61.732  -3.648  18.715
   35    HG2  PRO   5           HG2      PRO   5  61.200  -3.180  21.302
   36    HG3  PRO   5           HG1      PRO   5  62.324  -2.181  20.368
   37    HD2  PRO   5           HD2      PRO   5  59.662  -1.479  21.419
   38    HD3  PRO   5           HD1      PRO   5  60.959  -0.410  20.844
   39    HA   PRO   6           HA       PRO   6  57.468  -2.866  15.312
   40    HB2  PRO   6           HB2      PRO   6  58.770  -3.599  13.037
   41    HB3  PRO   6           HB1      PRO   6  58.576  -1.902  13.521
   42    HG2  PRO   6           HG2      PRO   6  60.946  -3.681  13.808
   43    HG3  PRO   6           HG1      PRO   6  60.866  -1.969  13.360
   44    HD2  PRO   6           HD2      PRO   6  61.521  -2.845  15.888
   45    HD3  PRO   6           HD1      PRO   6  60.783  -1.262  15.557
   46    H    LYS   7           HN       LYS   7  56.654  -4.851  14.177
   47    HA   LYS   7           HA       LYS   7  56.783  -7.192  15.617
   48    HB2  LYS   7           HB2      LYS   7  55.266  -6.768  13.671
   49    HB3  LYS   7           HB1      LYS   7  56.622  -7.097  12.594
   50    HG2  LYS   7           HG2      LYS   7  56.857  -9.353  13.641
   51    HG3  LYS   7           HG1      LYS   7  55.415  -9.021  14.601
   52    HD2  LYS   7           HD2      LYS   7  54.445 -10.112  12.806
   53    HD3  LYS   7           HD1      LYS   7  54.384  -8.451  12.215
   54    HE2  LYS   7           HE2      LYS   7  55.320  -9.675  10.416
   55    HE3  LYS   7           HE1      LYS   7  56.708  -8.920  11.199
   56    HZ1  LYS   7           HZ1      LYS   7  56.016 -11.701  10.980
   57    HZ2  LYS   7           HZ2      LYS   7  56.425 -11.236  12.562
   58    HZ3  LYS   7           HZ3      LYS   7  57.520 -10.979  11.289
   59    H    ALA   8           HN       ALA   8  58.309  -7.451  12.466
   60    HA   ALA   8           HA       ALA   8  60.963  -7.968  13.553
   61    HB1  ALA   8           HB1      ALA   8  60.084 -10.096  14.170
   62    HB2  ALA   8           HB2      ALA   8  60.952 -10.373  12.660
   63    HB3  ALA   8           HB3      ALA   8  59.192 -10.250  12.656
   64    H    GLU   9           HN       GLU   9  60.524 -10.011  10.959
   65    HA   GLU   9           HA       GLU   9  60.387  -8.161   8.768
   66    HB2  GLU   9           HB2      GLU   9  62.873  -8.181  10.130
   67    HB3  GLU   9           HB1      GLU   9  63.136  -9.079   8.637
   68    HG2  GLU   9           HG2      GLU   9  61.900  -6.315   8.837
   69    HG3  GLU   9           HG1      GLU   9  63.541  -6.670   8.294
   70    H1U  RCY  10           H1U      RCY  10  56.708  -9.143   2.288
   71    H1S  RCY  10           H1S      RCY  10  58.946 -13.036   4.121
   72    HB1  RCY  10           HB1      RCY  10  57.671 -11.266   6.380
   73    HB2  RCY  10           HB2      RCY  10  57.741 -12.117   7.923
   74    HA   RCY  10           HA       RCY  10  60.168 -12.515   7.568
   75    HN1  RCY  10           HN1      RCY  10  59.107  -9.785   7.830
   76    H    ARG  11           HN       ARG  11  58.522 -12.004   4.786
   77    HA   ARG  11           HA       ARG  11  59.403 -12.310   2.588
   78    HE   ARG  11           HE       ARG  11  59.501  -7.194   5.376
   79    HB2  ARG  11           HB2      ARG  11  60.428 -10.002   1.900
   80    HB3  ARG  11           HB1      ARG  11  58.737 -10.073   2.392
   81    HG2  ARG  11           HG2      ARG  11  59.335  -9.376   4.663
   82    HG3  ARG  11           HG1      ARG  11  61.046  -9.374   4.232
   83    HD2  ARG  11           HD2      ARG  11  60.800  -7.521   2.783
   84    HD3  ARG  11           HD1      ARG  11  59.047  -7.706   2.707
   85   HH11  ARG  11          HH21      ARG  11  60.444  -5.740   2.396
   86   HH12  ARG  11          HH22      ARG  11  60.516  -4.137   3.047
   87   HH21  ARG  11          HH11      ARG  11  59.589  -5.108   6.244
   88   HH22  ARG  11          HH12      ARG  11  60.032  -3.779   5.226
   89    H    SER  12           HN       SER  12  61.121 -13.753   4.033
   90    HA   SER  12           HA       SER  12  63.634 -13.404   2.631
   91    HG   SER  12           HG       SER  12  63.362 -12.873   6.476
   92    HB2  SER  12           HB2      SER  12  65.051 -12.720   4.352
   93    HB3  SER  12           HB1      SER  12  63.609 -11.770   4.707
   94    H    ALA  13           HN       ALA  13  65.156 -14.863   4.686
   95    HA   ALA  13           HA       ALA  13  65.469 -17.057   5.464
   96    HB1  ALA  13           HB1      ALA  13  62.948 -16.569   6.200
   97    HB2  ALA  13           HB2      ALA  13  63.645 -18.183   6.333
   98    HB3  ALA  13           HB3      ALA  13  62.611 -17.779   4.962
   99    H    THR  14           HN       THR  14  63.581 -16.516   2.542
  100    HA   THR  14           HA       THR  14  64.062 -19.159   1.440
  101    HB   THR  14           HB       THR  14  63.476 -16.722  -0.232
  102    HG1  THR  14           HG1      THR  14  61.898 -16.399   1.132
  103   HG21  THR  14          HG21      THR  14  62.361 -18.260  -1.637
  104   HG22  THR  14          HG22      THR  14  62.248 -19.473  -0.362
  105   HG23  THR  14          HG23      THR  14  63.805 -19.127  -1.114
  106    H    ARG  15           HN       ARG  15  66.413 -17.552   2.398
  107    HA   ARG  15           HA       ARG  15  68.624 -17.180   1.719
  108    HE   ARG  15           HE       ARG  15  71.046 -18.630  -2.694
  109    HB2  ARG  15           HB2      ARG  15  68.151 -19.539   0.761
  110    HB3  ARG  15           HB1      ARG  15  67.981 -18.726  -0.794
  111    HG2  ARG  15           HG2      ARG  15  70.255 -17.660  -0.335
  112    HG3  ARG  15           HG1      ARG  15  70.416 -18.805   0.997
  113    HD2  ARG  15           HD2      ARG  15  71.422 -19.999  -0.728
  114    HD3  ARG  15           HD1      ARG  15  69.760 -20.575  -0.849
  115   HH11  ARG  15          HH21      ARG  15  68.380 -20.563  -1.674
  116   HH12  ARG  15          HH22      ARG  15  67.533 -20.425  -3.179
  117   HH21  ARG  15          HH11      ARG  15  69.955 -18.438  -4.664
  118   HH22  ARG  15          HH12      ARG  15  68.425 -19.221  -4.872
  119    H    VAL  16           HN       VAL  16  67.116 -17.329  -1.512
  120    HA   VAL  16           HA       VAL  16  67.071 -14.437  -1.791
  121    HB   VAL  16           HB       VAL  16  69.549 -15.722  -2.269
  122   HG11  VAL  16          HG11      VAL  16  68.254 -14.820  -4.860
  123   HG12  VAL  16          HG12      VAL  16  68.565 -16.500  -4.426
  124   HG13  VAL  16          HG13      VAL  16  69.912 -15.387  -4.663
  125   HG21  VAL  16          HG21      VAL  16  68.548 -13.022  -3.233
  126   HG22  VAL  16          HG22      VAL  16  70.236 -13.477  -3.000
  127   HG23  VAL  16          HG23      VAL  16  69.155 -13.357  -1.612
  128    H    MET  17           HN       MET  17  66.295 -13.826  -3.997
  129    HA   MET  17           HA       MET  17  64.104 -15.310  -4.869
  130    HB2  MET  17           HB2      MET  17  64.330 -13.080  -5.684
  131    HB3  MET  17           HB1      MET  17  65.917 -13.413  -6.373
  132    HG2  MET  17           HG2      MET  17  63.969 -13.337  -8.033
  133    HG3  MET  17           HG1      MET  17  64.991 -14.772  -8.105
  134    HE1  MET  17           HE1      MET  17  61.973 -13.317  -6.082
  135    HE2  MET  17           HE2      MET  17  60.679 -14.348  -6.687
  136    HE3  MET  17           HE3      MET  17  61.581 -13.330  -7.806
  137    H    GLY  18           HN       GLY  18  67.042 -15.125  -6.901
  138    HA2  GLY  18           HA2      GLY  18  67.405 -17.979  -7.032
  139    HA3  GLY  18           HA1      GLY  18  66.501 -17.413  -8.438
  140    H    GLY  19           HN       GLY  19  68.707 -18.399  -9.295
  141    HA2  GLY  19           HA2      GLY  19  70.916 -16.439  -9.194
  142    HA3  GLY  19           HA1      GLY  19  70.977 -18.026  -9.961
  143    HA   PRO  20           HA       PRO  20  69.628 -16.777 -13.998
  144    HB2  PRO  20           HB2      PRO  20  66.700 -16.880 -13.359
  145    HB3  PRO  20           HB1      PRO  20  67.580 -17.585 -14.730
  146    HG2  PRO  20           HG2      PRO  20  66.769 -19.088 -12.698
  147    HG3  PRO  20           HG1      PRO  20  68.328 -19.380 -13.489
  148    HD2  PRO  20           HD2      PRO  20  67.773 -18.164 -10.818
  149    HD3  PRO  20           HD1      PRO  20  69.174 -19.117 -11.356
  150    H1U  RCY  21           H1U      RCY  21  69.796  -6.579  -7.936
  151    H1S  RCY  21           H1S      RCY  21  69.625 -10.225  -9.665
  152    HB1  RCY  21           HB1      RCY  21  70.706 -12.079 -11.886
  153    HB2  RCY  21           HB2      RCY  21  69.308 -12.916 -11.210
  154    HA   RCY  21           HA       RCY  21  68.263 -12.567 -13.581
  155    HN1  RCY  21           HN1      RCY  21  70.439 -14.601 -13.439
  156    H    THR  22           HN       THR  22  68.877 -10.667 -14.747
  157    HA   THR  22           HA       THR  22  71.617 -10.663 -15.931
  158    HB   THR  22           HB       THR  22  70.791 -10.423 -18.158
  159    HG1  THR  22           HG1      THR  22  68.961  -9.465 -18.408
  160   HG21  THR  22          HG21      THR  22  70.741 -12.740 -17.168
  161   HG22  THR  22          HG22      THR  22  69.621 -12.505 -18.510
  162   HG23  THR  22          HG23      THR  22  69.022 -12.505 -16.852
  163    HA   PRO  23           HA       PRO  23  70.616  -6.459 -14.345
  164    HB2  PRO  23           HB2      PRO  23  73.541  -6.143 -14.748
  165    HB3  PRO  23           HB1      PRO  23  72.564  -5.836 -13.300
  166    HG2  PRO  23           HG2      PRO  23  74.215  -7.936 -13.493
  167    HG3  PRO  23           HG1      PRO  23  72.694  -8.006 -12.589
  168    HD2  PRO  23           HD2      PRO  23  73.342  -9.159 -15.276
  169    HD3  PRO  23           HD1      PRO  23  72.271  -9.791 -14.004
  170    H    ARG  24           HN       ARG  24  71.319  -4.238 -15.298
  171    HA   ARG  24           HA       ARG  24  72.366  -4.120 -17.971
  172    HE   ARG  24           HE       ARG  24  70.325  -3.096 -22.211
  173    HB2  ARG  24           HB2      ARG  24  70.037  -5.191 -18.275
  174    HB3  ARG  24           HB1      ARG  24  69.391  -3.609 -17.840
  175    HG2  ARG  24           HG2      ARG  24  70.412  -2.557 -19.714
  176    HG3  ARG  24           HG1      ARG  24  71.457  -3.945 -20.019
  177    HD2  ARG  24           HD2      ARG  24  69.428  -5.308 -20.535
  178    HD3  ARG  24           HD1      ARG  24  68.443  -3.857 -20.343
  179   HH11  ARG  24          HH21      ARG  24  68.159  -5.751 -21.827
  180   HH12  ARG  24          HH22      ARG  24  67.941  -5.991 -23.529
  181   HH21  ARG  24          HH11      ARG  24  70.053  -3.394 -24.435
  182   HH22  ARG  24          HH12      ARG  24  69.013  -4.656 -25.005
  183    H    LYS  25           HN       LYS  25  69.601  -2.316 -16.635
  184    HA   LYS  25           HA       LYS  25  69.413  -0.020 -16.169
  185    HB2  LYS  25           HB2      LYS  25  71.984  -0.917 -14.918
  186    HB3  LYS  25           HB1      LYS  25  71.638   0.811 -14.946
  187    HG2  LYS  25           HG2      LYS  25  70.787  -0.233 -12.874
  188    HG3  LYS  25           HG1      LYS  25  69.466   0.402 -13.855
  189    HD2  LYS  25           HD2      LYS  25  68.979  -1.813 -14.729
  190    HD3  LYS  25           HD1      LYS  25  70.386  -2.486 -13.903
  191    HE2  LYS  25           HE2      LYS  25  69.416  -2.176 -11.761
  192    HE3  LYS  25           HE1      LYS  25  68.187  -1.078 -12.387
  193    HZ1  LYS  25           HZ1      LYS  25  67.126  -2.858 -13.519
  194    HZ2  LYS  25           HZ2      LYS  25  67.384  -3.366 -11.918
  195    HZ3  LYS  25           HZ3      LYS  25  68.390  -3.933 -13.164
  196    H    GLY  26           HN       GLY  26  71.359   2.024 -16.225
  197    HA2  GLY  26           HA2      GLY  26  71.424   2.733 -18.947
  198    HA3  GLY  26           HA1      GLY  26  72.493   3.426 -17.728
  199    HA   PRO  27           HA       PRO  27  75.014   1.197 -21.022
  200    HB2  PRO  27           HB2      PRO  27  76.820   3.416 -20.154
  201    HB3  PRO  27           HB1      PRO  27  76.463   2.830 -21.790
  202    HG2  PRO  27           HG2      PRO  27  75.436   5.106 -20.863
  203    HG3  PRO  27           HG1      PRO  27  74.525   4.042 -21.948
  204    HD2  PRO  27           HD2      PRO  27  74.171   4.491 -19.019
  205    HD3  PRO  27           HD1      PRO  27  72.963   4.063 -20.251
  206    HA   PRO  28           HA       PRO  28  77.558  -1.369 -18.476
  207    HB2  PRO  28           HB2      PRO  28  79.922  -0.152 -19.874
  208    HB3  PRO  28           HB1      PRO  28  79.565  -1.861 -19.550
  209    HG2  PRO  28           HG2      PRO  28  79.164  -0.772 -21.955
  210    HG3  PRO  28           HG1      PRO  28  78.092  -2.022 -21.304
  211    HD2  PRO  28           HD2      PRO  28  77.561   0.865 -21.706
  212    HD3  PRO  28           HD1      PRO  28  76.412  -0.483 -21.562
  213    H    LYS  29           HN       LYS  29  79.163  -1.256 -16.709
  214    HA   LYS  29           HA       LYS  29  80.133  -0.228 -14.848
  215    HB2  LYS  29           HB2      LYS  29  80.647   1.713 -17.061
  216    HB3  LYS  29           HB1      LYS  29  80.845   2.312 -15.417
  217    HG2  LYS  29           HG2      LYS  29  82.971   1.412 -16.196
  218    HG3  LYS  29           HG1      LYS  29  82.331   0.362 -14.931
  219    HD2  LYS  29           HD2      LYS  29  81.385  -1.129 -16.686
  220    HD3  LYS  29           HD1      LYS  29  82.123  -0.107 -17.920
  221    HE2  LYS  29           HE2      LYS  29  83.712  -1.818 -17.632
  222    HE3  LYS  29           HE1      LYS  29  84.337  -0.518 -16.616
  223    HZ1  LYS  29           HZ1      LYS  29  82.492  -2.078 -15.157
  224    HZ2  LYS  29           HZ2      LYS  29  84.139  -1.802 -14.843
  225    HZ3  LYS  29           HZ3      LYS  29  83.667  -3.093 -15.841
  226    H1U  RCY  30           H1U      RCY  30  75.884   5.757  -8.871
  227    H1S  RCY  30           H1S      RCY  30  75.648   3.825 -12.843
  228    HB1  RCY  30           HB1      RCY  30  76.360   1.629 -13.016
  229    HB2  RCY  30           HB2      RCY  30  75.703   0.632 -14.313
  230    HA   RCY  30           HA       RCY  30  75.822   2.806 -15.739
  231    HN1  RCY  30           HN1      RCY  30  77.610   1.532 -16.553
  232    H    LYS  31           HN       LYS  31  76.071   4.959 -15.487
  233    HA   LYS  31           HA       LYS  31  77.542   5.964 -13.108
  234    HB2  LYS  31           HB2      LYS  31  78.238   7.759 -15.153
  235    HB3  LYS  31           HB1      LYS  31  79.309   6.591 -14.383
  236    HG2  LYS  31           HG2      LYS  31  78.842   4.931 -16.056
  237    HG3  LYS  31           HG1      LYS  31  77.529   5.898 -16.731
  238    HD2  LYS  31           HD2      LYS  31  79.135   7.635 -17.405
  239    HD3  LYS  31           HD1      LYS  31  80.455   6.697 -16.705
  240    HE2  LYS  31           HE2      LYS  31  78.714   5.950 -19.066
  241    HE3  LYS  31           HE1      LYS  31  80.457   6.223 -19.058
  242    HZ1  LYS  31           HZ1      LYS  31  80.359   4.324 -17.272
  243    HZ2  LYS  31           HZ2      LYS  31  80.403   3.968 -18.933
  244    HZ3  LYS  31           HZ3      LYS  31  78.928   3.922 -18.091
  245    H    GLN  32           HN       GLN  32  77.210   8.517 -13.119
  246    HA   GLN  32           HA       GLN  32  74.435   9.113 -14.063
  247    HB2  GLN  32           HB2      GLN  32  74.533   8.568 -11.600
  248    HB3  GLN  32           HB1      GLN  32  75.577   9.972 -11.394
  249    HG2  GLN  32           HG2      GLN  32  73.356  10.729 -10.925
  250    HG3  GLN  32           HG1      GLN  32  73.751  11.341 -12.532
  251   HE21  GLN  32          HE21      GLN  32  71.235  11.345 -12.660
  252   HE22  GLN  32          HE22      GLN  32  70.494   9.914 -13.190
  253    H    ARG  33           HN       ARG  33  76.445  11.217 -12.120
  254    HA   ARG  33           HA       ARG  33  77.112  12.837 -14.535
  255    HE   ARG  33           HE       ARG  33  72.378  14.170 -14.692
  256    HB2  ARG  33           HB2      ARG  33  75.634  13.737 -12.060
  257    HB3  ARG  33           HB1      ARG  33  76.552  14.880 -13.041
  258    HG2  ARG  33           HG2      ARG  33  75.253  14.136 -15.044
  259    HG3  ARG  33           HG1      ARG  33  74.274  13.116 -13.989
  260    HD2  ARG  33           HD2      ARG  33  73.873  15.297 -12.629
  261    HD3  ARG  33           HD1      ARG  33  74.429  16.124 -14.084
  262   HH11  ARG  33          HH21      ARG  33  73.034  17.318 -13.449
  263   HH12  ARG  33          HH22      ARG  33  71.489  17.962 -13.895
  264   HH21  ARG  33          HH11      ARG  33  70.356  14.992 -15.282
  265   HH22  ARG  33          HH12      ARG  33  69.973  16.645 -14.933
  266    H    GLN  34           HN       GLN  34  77.934  11.613 -11.422
  267    HA   GLN  34           HA       GLN  34  80.667  12.638 -11.741
  268    HB2  GLN  34           HB2      GLN  34  78.758  13.947  -9.996
  269    HB3  GLN  34           HB1      GLN  34  80.073  13.264  -9.041
  270    HG2  GLN  34           HG2      GLN  34  80.537  14.940 -11.520
  271    HG3  GLN  34           HG1      GLN  34  80.479  15.623  -9.894
  272   HE21  GLN  34          HE21      GLN  34  82.845  15.469 -11.725
  273   HE22  GLN  34          HE22      GLN  34  84.023  14.587 -10.879
  274    H    THR  35           HN       THR  35  81.668  10.683 -11.557
  275    HA   THR  35           HA       THR  35  80.731   8.747  -9.516
  276    HB   THR  35           HB       THR  35  82.932   7.606 -10.734
  277    HG1  THR  35           HG1      THR  35  82.676   8.122 -12.942
  278   HG21  THR  35          HG21      THR  35  80.735   6.555 -10.424
  279   HG22  THR  35          HG22      THR  35  81.265   6.380 -12.097
  280   HG23  THR  35          HG23      THR  35  80.051   7.589 -11.679
  281    H    ARG  36           HN       ARG  36  81.467  10.371  -7.832
  282    HA   ARG  36           HA       ARG  36  84.154  11.135  -7.440
  283    HE   ARG  36           HE       ARG  36  80.228  11.186  -3.990
  284    HB2  ARG  36           HB2      ARG  36  82.103  10.410  -5.324
  285    HB3  ARG  36           HB1      ARG  36  83.566  11.359  -5.055
  286    HG2  ARG  36           HG2      ARG  36  82.778  13.152  -6.405
  287    HG3  ARG  36           HG1      ARG  36  81.489  12.166  -7.096
  288    HD2  ARG  36           HD2      ARG  36  81.689  13.025  -4.194
  289    HD3  ARG  36           HD1      ARG  36  80.589  13.704  -5.394
  290   HH11  ARG  36          HH21      ARG  36  79.695  12.950  -6.904
  291   HH12  ARG  36          HH22      ARG  36  78.287  12.046  -7.351
  292   HH21  ARG  36          HH11      ARG  36  78.393   9.995  -4.556
  293   HH22  ARG  36          HH12      ARG  36  77.550  10.373  -6.021
  294    H    GLN  37           HN       GLN  37  85.405   9.262  -8.131
  295    HA   GLN  37           HA       GLN  37  85.219   6.714  -6.812
  296    HB2  GLN  37           HB2      GLN  37  87.586   6.420  -7.724
  297    HB3  GLN  37           HB1      GLN  37  86.345   6.784  -8.924
  298    HG2  GLN  37           HG2      GLN  37  86.991   9.113  -8.984
  299    HG3  GLN  37           HG1      GLN  37  88.099   8.889  -7.630
  300   HE21  GLN  37          HE21      GLN  37  89.453   6.553  -8.330
  301   HE22  GLN  37          HE22      GLN  37  90.290   6.780  -9.789
  302    H1U  RCY  38           H1U      RCY  38  86.751   3.471  -1.117
  303    H1S  RCY  38           H1S      RCY  38  84.034   7.367  -1.268
  304    HB1  RCY  38           HB1      RCY  38  87.008   8.995  -1.778
  305    HB2  RCY  38           HB2      RCY  38  86.938   7.511  -2.727
  306    HA   RCY  38           HA       RCY  38  87.346  10.341  -3.702
  307    HN1  RCY  38           HN1      RCY  38  86.102   9.669  -5.582
  308    H    LYS  39           HN       LYS  39  89.247   9.411  -2.161
  309    HA   LYS  39           HA       LYS  39  91.436   8.806  -3.984
  310    HB2  LYS  39           HB2      LYS  39  91.325   8.992  -0.958
  311    HB3  LYS  39           HB1      LYS  39  92.810   8.796  -1.890
  312    HG2  LYS  39           HG2      LYS  39  92.494  10.913  -2.990
  313    HG3  LYS  39           HG1      LYS  39  90.866  11.075  -2.330
  314    HD2  LYS  39           HD2      LYS  39  91.844  11.118  -0.033
  315    HD3  LYS  39           HD1      LYS  39  93.455  11.085  -0.752
  316    HE2  LYS  39           HE2      LYS  39  91.357  13.218  -1.254
  317    HE3  LYS  39           HE1      LYS  39  92.762  13.397  -0.202
  318    HZ1  LYS  39           HZ1      LYS  39  94.204  13.048  -2.080
  319    HZ2  LYS  39           HZ2      LYS  39  93.129  14.317  -2.427
  320    HZ3  LYS  39           HZ3      LYS  39  92.879  12.779  -3.104
  321    H    SER  40           HN       SER  40  90.295   7.101  -1.041
  322    HA   SER  40           HA       SER  40  90.082   4.544  -2.281
  323    HG   SER  40           HG       SER  40  93.094   2.935  -1.091
  324    HB2  SER  40           HB2      SER  40  92.406   4.426  -2.624
  325    HB3  SER  40           HB1      SER  40  92.766   5.255  -1.113
  326    H    LYS  41           HN       LYS  41  91.852   4.972   0.738
  327    HA   LYS  41           HA       LYS  41  89.386   4.119   2.212
  328    HB2  LYS  41           HB2      LYS  41  92.306   3.483   2.588
  329    HB3  LYS  41           HB1      LYS  41  91.180   3.352   3.939
  330    HG2  LYS  41           HG2      LYS  41  89.793   1.784   2.688
  331    HG3  LYS  41           HG1      LYS  41  90.810   1.978   1.260
  332    HD2  LYS  41           HD2      LYS  41  92.650   0.888   2.285
  333    HD3  LYS  41           HD1      LYS  41  91.949   1.043   3.896
  334    HE2  LYS  41           HE2      LYS  41  90.089  -0.471   3.178
  335    HE3  LYS  41           HE1      LYS  41  90.920  -0.703   1.640
  336    HZ1  LYS  41           HZ1      LYS  41  92.126  -2.270   2.601
  337    HZ2  LYS  41           HZ2      LYS  41  91.392  -1.978   4.105
  338    HZ3  LYS  41           HZ3      LYS  41  92.787  -1.118   3.656
  339    HA   PRO  42           HA       PRO  42  90.516   8.342   3.748
  340    HB2  PRO  42           HB2      PRO  42  87.945   9.262   3.970
  341    HB3  PRO  42           HB1      PRO  42  88.882   9.345   2.465
  342    HG2  PRO  42           HG2      PRO  42  86.755   7.434   3.267
  343    HG3  PRO  42           HG1      PRO  42  87.104   8.139   1.681
  344    HD2  PRO  42           HD2      PRO  42  87.820   5.574   2.416
  345    HD3  PRO  42           HD1      PRO  42  88.649   6.513   1.156
  346    HA   PRO  43           HA       PRO  43  89.896   7.500   8.038
  347    HB2  PRO  43           HB2      PRO  43  89.401  10.026   9.052
  348    HB3  PRO  43           HB1      PRO  43  91.010   9.423   8.613
  349    HG2  PRO  43           HG2      PRO  43  89.176  11.193   7.080
  350    HG3  PRO  43           HG1      PRO  43  90.939  11.259   7.243
  351    HD2  PRO  43           HD2      PRO  43  89.734  10.257   5.021
  352    HD3  PRO  43           HD1      PRO  43  91.289   9.633   5.617
  353    H    LYS  44           HN       LYS  44  88.217   6.923   9.414
  354    HA   LYS  44           HA       LYS  44  85.501   7.221   8.464
  355    HB2  LYS  44           HB2      LYS  44  86.826   6.001  10.862
  356    HB3  LYS  44           HB1      LYS  44  85.092   6.304  10.941
  357    HG2  LYS  44           HG2      LYS  44  85.970   5.057   8.418
  358    HG3  LYS  44           HG1      LYS  44  86.234   4.052   9.843
  359    HD2  LYS  44           HD2      LYS  44  84.008   3.601   8.965
  360    HD3  LYS  44           HD1      LYS  44  83.853   4.449  10.505
  361    HE2  LYS  44           HE2      LYS  44  82.335   5.379   8.766
  362    HE3  LYS  44           HE1      LYS  44  83.502   6.570   9.338
  363    HZ1  LYS  44           HZ1      LYS  44  84.916   5.910   7.409
  364    HZ2  LYS  44           HZ2      LYS  44  83.467   6.691   6.991
  365    HZ3  LYS  44           HZ3      LYS  44  83.606   5.006   6.822
  366    H    LYS  45           HN       LYS  45  86.557   8.048  11.766
  367    HA   LYS  45           HA       LYS  45  86.185   9.997  13.025
  368    HB2  LYS  45           HB2      LYS  45  86.808  11.000  10.609
  369    HB3  LYS  45           HB1      LYS  45  85.121  11.506  10.674
  370    HG2  LYS  45           HG2      LYS  45  85.525  12.584  12.858
  371    HG3  LYS  45           HG1      LYS  45  87.215  12.083  12.792
  372    HD2  LYS  45           HD2      LYS  45  87.255  13.318  10.501
  373    HD3  LYS  45           HD1      LYS  45  85.783  14.102  11.077
  374    HE2  LYS  45           HE2      LYS  45  88.576  14.295  12.155
  375    HE3  LYS  45           HE1      LYS  45  87.404  15.579  11.858
  376    HZ1  LYS  45           HZ1      LYS  45  87.621  13.746  14.133
  377    HZ2  LYS  45           HZ2      LYS  45  86.075  14.285  13.680
  378    HZ3  LYS  45           HZ3      LYS  45  87.275  15.407  14.113
  379    H    GLY  46           HN       GLY  46  83.696   9.734  10.455
  380    HA2  GLY  46           HA2      GLY  46  81.582  10.492  12.320
  381    HA3  GLY  46           HA1      GLY  46  81.351   9.970  10.651
  382    H    VAL  47           HN       VAL  47  81.010   9.042  13.876
  383    HA   VAL  47           HA       VAL  47  81.461   6.223  13.718
  384    HB   VAL  47           HB       VAL  47  79.285   7.454  15.406
  385   HG11  VAL  47          HG11      VAL  47  81.375   5.388  16.117
  386   HG12  VAL  47          HG12      VAL  47  79.848   4.951  15.351
  387   HG13  VAL  47          HG13      VAL  47  79.850   5.720  16.939
  388   HG21  VAL  47          HG21      VAL  47  82.281   7.761  15.661
  389   HG22  VAL  47          HG22      VAL  47  81.220   7.864  17.067
  390   HG23  VAL  47          HG23      VAL  47  81.043   9.015  15.743
  391    H    GLN  48           HN       GLN  48  78.418   8.088  13.388
  392    HA   GLN  48           HA       GLN  48  77.448   6.026  11.483
  393    HB2  GLN  48           HB2      GLN  48  76.103   6.798  14.078
  394    HB3  GLN  48           HB1      GLN  48  75.194   6.120  12.727
  395    HG2  GLN  48           HG2      GLN  48  76.541   4.108  12.747
  396    HG3  GLN  48           HG1      GLN  48  77.631   4.797  13.951
  397   HE21  GLN  48          HE21      GLN  48  77.130   4.335  16.104
  398   HE22  GLN  48          HE22      GLN  48  75.624   3.773  16.649
  399    H    GLY  49           HN       GLY  49  78.184   9.075  11.777
  400    HA2  GLY  49           HA2      GLY  49  75.801  10.558  11.223
  401    HA3  GLY  49           HA1      GLY  49  77.434  11.070  10.792
  402    H1U  RCY  50           H1U      RCY  50  76.913   5.289   7.143
  403    H1S  RCY  50           H1S      RCY  50  73.215   7.988   7.130
  404    HB1  RCY  50           HB1      RCY  50  74.967  10.928   5.497
  405    HB2  RCY  50           HB2      RCY  50  75.035  12.112   6.801
  406    HA   RCY  50           HA       RCY  50  76.607   9.519   6.730
  407    HN1  RCY  50           HN1      RCY  50  77.193  11.674   8.661
  408    H    GLY  51           HN       GLY  51  78.379  12.157   7.706
  409    HA2  GLY  51           HA2      GLY  51  80.226  13.179   6.645
  410    HA3  GLY  51           HA1      GLY  51  79.881  12.214   5.208
  411    H    ASP  52           HN       ASP  52  80.323  15.241   5.790
  412    HA   ASP  52           HA       ASP  52  79.396  17.288   5.084
  413    HB2  ASP  52           HB2      ASP  52  78.996  17.331   2.775
  414    HB3  ASP  52           HB1      ASP  52  79.979  15.879   2.954
  415    H    ASP  53           HN       ASP  53  77.633  15.388   6.693
  416    HA   ASP  53           HA       ASP  53  75.471  15.596   7.591
  417    HB2  ASP  53           HB2      ASP  53  75.891  18.082   6.707
  418    HB3  ASP  53           HB1      ASP  53  74.660  17.616   5.533
  419    H    ILE  54           HN       ILE  54  73.441  14.642   7.104
  420    HA   ILE  54           HA       ILE  54  73.310  12.695   5.138
  421    HB   ILE  54           HB       ILE  54  70.712  14.023   5.669
  422   HG12  ILE  54          HG12      ILE  54  72.517  13.012   7.886
  423   HG13  ILE  54          HG11      ILE  54  71.824  14.627   7.735
  424   HG21  ILE  54          HG21      ILE  54  70.011  11.781   6.087
  425   HG22  ILE  54          HG22      ILE  54  71.666  11.241   6.374
  426   HG23  ILE  54          HG23      ILE  54  71.149  11.674   4.744
  427   HD11  ILE  54          HD11      ILE  54  70.440  13.482   9.306
  428   HD12  ILE  54          HD12      ILE  54  70.377  12.033   8.302
  429   HD13  ILE  54          HD13      ILE  54  69.532  13.495   7.794
  430    HA   PRO  55           HA       PRO  55  72.862  15.526   1.611
  431    HB2  PRO  55           HB2      PRO  55  73.863  13.894  -0.287
  432    HB3  PRO  55           HB1      PRO  55  74.912  14.685   0.907
  433    HG2  PRO  55           HG2      PRO  55  73.943  11.877   0.821
  434    HG3  PRO  55           HG1      PRO  55  75.516  12.515   1.322
  435    HD2  PRO  55           HD2      PRO  55  73.456  11.779   3.065
  436    HD3  PRO  55           HD1      PRO  55  74.823  12.834   3.485
  437    H    GLY  56           HN       GLY  56  71.888  12.085   1.458
  438    HA2  GLY  56           HA2      GLY  56  69.416  12.964   0.030
  439    HA3  GLY  56           HA1      GLY  56  70.334  11.580  -0.564
  440    H    MET  57           HN       MET  57  67.849  12.547   1.514
  441    HA   MET  57           HA       MET  57  67.870   9.862   2.848
  442    HB2  MET  57           HB2      MET  57  66.515  11.110   4.669
  443    HB3  MET  57           HB1      MET  57  68.256  11.383   4.617
  444    HG2  MET  57           HG2      MET  57  66.362  13.167   3.093
  445    HG3  MET  57           HG1      MET  57  66.714  13.461   4.796
  446    HE1  MET  57           HE1      MET  57  67.416  15.849   3.790
  447    HE2  MET  57           HE2      MET  57  69.146  16.091   4.023
  448    HE3  MET  57           HE3      MET  57  68.199  15.282   5.270
  449    H    GLU  58           HN       GLU  58  66.650  10.070   0.407
  450    HA   GLU  58           HA       GLU  58  63.790   9.798   1.150
  451    HB2  GLU  58           HB2      GLU  58  64.535  11.324  -1.344
  452    HB3  GLU  58           HB1      GLU  58  62.981  11.264  -0.514
  453    HG2  GLU  58           HG2      GLU  58  63.995  12.451   1.422
  454    HG3  GLU  58           HG1      GLU  58  65.513  12.568   0.530
  455    H    GLY  59           HN       GLY  59  66.515   8.966  -0.804
  456    HA2  GLY  59           HA2      GLY  59  64.989   7.405  -2.753
  457    HA3  GLY  59           HA1      GLY  59  66.746   7.421  -2.587
  458    H1U  RCY  60           H1U      RCY  60  71.001   2.070  -0.722
  459    H1S  RCY  60           H1S      RCY  60  68.343   3.779  -3.411
  460    HB1  RCY  60           HB1      RCY  60  65.050   1.999  -1.528
  461    HB2  RCY  60           HB2      RCY  60  66.413   2.796  -0.743
  462    HA   RCY  60           HA       RCY  60  63.590   3.597  -0.842
  463    HN1  RCY  60           HN1      RCY  60  64.009   5.544  -2.103
  464    H    GLY  61           HN       GLY  61  64.662   6.123   0.574
  465    HA2  GLY  61           HA2      GLY  61  66.334   5.614   2.717
  466    HA3  GLY  61           HA1      GLY  61  64.916   6.654   2.857
  467    H    THR  62           HN       THR  62  62.782   5.119   2.848
  468    HA   THR  62           HA       THR  62  62.535   3.941   5.331
  469    HB   THR  62           HB       THR  62  60.698   4.325   3.630
  470    HG1  THR  62           HG1      THR  62  60.203   1.769   4.366
  471   HG21  THR  62          HG21      THR  62  60.271   2.726   1.946
  472   HG22  THR  62          HG22      THR  62  61.363   1.545   2.671
  473   HG23  THR  62          HG23      THR  62  62.016   2.972   1.865
  474    H    ASP  63           HN       ASP  63  63.611   2.294   2.356
  475    HA   ASP  63           HA       ASP  63  63.845  -0.309   3.498
  476    HB2  ASP  63           HB2      ASP  63  63.971   0.287   1.033
  477    HB3  ASP  63           HB1      ASP  63  65.621   0.835   1.328
  478    H    ILE  64           HN       ILE  64  65.302   2.369   4.618
  479    HA   ILE  64           HA       ILE  64  67.417   0.839   5.943
  480    HB   ILE  64           HB       ILE  64  68.732   1.388   4.034
  481   HG12  ILE  64          HG12      ILE  64  69.159   3.707   5.943
  482   HG13  ILE  64          HG11      ILE  64  69.725   2.065   6.252
  483   HG21  ILE  64          HG21      ILE  64  67.675   4.224   4.190
  484   HG22  ILE  64          HG22      ILE  64  67.005   2.991   3.121
  485   HG23  ILE  64          HG23      ILE  64  68.673   3.527   2.914
  486   HD11  ILE  64          HD11      ILE  64  71.613   2.817   5.203
  487   HD12  ILE  64          HD12      ILE  64  70.749   4.090   4.340
  488   HD13  ILE  64          HD13      ILE  64  70.696   2.429   3.747
  489    H    THR  65           HN       THR  65  66.376   4.141   5.238
  490    HA   THR  65           HA       THR  65  65.773   5.904   6.665
  491    HB   THR  65           HB       THR  65  65.846   4.037   9.022
  492    HG1  THR  65           HG1      THR  65  63.869   4.112   6.989
  493   HG21  THR  65          HG21      THR  65  64.069   5.400   9.812
  494   HG22  THR  65          HG22      THR  65  63.758   6.060   8.207
  495   HG23  THR  65          HG23      THR  65  65.215   6.526   9.085
  496    H    VAL  66           HN       VAL  66  67.968   3.683   8.413
  497    HA   VAL  66           HA       VAL  66  69.995   5.831   8.551
  498    HB   VAL  66           HB       VAL  66  69.986   4.744  11.154
  499   HG11  VAL  66          HG11      VAL  66  69.479   7.020  11.825
  500   HG12  VAL  66          HG12      VAL  66  68.784   7.374  10.244
  501   HG13  VAL  66          HG13      VAL  66  70.516   7.082  10.401
  502   HG21  VAL  66          HG21      VAL  66  67.661   3.938  10.610
  503   HG22  VAL  66          HG22      VAL  66  67.189   5.620  10.371
  504   HG23  VAL  66          HG23      VAL  66  67.721   5.070  11.960
  505    H    ILE  67           HN       ILE  67  69.161   2.569   9.738
  506    HA   ILE  67           HA       ILE  67  71.739   1.593   8.599
  507    HB   ILE  67           HB       ILE  67  70.640   1.011  11.363
  508   HG12  ILE  67          HG12      ILE  67  73.434   1.820  10.538
  509   HG13  ILE  67          HG11      ILE  67  72.183   3.015  10.883
  510   HG21  ILE  67          HG21      ILE  67  72.717  -0.543  11.412
  511   HG22  ILE  67          HG22      ILE  67  72.621  -0.487   9.652
  512   HG23  ILE  67          HG23      ILE  67  71.271  -1.127  10.588
  513   HD11  ILE  67          HD11      ILE  67  73.503   2.595  12.903
  514   HD12  ILE  67          HD12      ILE  67  73.171   0.867  12.782
  515   HD13  ILE  67          HD13      ILE  67  71.859   1.995  13.127
  516    H1U  RCY  68           H1U      RCY  68  72.197   0.409  -0.981
  517    H1S  RCY  68           H1S      RCY  68  72.224  -0.586   3.169
  518    HB1  RCY  68           HB1      RCY  68  68.583  -0.555   4.870
  519    HB2  RCY  68           HB2      RCY  68  69.619  -1.977   4.931
  520    HA   RCY  68           HA       RCY  68  68.270  -0.887   7.095
  521    HN1  RCY  68           HN1      RCY  68  70.698   0.613   6.884
  522    HA   PRO  69           HA       PRO  69  70.249  -4.276   9.319
  523    HB2  PRO  69           HB2      PRO  69  67.984  -5.864   9.478
  524    HB3  PRO  69           HB1      PRO  69  68.378  -4.562  10.614
  525    HG2  PRO  69           HG2      PRO  69  66.483  -4.567   8.332
  526    HG3  PRO  69           HG1      PRO  69  66.365  -3.753   9.899
  527    HD2  PRO  69           HD2      PRO  69  67.034  -2.443   7.587
  528    HD3  PRO  69           HD1      PRO  69  67.590  -1.921   9.192
  529    H    TRP  70           HN       TRP  70  69.053  -4.181   6.199
  530    HA   TRP  70           HA       TRP  70  69.319  -7.024   5.576
  531    HD1  TRP  70           HD1      TRP  70  69.862  -8.194   3.518
  532    HE1  TRP  70           HE1      TRP  70  70.679  -8.520   1.096
  533    HE3  TRP  70           HE3      TRP  70  68.830  -3.572   1.610
  534    HZ2  TRP  70           HZ2      TRP  70  70.871  -7.017  -1.335
  535    HZ3  TRP  70           HZ3      TRP  70  69.338  -3.046  -0.755
  536    HH2  TRP  70           HH2      TRP  70  70.355  -4.758  -2.229
  537    HB2  TRP  70           HB2      TRP  70  67.786  -5.905   4.178
  538    HB3  TRP  70           HB1      TRP  70  68.844  -4.512   3.977
  539    H    GLU  71           HN       GLU  71  71.434  -4.276   5.825
  540    HA   GLU  71           HA       GLU  71  73.708  -5.999   5.140
  541    HB2  GLU  71           HB2      GLU  71  72.989  -3.601   3.428
  542    HB3  GLU  71           HB1      GLU  71  74.586  -4.348   3.433
  543    HG2  GLU  71           HG2      GLU  71  73.372  -6.561   2.940
  544    HG3  GLU  71           HG1      GLU  71  71.962  -5.568   2.567
  545    H    ALA  72           HN       ALA  72  72.866  -4.593   7.517
  546    HA   ALA  72           HA       ALA  72  74.184  -2.105   7.903
  547    HB1  ALA  72           HB1      ALA  72  73.837  -4.328   9.942
  548    HB2  ALA  72           HB2      ALA  72  72.595  -3.144   9.533
  549    HB3  ALA  72           HB3      ALA  72  74.099  -2.619  10.291
  550    H1U  RCY  73           H1U      RCY  73  74.920  -1.158   5.497
  551    H1S  RCY  73           H1S      RCY  73  75.819  -1.080   9.418
  552    HB1  RCY  73           HB1      RCY  73  79.071  -0.999   8.300
  553    HB2  RCY  73           HB2      RCY  73  79.779  -1.963   9.593
  554    HA   RCY  73           HA       RCY  73  78.434  -3.148   7.658
  555    HN1  RCY  73           HN1      RCY  73  76.313  -1.646   8.753
  556    H    ASN  74           HN       ASN  74  78.008  -5.374   8.160
  557    HA   ASN  74           HA       ASN  74  77.906  -6.275  10.932
  558    HB2  ASN  74           HB2      ASN  74  78.241  -7.742   8.300
  559    HB3  ASN  74           HB1      ASN  74  78.163  -8.560   9.860
  560   HD21  ASN  74          HD21      ASN  74  76.264  -5.774  10.035
  561   HD22  ASN  74          HD22      ASN  74  74.757  -6.470   9.682
  562    H    HIS  75           HN       HIS  75  79.876  -5.371  11.801
  563    HA   HIS  75           HA       HIS  75  82.174  -5.361  12.297
  564    HD1  HIS  75           HD1      HIS  75  84.421  -8.674  10.832
  565    HD2  HIS  75           HD2      HIS  75  83.866  -6.568  14.390
  566    HE1  HIS  75           HE1      HIS  75  86.690  -8.548  11.951
  567    HE2  HIS  75           HE2      HIS  75  86.366  -7.268  14.118
  568    HB2  HIS  75           HB2      HIS  75  81.561  -7.705  12.920
  569    HB3  HIS  75           HB1      HIS  75  81.989  -8.216  11.287
  570    H1U  RCY  76           H1U      RCY  76  80.670  -6.129   3.040
  571    H1S  RCY  76           H1S      RCY  76  84.461  -3.667   4.700
  572    HB1  RCY  76           HB1      RCY  76  84.886  -4.900   8.450
  573    HB2  RCY  76           HB2      RCY  76  83.925  -3.617   9.184
  574    HA   RCY  76           HA       RCY  76  82.151  -4.417   7.345
  575    HN1  RCY  76           HN1      RCY  76  81.120  -5.031   9.361
  576    H    GLU  77           HN       GLU  77  82.724  -5.581   5.520
  577    HA   GLU  77           HA       GLU  77  82.615  -8.386   5.537
  578    HB2  GLU  77           HB2      GLU  77  83.774  -6.424   3.559
  579    HB3  GLU  77           HB1      GLU  77  83.797  -8.160   3.251
  580    HG2  GLU  77           HG2      GLU  77  81.261  -6.699   4.006
  581    HG3  GLU  77           HG1      GLU  77  81.780  -6.873   2.329
  582    H    LEU  78           HN       LEU  78  85.559  -7.284   4.058
  583    HA   LEU  78           HA       LEU  78  87.315  -8.089   6.231
  584    HG   LEU  78           HG       LEU  78  89.234  -9.588   5.631
  585    HB2  LEU  78           HB2      LEU  78  86.338 -10.268   5.230
  586    HB3  LEU  78           HB1      LEU  78  87.329  -9.906   3.819
  587   HD11  LEU  78          HD11      LEU  78  88.905 -11.265   7.478
  588   HD12  LEU  78          HD12      LEU  78  87.215 -11.396   6.991
  589   HD13  LEU  78          HD13      LEU  78  87.843  -9.863   7.598
  590   HD21  LEU  78          HD21      LEU  78  89.386 -11.251   3.890
  591   HD22  LEU  78          HD22      LEU  78  88.135 -12.236   4.648
  592   HD23  LEU  78          HD23      LEU  78  89.712 -12.069   5.418
  593    H    HIS  79           HN       HIS  79  87.619  -8.492   2.691
  594    HA   HIS  79           HA       HIS  79  89.942  -6.628   2.768
  595    HD1  HIS  79           HD1      HIS  79  92.083  -7.160   2.506
  596    HD2  HIS  79           HD2      HIS  79  90.545 -10.947   1.675
  597    HE1  HIS  79           HE1      HIS  79  93.721  -8.827   3.481
  598    HE2  HIS  79           HE2      HIS  79  92.797 -11.136   2.982
  599    HB2  HIS  79           HB2      HIS  79  89.026  -8.786   0.878
  600    HB3  HIS  79           HB1      HIS  79  90.149  -7.546   0.321
  601    H    GLU  80           HN       GLU  80  89.983  -5.681   0.191
  602    HA   GLU  80           HA       GLU  80  87.514  -3.993   0.109
  603    HB2  GLU  80           HB2      GLU  80  89.159  -2.655  -1.520
  604    HB3  GLU  80           HB1      GLU  80  89.236  -2.447   0.228
  605    HG2  GLU  80           HG2      GLU  80  90.835  -4.684  -0.915
  606    HG3  GLU  80           HG1      GLU  80  91.411  -3.049  -1.247
  607    H    LEU  81           HN       LEU  81  89.383  -6.343  -1.595
  608    HA   LEU  81           HA       LEU  81  88.060  -5.830  -4.185
  609    HG   LEU  81           HG       LEU  81  89.985  -6.208  -5.819
  610    HB2  LEU  81           HB2      LEU  81  90.217  -7.643  -3.166
  611    HB3  LEU  81           HB1      LEU  81  89.335  -8.148  -4.604
  612   HD11  LEU  81          HD11      LEU  81  90.604  -5.130  -3.083
  613   HD12  LEU  81          HD12      LEU  81  89.664  -4.395  -4.382
  614   HD13  LEU  81          HD13      LEU  81  91.423  -4.452  -4.490
  615   HD21  LEU  81          HD21      LEU  81  91.800  -7.925  -5.378
  616   HD22  LEU  81          HD22      LEU  81  92.397  -6.862  -4.103
  617   HD23  LEU  81          HD23      LEU  81  92.394  -6.313  -5.779
  618    H    ALA  82           HN       ALA  82  88.000  -8.191  -1.546
  619    HA   ALA  82           HA       ALA  82  86.197 -10.043  -2.756
  620    HB1  ALA  82           HB1      ALA  82  86.733  -9.348   0.142
  621    HB2  ALA  82           HB2      ALA  82  87.393 -10.702  -0.775
  622    HB3  ALA  82           HB3      ALA  82  85.681 -10.674  -0.354
  623    H    GLN  83           HN       GLN  83  84.721  -9.069   0.110
  624    HA   GLN  83           HA       GLN  83  82.581  -8.190   0.517
  625    HB2  GLN  83           HB2      GLN  83  83.384  -6.269  -1.692
  626    HB3  GLN  83           HB1      GLN  83  82.132  -6.004  -0.478
  627    HG2  GLN  83           HG2      GLN  83  84.075  -6.453   1.230
  628    HG3  GLN  83           HG1      GLN  83  85.118  -6.048  -0.134
  629   HE21  GLN  83          HE21      GLN  83  84.753  -4.419   2.311
  630   HE22  GLN  83          HE22      GLN  83  84.122  -2.928   1.803
  631    H    TYR  84           HN       TYR  84  81.999 -10.345  -0.652
  632    HA   TYR  84           HA       TYR  84  80.345 -11.377  -1.972
  633    HD1  TYR  84           HD2      TYR  84  78.678 -10.424  -4.997
  634    HD2  TYR  84           HD1      TYR  84  77.577 -10.406  -0.845
  635    HE1  TYR  84           HE2      TYR  84  76.672 -11.784  -5.523
  636    HE2  TYR  84           HE1      TYR  84  75.571 -11.766  -1.371
  637    HH   TYR  84           HH       TYR  84  75.143 -13.542  -3.805
  638    HB2  TYR  84           HB2      TYR  84  79.301  -8.930  -1.667
  639    HB3  TYR  84           HB1      TYR  84  79.678  -8.823  -3.386
  640    H    GLY  85           HN       GLY  85  82.189  -8.818  -3.641
  641    HA2  GLY  85           HA2      GLY  85  83.892  -9.581  -5.304
  642    HA3  GLY  85           HA1      GLY  85  82.721 -10.791  -5.830
  643    H    ILE  86           HN       ILE  86  82.439  -7.274  -5.197
  644    HA   ILE  86           HA       ILE  86  81.788  -6.857  -8.056
  645    HB   ILE  86           HB       ILE  86  79.632  -7.372  -6.858
  646   HG12  ILE  86          HG12      ILE  86  79.903  -4.511  -7.835
  647   HG13  ILE  86          HG11      ILE  86  79.752  -5.917  -8.890
  648   HG21  ILE  86          HG21      ILE  86  80.065  -4.703  -5.503
  649   HG22  ILE  86          HG22      ILE  86  80.449  -6.233  -4.713
  650   HG23  ILE  86          HG23      ILE  86  78.789  -5.882  -5.197
  651   HD11  ILE  86          HD11      ILE  86  77.576  -6.460  -7.857
  652   HD12  ILE  86          HD12      ILE  86  77.560  -4.839  -8.552
  653   HD13  ILE  86          HD13      ILE  86  77.723  -5.049  -6.809
  654    H1U  RCY  87           H1U      RCY  87  88.457   1.370  -1.863
  655    H1S  RCY  87           H1S      RCY  87  85.993  -1.812  -2.368
  656    HB1  RCY  87           HB1      RCY  87  85.189  -4.030  -3.922
  657    HB2  RCY  87           HB2      RCY  87  83.527  -4.365  -3.436
  658    HA   RCY  87           HA       RCY  87  83.065  -2.954  -5.703
  659    HN1  RCY  87           HN1      RCY  87  83.173  -5.822  -5.150
  Start of MODEL   40
    1    HA   MET   1           HA       MET   1  51.893   7.440   9.296
    2    HB2  MET   1           HB2      MET   1  50.360   5.316   9.434
    3    HB3  MET   1           HB1      MET   1  49.808   6.821  10.170
    4    HG2  MET   1           HG2      MET   1  48.350   7.300   8.359
    5    HG3  MET   1           HG1      MET   1  49.123   6.106   7.317
    6    HE1  MET   1           HE1      MET   1  47.680   6.262  10.983
    7    HE2  MET   1           HE2      MET   1  46.129   5.472  10.710
    8    HE3  MET   1           HE3      MET   1  46.517   6.959   9.848
    9    H    ASN   2           HN       ASN   2  53.677   6.977   7.975
   10    HA   ASN   2           HA       ASN   2  54.982   5.773   6.437
   11    HB2  ASN   2           HB2      ASN   2  52.946   3.659   7.206
   12    HB3  ASN   2           HB1      ASN   2  54.443   3.334   6.331
   13   HD21  ASN   2          HD21      ASN   2  56.508   3.786   7.501
   14   HD22  ASN   2          HD22      ASN   2  56.529   3.792   9.198
   15    H    LEU   3           HN       LEU   3  54.331   7.063   4.597
   16    HA   LEU   3           HA       LEU   3  52.027   6.782   3.045
   17    HG   LEU   3           HG       LEU   3  53.587   8.585   0.277
   18    HB2  LEU   3           HB2      LEU   3  53.913   8.436   2.684
   19    HB3  LEU   3           HB1      LEU   3  54.826   7.139   1.924
   20   HD11  LEU   3          HD11      LEU   3  54.048   5.954   0.163
   21   HD12  LEU   3          HD12      LEU   3  53.145   6.787  -1.103
   22   HD13  LEU   3          HD13      LEU   3  52.285   5.898   0.154
   23   HD21  LEU   3          HD21      LEU   3  51.269   8.763   0.292
   24   HD22  LEU   3          HD22      LEU   3  51.590   8.682   2.024
   25   HD23  LEU   3          HD23      LEU   3  51.055   7.242   1.158
   26    H    GLU   4           HN       GLU   4  55.122   5.084   2.399
   27    HA   GLU   4           HA       GLU   4  54.222   3.332   0.428
   28    HB2  GLU   4           HB2      GLU   4  55.939   1.690   1.544
   29    HB3  GLU   4           HB1      GLU   4  56.519   3.205   0.851
   30    HG2  GLU   4           HG2      GLU   4  56.598   4.261   3.007
   31    HG3  GLU   4           HG1      GLU   4  55.740   2.916   3.762
   32    HA   PRO   5           HA       PRO   5  50.817   1.249   2.535
   33    HB2  PRO   5           HB2      PRO   5  51.633  -0.867   0.568
   34    HB3  PRO   5           HB1      PRO   5  50.010  -0.270   0.968
   35    HG2  PRO   5           HG2      PRO   5  51.278   0.502  -1.248
   36    HG3  PRO   5           HG1      PRO   5  50.236   1.608  -0.338
   37    HD2  PRO   5           HD2      PRO   5  53.197   1.594  -0.571
   38    HD3  PRO   5           HD1      PRO   5  52.102   2.939  -0.183
   39    HA   PRO   6           HA       PRO   6  53.006  -1.432   5.331
   40    HB2  PRO   6           HB2      PRO   6  50.948  -2.872   6.382
   41    HB3  PRO   6           HB1      PRO   6  51.196  -1.153   6.748
   42    HG2  PRO   6           HG2      PRO   6  49.294  -2.415   4.836
   43    HG3  PRO   6           HG1      PRO   6  49.049  -1.049   5.938
   44    HD2  PRO   6           HD2      PRO   6  49.545  -0.744   3.252
   45    HD3  PRO   6           HD1      PRO   6  49.982   0.474   4.471
   46    H    LYS   7           HN       LYS   7  53.664  -3.668   5.642
   47    HA   LYS   7           HA       LYS   7  52.519  -5.859   4.182
   48    HB2  LYS   7           HB2      LYS   7  54.425  -6.165   2.562
   49    HB3  LYS   7           HB1      LYS   7  53.397  -4.777   2.203
   50    HG2  LYS   7           HG2      LYS   7  54.993  -3.264   3.252
   51    HG3  LYS   7           HG1      LYS   7  55.992  -4.624   3.765
   52    HD2  LYS   7           HD2      LYS   7  57.095  -3.997   1.820
   53    HD3  LYS   7           HD1      LYS   7  55.974  -5.201   1.183
   54    HE2  LYS   7           HE2      LYS   7  55.714  -3.354  -0.271
   55    HE3  LYS   7           HE1      LYS   7  54.348  -3.223   0.836
   56    HZ1  LYS   7           HZ1      LYS   7  56.724  -1.918   1.788
   57    HZ2  LYS   7           HZ2      LYS   7  55.131  -1.337   1.689
   58    HZ3  LYS   7           HZ3      LYS   7  56.149  -1.267   0.331
   59    H    ALA   8           HN       ALA   8  53.632  -5.190   6.821
   60    HA   ALA   8           HA       ALA   8  56.192  -6.258   7.305
   61    HB1  ALA   8           HB1      ALA   8  55.288  -6.833   9.587
   62    HB2  ALA   8           HB2      ALA   8  53.685  -6.386   9.005
   63    HB3  ALA   8           HB3      ALA   8  54.963  -5.173   9.089
   64    H    GLU   9           HN       GLU   9  56.468  -8.067   5.865
   65    HA   GLU   9           HA       GLU   9  55.559 -10.604   7.031
   66    HB2  GLU   9           HB2      GLU   9  53.731  -9.821   5.418
   67    HB3  GLU   9           HB1      GLU   9  54.909 -10.061   4.127
   68    HG2  GLU   9           HG2      GLU   9  55.176 -12.412   4.778
   69    HG3  GLU   9           HG1      GLU   9  54.042 -12.185   6.111
   70    H1U  RCY  10           H1U      RCY  10  61.055  -6.662   8.698
   71    H1S  RCY  10           H1S      RCY  10  60.021 -10.161   7.001
   72    HB1  RCY  10           HB1      RCY  10  59.871 -13.984   6.110
   73    HB2  RCY  10           HB2      RCY  10  58.859 -13.243   7.347
   74    HA   RCY  10           HA       RCY  10  59.538 -11.346   5.234
   75    HN1  RCY  10           HN1      RCY  10  57.151 -12.111   6.756
   76    H    ARG  11           HN       ARG  11  56.911 -12.043   3.875
   77    HA   ARG  11           HA       ARG  11  56.883 -14.514   2.602
   78    HE   ARG  11           HE       ARG  11  54.539 -14.933   3.247
   79    HB2  ARG  11           HB2      ARG  11  55.305 -12.500   2.271
   80    HB3  ARG  11           HB1      ARG  11  56.460 -11.951   1.059
   81    HG2  ARG  11           HG2      ARG  11  55.151 -13.227  -0.329
   82    HG3  ARG  11           HG1      ARG  11  56.188 -14.521   0.272
   83    HD2  ARG  11           HD2      ARG  11  53.521 -13.729   1.481
   84    HD3  ARG  11           HD1      ARG  11  53.783 -15.121   0.429
   85   HH11  ARG  11          HH21      ARG  11  55.100 -16.372   0.164
   86   HH12  ARG  11          HH22      ARG  11  55.810 -17.811   0.817
   87   HH21  ARG  11          HH11      ARG  11  55.462 -16.804   4.117
   88   HH22  ARG  11          HH12      ARG  11  56.015 -18.055   3.055
   89    H    SER  12           HN       SER  12  58.958 -15.357   2.200
   90    HA   SER  12           HA       SER  12  60.163 -14.622  -0.318
   91    HG   SER  12           HG       SER  12  61.705 -12.216   0.027
   92    HB2  SER  12           HB2      SER  12  61.520 -13.764   2.241
   93    HB3  SER  12           HB1      SER  12  62.426 -14.044   0.756
   94    H    ALA  13           HN       ALA  13  60.895 -16.545  -1.080
   95    HA   ALA  13           HA       ALA  13  62.566 -18.302   0.507
   96    HB1  ALA  13           HB1      ALA  13  59.862 -19.433  -0.239
   97    HB2  ALA  13           HB2      ALA  13  60.186 -18.752   1.355
   98    HB3  ALA  13           HB3      ALA  13  61.095 -20.156   0.794
   99    H    THR  14           HN       THR  14  60.620 -17.710  -2.360
  100    HA   THR  14           HA       THR  14  61.803 -19.861  -3.917
  101    HB   THR  14           HB       THR  14  60.788 -18.579  -5.859
  102    HG1  THR  14           HG1      THR  14  59.216 -17.018  -4.420
  103   HG21  THR  14          HG21      THR  14  58.471 -19.054  -5.173
  104   HG22  THR  14          HG22      THR  14  58.987 -19.151  -3.489
  105   HG23  THR  14          HG23      THR  14  59.555 -20.346  -4.655
  106    H    ARG  15           HN       ARG  15  63.666 -17.992  -2.550
  107    HA   ARG  15           HA       ARG  15  65.595 -16.732  -3.023
  108    HE   ARG  15           HE       ARG  15  68.379 -17.431  -7.053
  109    HB2  ARG  15           HB2      ARG  15  65.979 -19.058  -4.077
  110    HB3  ARG  15           HB1      ARG  15  65.651 -18.273  -5.622
  111    HG2  ARG  15           HG2      ARG  15  67.465 -16.679  -5.239
  112    HG3  ARG  15           HG1      ARG  15  67.761 -17.365  -3.641
  113    HD2  ARG  15           HD2      ARG  15  69.314 -18.611  -4.764
  114    HD3  ARG  15           HD1      ARG  15  67.915 -19.611  -5.156
  115   HH11  ARG  15          HH21      ARG  15  69.044 -20.677  -6.101
  116   HH12  ARG  15          HH22      ARG  15  69.476 -21.197  -7.696
  117   HH21  ARG  15          HH11      ARG  15  68.940 -18.091  -9.141
  118   HH22  ARG  15          HH12      ARG  15  69.417 -19.733  -9.417
  119    H    VAL  16           HN       VAL  16  65.913 -16.684  -6.291
  120    HA   VAL  16           HA       VAL  16  65.588 -13.960  -6.683
  121    HB   VAL  16           HB       VAL  16  64.852 -16.062  -8.741
  122   HG11  VAL  16          HG11      VAL  16  64.325 -13.734  -9.369
  123   HG12  VAL  16          HG12      VAL  16  65.667 -14.356 -10.331
  124   HG13  VAL  16          HG13      VAL  16  65.980 -13.256  -8.988
  125   HG21  VAL  16          HG21      VAL  16  67.515 -15.045  -7.739
  126   HG22  VAL  16          HG22      VAL  16  67.339 -15.733  -9.353
  127   HG23  VAL  16          HG23      VAL  16  66.986 -16.716  -7.932
  128    H    MET  17           HN       MET  17  63.783 -12.980  -5.776
  129    HA   MET  17           HA       MET  17  61.100 -14.067  -6.186
  130    HB2  MET  17           HB2      MET  17  61.636 -12.865  -4.116
  131    HB3  MET  17           HB1      MET  17  62.029 -11.416  -5.042
  132    HG2  MET  17           HG2      MET  17  59.775 -11.105  -5.722
  133    HG3  MET  17           HG1      MET  17  59.322 -12.741  -5.241
  134    HE1  MET  17           HE1      MET  17  61.715 -10.491  -2.913
  135    HE2  MET  17           HE2      MET  17  60.503  -9.288  -2.479
  136    HE3  MET  17           HE3      MET  17  60.918  -9.539  -4.172
  137    H    GLY  18           HN       GLY  18  62.431 -10.833  -6.977
  138    HA2  GLY  18           HA2      GLY  18  62.188  -9.571  -8.955
  139    HA3  GLY  18           HA1      GLY  18  61.547 -11.014  -9.743
  140    H    GLY  19           HN       GLY  19  59.609 -10.347 -10.593
  141    HA2  GLY  19           HA2      GLY  19  57.444  -9.433 -10.678
  142    HA3  GLY  19           HA1      GLY  19  57.305 -10.042  -9.028
  143    HA   PRO  20           HA       PRO  20  56.449  -5.720  -8.041
  144    HB2  PRO  20           HB2      PRO  20  57.398  -6.763  -5.390
  145    HB3  PRO  20           HB1      PRO  20  55.987  -5.751  -5.761
  146    HG2  PRO  20           HG2      PRO  20  55.744  -8.362  -5.281
  147    HG3  PRO  20           HG1      PRO  20  54.731  -7.541  -6.479
  148    HD2  PRO  20           HD2      PRO  20  56.965  -9.452  -6.913
  149    HD3  PRO  20           HD1      PRO  20  55.585  -9.071  -7.966
  150    H1U  RCY  21           H1U      RCY  21  63.232   0.263  -3.918
  151    H1S  RCY  21           H1S      RCY  21  63.640  -4.246  -5.640
  152    HB1  RCY  21           HB1      RCY  21  62.519  -7.010  -6.369
  153    HB2  RCY  21           HB2      RCY  21  61.106  -7.431  -5.403
  154    HA   RCY  21           HA       RCY  21  60.756  -4.735  -6.249
  155    HN1  RCY  21           HN1      RCY  21  59.259  -7.170  -6.337
  156    H    THR  22           HN       THR  22  60.937  -3.717  -8.248
  157    HA   THR  22           HA       THR  22  62.665  -5.091 -10.240
  158    HB   THR  22           HB       THR  22  60.087  -3.663 -10.947
  159    HG1  THR  22           HG1      THR  22  59.968  -6.069 -11.793
  160   HG21  THR  22          HG21      THR  22  62.241  -5.018 -12.581
  161   HG22  THR  22          HG22      THR  22  61.684  -3.349 -12.701
  162   HG23  THR  22          HG23      THR  22  60.635  -4.668 -13.220
  163    HA   PRO  23           HA       PRO  23  64.503  -0.987  -9.353
  164    HB2  PRO  23           HB2      PRO  23  66.300  -2.028 -11.512
  165    HB3  PRO  23           HB1      PRO  23  66.720  -1.267  -9.965
  166    HG2  PRO  23           HG2      PRO  23  66.932  -3.897 -10.328
  167    HG3  PRO  23           HG1      PRO  23  66.423  -3.211  -8.776
  168    HD2  PRO  23           HD2      PRO  23  64.791  -4.634 -10.826
  169    HD3  PRO  23           HD1      PRO  23  64.557  -4.532  -9.067
  170    H    ARG  24           HN       ARG  24  65.557   0.608 -11.235
  171    HA   ARG  24           HA       ARG  24  63.349   1.562 -12.742
  172    HE   ARG  24           HE       ARG  24  66.675   4.217  -9.803
  173    HB2  ARG  24           HB2      ARG  24  66.292   1.978 -13.357
  174    HB3  ARG  24           HB1      ARG  24  64.956   3.010 -13.869
  175    HG2  ARG  24           HG2      ARG  24  64.435   3.523 -11.519
  176    HG3  ARG  24           HG1      ARG  24  65.754   2.476 -10.992
  177    HD2  ARG  24           HD2      ARG  24  67.265   3.950 -12.482
  178    HD3  ARG  24           HD1      ARG  24  65.923   5.095 -12.482
  179   HH11  ARG  24          HH21      ARG  24  67.266   6.379 -12.423
  180   HH12  ARG  24          HH22      ARG  24  67.966   7.609 -11.425
  181   HH21  ARG  24          HH11      ARG  24  67.586   5.811  -8.484
  182   HH22  ARG  24          HH12      ARG  24  68.148   7.287  -9.195
  183    H    LYS  25           HN       LYS  25  65.879   1.321 -14.964
  184    HA   LYS  25           HA       LYS  25  64.416  -0.844 -16.418
  185    HB2  LYS  25           HB2      LYS  25  66.197   0.453 -18.206
  186    HB3  LYS  25           HB1      LYS  25  64.443   0.563 -18.183
  187    HG2  LYS  25           HG2      LYS  25  66.094   2.241 -16.301
  188    HG3  LYS  25           HG1      LYS  25  65.825   2.766 -17.964
  189    HD2  LYS  25           HD2      LYS  25  63.341   2.422 -17.552
  190    HD3  LYS  25           HD1      LYS  25  63.735   2.215 -15.845
  191    HE2  LYS  25           HE2      LYS  25  63.940   4.673 -17.551
  192    HE3  LYS  25           HE1      LYS  25  63.303   4.499 -15.915
  193    HZ1  LYS  25           HZ1      LYS  25  65.415   5.616 -15.852
  194    HZ2  LYS  25           HZ2      LYS  25  66.157   4.360 -16.722
  195    HZ3  LYS  25           HZ3      LYS  25  65.580   4.082 -15.148
  196    H    GLY  26           HN       GLY  26  67.532   0.190 -15.183
  197    HA2  GLY  26           HA2      GLY  26  69.103  -1.589 -14.511
  198    HA3  GLY  26           HA1      GLY  26  68.610  -2.487 -15.940
  199    HA   PRO  27           HA       PRO  27  71.012   0.719 -18.483
  200    HB2  PRO  27           HB2      PRO  27  71.213   2.979 -16.532
  201    HB3  PRO  27           HB1      PRO  27  70.964   3.026 -18.288
  202    HG2  PRO  27           HG2      PRO  27  68.965   3.455 -16.570
  203    HG3  PRO  27           HG1      PRO  27  68.712   2.626 -18.114
  204    HD2  PRO  27           HD2      PRO  27  68.733   1.495 -15.360
  205    HD3  PRO  27           HD1      PRO  27  67.894   0.912 -16.814
  206    HA   PRO  28           HA       PRO  28  74.847  -0.838 -16.752
  207    HB2  PRO  28           HB2      PRO  28  75.982   1.413 -18.384
  208    HB3  PRO  28           HB1      PRO  28  76.512  -0.278 -18.281
  209    HG2  PRO  28           HG2      PRO  28  75.069   0.635 -20.343
  210    HG3  PRO  28           HG1      PRO  28  74.890  -1.014 -19.723
  211    HD2  PRO  28           HD2      PRO  28  73.012   1.264 -19.523
  212    HD3  PRO  28           HD1      PRO  28  72.693  -0.477 -19.362
  213    H    LYS  29           HN       LYS  29  75.880  -0.307 -14.836
  214    HA   LYS  29           HA       LYS  29  76.368   0.975 -12.921
  215    HB2  LYS  29           HB2      LYS  29  77.181   2.716 -15.246
  216    HB3  LYS  29           HB1      LYS  29  77.353   3.302 -13.592
  217    HG2  LYS  29           HG2      LYS  29  79.408   2.147 -14.522
  218    HG3  LYS  29           HG1      LYS  29  78.802   1.469 -13.010
  219    HD2  LYS  29           HD2      LYS  29  77.791  -0.378 -14.125
  220    HD3  LYS  29           HD1      LYS  29  77.973   0.382 -15.706
  221    HE2  LYS  29           HE2      LYS  29  79.679  -1.484 -14.893
  222    HE3  LYS  29           HE1      LYS  29  80.235  -0.099 -15.833
  223    HZ1  LYS  29           HZ1      LYS  29  80.306  -0.381 -12.879
  224    HZ2  LYS  29           HZ2      LYS  29  80.716   1.037 -13.719
  225    HZ3  LYS  29           HZ3      LYS  29  81.638  -0.374 -13.929
  226    H1U  RCY  30           H1U      RCY  30  76.952   6.895  -5.963
  227    H1S  RCY  30           H1S      RCY  30  74.639   6.235 -10.194
  228    HB1  RCY  30           HB1      RCY  30  72.754   3.717 -11.888
  229    HB2  RCY  30           HB2      RCY  30  73.032   5.442 -11.656
  230    HA   RCY  30           HA       RCY  30  73.026   4.396 -14.093
  231    HN1  RCY  30           HN1      RCY  30  75.808   4.067 -14.207
  232    H    LYS  31           HN       LYS  31  74.626   6.464 -11.832
  233    HA   LYS  31           HA       LYS  31  75.865   8.280 -13.683
  234    HB2  LYS  31           HB2      LYS  31  74.172  10.082 -13.635
  235    HB3  LYS  31           HB1      LYS  31  73.536   8.636 -14.418
  236    HG2  LYS  31           HG2      LYS  31  72.734   8.040 -11.971
  237    HG3  LYS  31           HG1      LYS  31  72.866   9.782 -11.730
  238    HD2  LYS  31           HD2      LYS  31  71.251   8.414 -13.903
  239    HD3  LYS  31           HD1      LYS  31  70.592   9.183 -12.459
  240    HE2  LYS  31           HE2      LYS  31  71.843  11.302 -13.252
  241    HE3  LYS  31           HE1      LYS  31  71.971  10.480 -14.807
  242    HZ1  LYS  31           HZ1      LYS  31  69.340  10.431 -13.605
  243    HZ2  LYS  31           HZ2      LYS  31  69.797  10.727 -15.215
  244    HZ3  LYS  31           HZ3      LYS  31  69.881  11.973 -14.062
  245    H    GLN  32           HN       GLN  32  76.667   7.275 -11.215
  246    HA   GLN  32           HA       GLN  32  76.611   9.746  -9.525
  247    HB2  GLN  32           HB2      GLN  32  76.133   6.883  -8.734
  248    HB3  GLN  32           HB1      GLN  32  76.872   7.991  -7.578
  249    HG2  GLN  32           HG2      GLN  32  74.348   8.738  -9.052
  250    HG3  GLN  32           HG1      GLN  32  74.289   7.793  -7.564
  251   HE21  GLN  32          HE21      GLN  32  74.732   8.878  -5.570
  252   HE22  GLN  32          HE22      GLN  32  75.029  10.546  -5.474
  253    H    ARG  33           HN       ARG  33  78.663  10.469 -10.025
  254    HA   ARG  33           HA       ARG  33  80.912   8.844  -9.017
  255    HE   ARG  33           HE       ARG  33  81.661   9.037 -13.486
  256    HB2  ARG  33           HB2      ARG  33  80.712   9.802 -11.889
  257    HB3  ARG  33           HB1      ARG  33  82.218   9.276 -11.139
  258    HG2  ARG  33           HG2      ARG  33  80.861   7.128 -10.512
  259    HG3  ARG  33           HG1      ARG  33  79.771   7.652 -11.795
  260    HD2  ARG  33           HD2      ARG  33  82.587   6.683 -11.977
  261    HD3  ARG  33           HD1      ARG  33  81.228   6.397 -13.064
  262   HH11  ARG  33          HH21      ARG  33  83.792   6.344 -13.184
  263   HH12  ARG  33          HH22      ARG  33  84.997   7.009 -14.237
  264   HH21  ARG  33          HH11      ARG  33  83.221   9.922 -14.862
  265   HH22  ARG  33          HH12      ARG  33  84.673   9.035 -15.186
  266    H    GLN  34           HN       GLN  34  80.967  10.576  -7.440
  267    HA   GLN  34           HA       GLN  34  81.900  13.204  -8.538
  268    HB2  GLN  34           HB2      GLN  34  80.408  12.482  -6.011
  269    HB3  GLN  34           HB1      GLN  34  81.226  14.034  -6.202
  270    HG2  GLN  34           HG2      GLN  34  79.914  14.452  -8.266
  271    HG3  GLN  34           HG1      GLN  34  79.064  12.926  -8.019
  272   HE21  GLN  34          HE21      GLN  34  79.653  16.112  -6.469
  273   HE22  GLN  34          HE22      GLN  34  78.215  16.111  -5.567
  274    H    THR  35           HN       THR  35  83.065  10.420  -7.216
  275    HA   THR  35           HA       THR  35  85.489  11.820  -6.238
  276    HB   THR  35           HB       THR  35  84.336   9.575  -4.585
  277    HG1  THR  35           HG1      THR  35  83.678  11.494  -3.231
  278   HG21  THR  35          HG21      THR  35  86.751  10.472  -4.432
  279   HG22  THR  35          HG22      THR  35  85.835  10.353  -2.930
  280   HG23  THR  35          HG23      THR  35  86.031  11.916  -3.721
  281    H    ARG  36           HN       ARG  36  84.771  10.181  -8.594
  282    HA   ARG  36           HA       ARG  36  85.630   8.374  -9.821
  283    HE   ARG  36           HE       ARG  36  88.793  11.327  -8.199
  284    HB2  ARG  36           HB2      ARG  36  87.890   9.064  -7.940
  285    HB3  ARG  36           HB1      ARG  36  88.048   7.786  -9.145
  286    HG2  ARG  36           HG2      ARG  36  87.593   9.341 -10.945
  287    HG3  ARG  36           HG1      ARG  36  87.219  10.627  -9.796
  288    HD2  ARG  36           HD2      ARG  36  89.909   9.251  -9.834
  289    HD3  ARG  36           HD1      ARG  36  89.569  10.666 -10.830
  290   HH11  ARG  36          HH21      ARG  36  91.602  10.408  -9.976
  291   HH12  ARG  36          HH22      ARG  36  92.694  11.290  -8.961
  292   HH21  ARG  36          HH11      ARG  36  90.204  12.483  -6.865
  293   HH22  ARG  36          HH12      ARG  36  91.903  12.465  -7.200
  294    H    GLN  37           HN       GLN  37  87.346   7.413  -6.903
  295    HA   GLN  37           HA       GLN  37  85.376   5.536  -5.969
  296    HB2  GLN  37           HB2      GLN  37  86.956   4.713  -8.235
  297    HB3  GLN  37           HB1      GLN  37  87.408   3.732  -6.843
  298    HG2  GLN  37           HG2      GLN  37  85.123   3.057  -6.478
  299    HG3  GLN  37           HG1      GLN  37  84.534   4.215  -7.672
  300   HE21  GLN  37          HE21      GLN  37  87.489   2.742  -8.623
  301   HE22  GLN  37          HE22      GLN  37  86.836   1.593  -9.688
  302    H1U  RCY  38           H1U      RCY  38  84.600   4.314   2.185
  303    H1S  RCY  38           H1S      RCY  38  86.686   7.707   0.339
  304    HB1  RCY  38           HB1      RCY  38  88.802   6.080  -1.603
  305    HB2  RCY  38           HB2      RCY  38  87.335   5.724  -2.515
  306    HA   RCY  38           HA       RCY  38  89.365   7.646  -3.629
  307    HN1  RCY  38           HN1      RCY  38  87.694   7.487  -5.278
  308    H    LYS  39           HN       LYS  39  91.175   6.836  -4.752
  309    HA   LYS  39           HA       LYS  39  91.799   4.238  -5.484
  310    HB2  LYS  39           HB2      LYS  39  94.235   4.917  -4.870
  311    HB3  LYS  39           HB1      LYS  39  93.384   5.872  -6.085
  312    HG2  LYS  39           HG2      LYS  39  92.815   7.563  -4.441
  313    HG3  LYS  39           HG1      LYS  39  93.482   6.577  -3.139
  314    HD2  LYS  39           HD2      LYS  39  95.712   6.828  -3.962
  315    HD3  LYS  39           HD1      LYS  39  95.145   7.502  -5.490
  316    HE2  LYS  39           HE2      LYS  39  95.970   9.305  -4.055
  317    HE3  LYS  39           HE1      LYS  39  94.225   9.457  -4.255
  318    HZ1  LYS  39           HZ1      LYS  39  94.012   9.339  -2.070
  319    HZ2  LYS  39           HZ2      LYS  39  95.690   9.146  -1.883
  320    HZ3  LYS  39           HZ3      LYS  39  94.692   7.784  -2.074
  321    H    SER  40           HN       SER  40  91.950   5.631  -2.233
  322    HA   SER  40           HA       SER  40  91.696   3.060  -0.984
  323    HG   SER  40           HG       SER  40  94.969   3.170   0.650
  324    HB2  SER  40           HB2      SER  40  93.978   2.650  -1.575
  325    HB3  SER  40           HB1      SER  40  94.462   4.279  -1.113
  326    H    LYS  41           HN       LYS  41  91.634   6.369  -0.981
  327    HA   LYS  41           HA       LYS  41  92.237   7.413   1.468
  328    HB2  LYS  41           HB2      LYS  41  89.663   7.711  -0.089
  329    HB3  LYS  41           HB1      LYS  41  90.033   8.684   1.335
  330    HG2  LYS  41           HG2      LYS  41  92.142   9.432   0.242
  331    HG3  LYS  41           HG1      LYS  41  91.689   8.524  -1.201
  332    HD2  LYS  41           HD2      LYS  41  89.753   9.896  -1.561
  333    HD3  LYS  41           HD1      LYS  41  89.927  10.663   0.018
  334    HE2  LYS  41           HE2      LYS  41  92.126  11.592  -0.725
  335    HE3  LYS  41           HE1      LYS  41  91.833  10.916  -2.327
  336    HZ1  LYS  41           HZ1      LYS  41  89.924  12.749  -0.998
  337    HZ2  LYS  41           HZ2      LYS  41  89.976  12.296  -2.635
  338    HZ3  LYS  41           HZ3      LYS  41  91.179  13.309  -1.993
  339    HA   PRO  42           HA       PRO  42  89.851   4.434   3.967
  340    HB2  PRO  42           HB2      PRO  42  91.575   4.240   6.032
  341    HB3  PRO  42           HB1      PRO  42  91.887   3.434   4.482
  342    HG2  PRO  42           HG2      PRO  42  93.082   5.911   5.591
  343    HG3  PRO  42           HG1      PRO  42  93.814   4.655   4.581
  344    HD2  PRO  42           HD2      PRO  42  92.846   7.139   3.670
  345    HD3  PRO  42           HD1      PRO  42  93.238   5.737   2.651
  346    HA   PRO  43           HA       PRO  43  87.925   7.298   6.761
  347    HB2  PRO  43           HB2      PRO  43  87.013   5.627   8.730
  348    HB3  PRO  43           HB1      PRO  43  86.284   5.711   7.114
  349    HG2  PRO  43           HG2      PRO  43  88.184   3.710   8.224
  350    HG3  PRO  43           HG1      PRO  43  86.792   3.475   7.155
  351    HD2  PRO  43           HD2      PRO  43  89.385   3.507   6.254
  352    HD3  PRO  43           HD1      PRO  43  87.999   3.985   5.250
  353    H    LYS  44           HN       LYS  44  88.032   8.145   9.045
  354    HA   LYS  44           HA       LYS  44  90.596   8.648   9.966
  355    HB2  LYS  44           HB2      LYS  44  88.149   8.317  11.729
  356    HB3  LYS  44           HB1      LYS  44  89.606   9.221  12.135
  357    HG2  LYS  44           HG2      LYS  44  88.558  11.018  11.238
  358    HG3  LYS  44           HG1      LYS  44  88.887  10.276   9.672
  359    HD2  LYS  44           HD2      LYS  44  86.570  10.597   9.583
  360    HD3  LYS  44           HD1      LYS  44  86.690   8.929  10.142
  361    HE2  LYS  44           HE2      LYS  44  86.608   9.868  12.519
  362    HE3  LYS  44           HE1      LYS  44  86.131  11.402  11.790
  363    HZ1  LYS  44           HZ1      LYS  44  84.620   9.260  10.710
  364    HZ2  LYS  44           HZ2      LYS  44  84.080  10.658  11.509
  365    HZ3  LYS  44           HZ3      LYS  44  84.492   9.272  12.401
  366    H    LYS  45           HN       LYS  45  88.783   6.795  12.327
  367    HA   LYS  45           HA       LYS  45  90.160   4.305  12.040
  368    HB2  LYS  45           HB2      LYS  45  91.637   4.621  14.124
  369    HB3  LYS  45           HB1      LYS  45  92.195   5.380  12.633
  370    HG2  LYS  45           HG2      LYS  45  91.226   7.524  13.339
  371    HG3  LYS  45           HG1      LYS  45  90.618   6.776  14.816
  372    HD2  LYS  45           HD2      LYS  45  93.538   6.540  14.188
  373    HD3  LYS  45           HD1      LYS  45  92.931   8.071  14.820
  374    HE2  LYS  45           HE2      LYS  45  92.534   5.357  16.115
  375    HE3  LYS  45           HE1      LYS  45  93.677   6.589  16.651
  376    HZ1  LYS  45           HZ1      LYS  45  91.279   7.894  16.440
  377    HZ2  LYS  45           HZ2      LYS  45  92.030   7.389  17.878
  378    HZ3  LYS  45           HZ3      LYS  45  90.873   6.397  17.127
  379    H    GLY  46           HN       GLY  46  87.558   4.689  12.527
  380    HA2  GLY  46           HA2      GLY  46  86.911   3.159  14.749
  381    HA3  GLY  46           HA1      GLY  46  86.905   4.816  15.355
  382    H    VAL  47           HN       VAL  47  84.696   2.772  14.776
  383    HA   VAL  47           HA       VAL  47  82.986   4.612  13.142
  384    HB   VAL  47           HB       VAL  47  81.781   2.620  12.320
  385   HG11  VAL  47          HG11      VAL  47  83.741   3.522  11.063
  386   HG12  VAL  47          HG12      VAL  47  83.524   1.789  10.824
  387   HG13  VAL  47          HG13      VAL  47  84.778   2.378  11.915
  388   HG21  VAL  47          HG21      VAL  47  82.018   0.997  14.008
  389   HG22  VAL  47          HG22      VAL  47  83.762   1.236  14.122
  390   HG23  VAL  47          HG23      VAL  47  83.075   0.392  12.734
  391    H    GLN  48           HN       GLN  48  81.344   5.412  14.349
  392    HA   GLN  48           HA       GLN  48  79.740   3.767  16.090
  393    HB2  GLN  48           HB2      GLN  48  81.965   4.227  17.385
  394    HB3  GLN  48           HB1      GLN  48  81.313   5.851  17.596
  395    HG2  GLN  48           HG2      GLN  48  79.261   4.893  18.592
  396    HG3  GLN  48           HG1      GLN  48  79.931   3.273  18.401
  397   HE21  GLN  48          HE21      GLN  48  82.498   5.332  19.075
  398   HE22  GLN  48          HE22      GLN  48  82.578   5.114  20.756
  399    H    GLY  49           HN       GLY  49  80.193   6.368  14.178
  400    HA2  GLY  49           HA2      GLY  49  77.589   7.433  14.528
  401    HA3  GLY  49           HA1      GLY  49  78.704   8.459  15.432
  402    H1U  RCY  50           H1U      RCY  50  77.536   7.031   3.830
  403    H1S  RCY  50           H1S      RCY  50  78.074   8.273   8.506
  404    HB1  RCY  50           HB1      RCY  50  78.623   8.551  10.635
  405    HB2  RCY  50           HB2      RCY  50  79.762   7.303  10.128
  406    HA   RCY  50           HA       RCY  50  81.589   8.428  11.250
  407    HN1  RCY  50           HN1      RCY  50  80.676   7.392  13.152
  408    H    GLY  51           HN       GLY  51  78.766  10.416  10.828
  409    HA2  GLY  51           HA2      GLY  51  79.379  12.650  12.425
  410    HA3  GLY  51           HA1      GLY  51  80.303  12.843  10.934
  411    H    ASP  52           HN       ASP  52  77.534  11.062  10.302
  412    HA   ASP  52           HA       ASP  52  75.595  11.593   9.090
  413    HB2  ASP  52           HB2      ASP  52  75.085  12.599  11.369
  414    HB3  ASP  52           HB1      ASP  52  75.623  14.148  10.717
  415    H    ASP  53           HN       ASP  53  78.188  12.435   8.007
  416    HA   ASP  53           HA       ASP  53  77.907  15.095   6.889
  417    HB2  ASP  53           HB2      ASP  53  79.619  12.806   5.878
  418    HB3  ASP  53           HB1      ASP  53  79.847  14.524   5.548
  419    H    ILE  54           HN       ILE  54  75.525  14.372   6.282
  420    HA   ILE  54           HA       ILE  54  75.573  13.849   3.374
  421    HB   ILE  54           HB       ILE  54  73.537  12.246   3.829
  422   HG12  ILE  54          HG12      ILE  54  75.145  11.859   6.368
  423   HG13  ILE  54          HG11      ILE  54  73.630  12.760   6.315
  424   HG21  ILE  54          HG21      ILE  54  75.065  10.336   3.813
  425   HG22  ILE  54          HG22      ILE  54  76.380  11.355   4.398
  426   HG23  ILE  54          HG23      ILE  54  75.712  11.617   2.787
  427   HD11  ILE  54          HD11      ILE  54  72.459  10.781   5.454
  428   HD12  ILE  54          HD12      ILE  54  73.264  10.398   6.976
  429   HD13  ILE  54          HD13      ILE  54  73.972   9.874   5.448
  430    HA   PRO  55           HA       PRO  55  72.530  17.093   4.297
  431    HB2  PRO  55           HB2      PRO  55  72.543  18.270   1.850
  432    HB3  PRO  55           HB1      PRO  55  73.842  18.520   3.033
  433    HG2  PRO  55           HG2      PRO  55  73.791  16.779   0.625
  434    HG3  PRO  55           HG1      PRO  55  75.119  17.734   1.303
  435    HD2  PRO  55           HD2      PRO  55  74.814  14.991   1.651
  436    HD3  PRO  55           HD1      PRO  55  75.773  16.044   2.714
  437    H    GLY  56           HN       GLY  56  72.174  14.293   2.642
  438    HA2  GLY  56           HA2      GLY  56  69.744  14.947   1.133
  439    HA3  GLY  56           HA1      GLY  56  70.428  13.334   1.347
  440    H    MET  57           HN       MET  57  70.399  12.719   3.869
  441    HA   MET  57           HA       MET  57  68.954  11.983   5.572
  442    HB2  MET  57           HB2      MET  57  68.100  14.883   5.323
  443    HB3  MET  57           HB1      MET  57  67.685  13.826   6.673
  444    HG2  MET  57           HG2      MET  57  70.537  14.371   5.818
  445    HG3  MET  57           HG1      MET  57  69.708  15.305   7.063
  446    HE1  MET  57           HE1      MET  57  68.318  14.134   8.907
  447    HE2  MET  57           HE2      MET  57  69.870  14.701   9.518
  448    HE3  MET  57           HE3      MET  57  69.258  13.125  10.013
  449    H    GLU  58           HN       GLU  58  67.849  10.648   3.864
  450    HA   GLU  58           HA       GLU  58  65.076  11.644   3.314
  451    HB2  GLU  58           HB2      GLU  58  66.627   9.502   1.828
  452    HB3  GLU  58           HB1      GLU  58  65.044  10.146   1.392
  453    HG2  GLU  58           HG2      GLU  58  67.617  11.747   1.516
  454    HG3  GLU  58           HG1      GLU  58  66.828  11.191   0.039
  455    H    GLY  59           HN       GLY  59  66.945   8.674   4.035
  456    HA2  GLY  59           HA2      GLY  59  65.558   7.731   6.201
  457    HA3  GLY  59           HA1      GLY  59  64.516   7.260   4.858
  458    H1U  RCY  60           H1U      RCY  60  73.843   4.768  -0.724
  459    H1S  RCY  60           H1S      RCY  60  70.373   7.420   0.943
  460    HB1  RCY  60           HB1      RCY  60  68.736   5.943   1.734
  461    HB2  RCY  60           HB2      RCY  60  69.938   4.842   2.406
  462    HA   RCY  60           HA       RCY  60  67.713   4.430   3.397
  463    HN1  RCY  60           HN1      RCY  60  67.543   7.286   3.591
  464    H    GLY  61           HN       GLY  61  67.516   3.933   5.750
  465    HA2  GLY  61           HA2      GLY  61  68.852   2.792   7.424
  466    HA3  GLY  61           HA1      GLY  61  70.214   3.832   6.999
  467    H    THR  62           HN       THR  62  70.454   5.782   8.075
  468    HA   THR  62           HA       THR  62  70.030   7.475   9.636
  469    HB   THR  62           HB       THR  62  67.533   6.960   8.373
  470    HG1  THR  62           HG1      THR  62  68.991   8.955   9.233
  471   HG21  THR  62          HG21      THR  62  66.827   5.926  10.511
  472   HG22  THR  62          HG22      THR  62  65.948   7.422  10.191
  473   HG23  THR  62          HG23      THR  62  67.268   7.407  11.361
  474    H    ASP  63           HN       ASP  63  68.438   4.360  10.215
  475    HA   ASP  63           HA       ASP  63  68.281   4.672  13.076
  476    HB2  ASP  63           HB2      ASP  63  68.116   2.107  12.997
  477    HB3  ASP  63           HB1      ASP  63  66.870   3.006  12.134
  478    H    ILE  64           HN       ILE  64  70.717   3.359  10.866
  479    HA   ILE  64           HA       ILE  64  72.686   3.498  13.081
  480    HB   ILE  64           HB       ILE  64  72.180   1.069  11.364
  481   HG12  ILE  64          HG12      ILE  64  72.505   0.177  13.885
  482   HG13  ILE  64          HG11      ILE  64  71.915   1.801  14.241
  483   HG21  ILE  64          HG21      ILE  64  74.258   0.235  12.705
  484   HG22  ILE  64          HG22      ILE  64  74.622   1.950  12.890
  485   HG23  ILE  64          HG23      ILE  64  74.522   1.239  11.279
  486   HD11  ILE  64          HD11      ILE  64  69.889   0.716  14.039
  487   HD12  ILE  64          HD12      ILE  64  70.520  -0.472  12.898
  488   HD13  ILE  64          HD13      ILE  64  70.138   1.160  12.350
  489    H    THR  65           HN       THR  65  72.007   3.363   9.638
  490    HA   THR  65           HA       THR  65  73.321   4.004   7.798
  491    HB   THR  65           HB       THR  65  74.540   5.956   9.759
  492    HG1  THR  65           HG1      THR  65  72.625   6.726  10.017
  493   HG21  THR  65          HG21      THR  65  75.490   5.975   7.508
  494   HG22  THR  65          HG22      THR  65  74.515   7.425   7.751
  495   HG23  THR  65          HG23      THR  65  73.876   6.081   6.804
  496    H    VAL  66           HN       VAL  66  75.647   4.677  10.402
  497    HA   VAL  66           HA       VAL  66  77.982   3.919   9.188
  498    HB   VAL  66           HB       VAL  66  77.585   2.913  11.979
  499   HG11  VAL  66          HG11      VAL  66  79.768   3.790  12.294
  500   HG12  VAL  66          HG12      VAL  66  79.636   4.842  10.884
  501   HG13  VAL  66          HG13      VAL  66  79.800   3.098  10.672
  502   HG21  VAL  66          HG21      VAL  66  76.293   4.807  12.329
  503   HG22  VAL  66          HG22      VAL  66  77.051   5.695  11.008
  504   HG23  VAL  66          HG23      VAL  66  77.902   5.498  12.540
  505    H    ILE  67           HN       ILE  67  76.619   1.512  11.464
  506    HA   ILE  67           HA       ILE  67  77.025  -0.561   9.341
  507    HB   ILE  67           HB       ILE  67  77.971  -0.695  12.221
  508   HG12  ILE  67          HG12      ILE  67  79.520  -0.877   9.619
  509   HG13  ILE  67          HG11      ILE  67  79.388   0.594  10.584
  510   HG21  ILE  67          HG21      ILE  67  78.855  -2.940  11.510
  511   HG22  ILE  67          HG22      ILE  67  77.932  -2.776  10.016
  512   HG23  ILE  67          HG23      ILE  67  77.094  -2.860  11.566
  513   HD11  ILE  67          HD11      ILE  67  81.474  -0.705  11.063
  514   HD12  ILE  67          HD12      ILE  67  80.469  -2.040  11.626
  515   HD13  ILE  67          HD13      ILE  67  80.448  -0.499  12.482
  516    H1U  RCY  68           H1U      RCY  68  75.957  -1.616   3.155
  517    H1S  RCY  68           H1S      RCY  68  73.275  -0.708   6.876
  518    HB1  RCY  68           HB1      RCY  68  72.480  -0.136   8.960
  519    HB2  RCY  68           HB2      RCY  68  71.245  -1.047   9.818
  520    HA   RCY  68           HA       RCY  68  72.970  -1.110  11.377
  521    HN1  RCY  68           HN1      RCY  68  74.710  -0.572   9.133
  522    HA   PRO  69           HA       PRO  69  73.378  -5.430  12.041
  523    HB2  PRO  69           HB2      PRO  69  70.670  -6.228  11.804
  524    HB3  PRO  69           HB1      PRO  69  71.503  -5.726  13.285
  525    HG2  PRO  69           HG2      PRO  69  69.705  -4.187  11.519
  526    HG3  PRO  69           HG1      PRO  69  69.978  -4.046  13.262
  527    HD2  PRO  69           HD2      PRO  69  70.966  -2.230  11.500
  528    HD3  PRO  69           HD1      PRO  69  71.826  -2.655  12.998
  529    H    TRP  70           HN       TRP  70  70.894  -4.947   9.465
  530    HA   TRP  70           HA       TRP  70  71.619  -7.427   8.166
  531    HD1  TRP  70           HD1      TRP  70  71.093  -4.083   5.413
  532    HE1  TRP  70           HE1      TRP  70  70.237  -1.716   5.964
  533    HE3  TRP  70           HE3      TRP  70  68.355  -5.089   9.604
  534    HZ2  TRP  70           HZ2      TRP  70  68.604  -0.417   7.926
  535    HZ3  TRP  70           HZ3      TRP  70  67.162  -3.274  10.792
  536    HH2  TRP  70           HH2      TRP  70  67.281  -0.942   9.961
  537    HB2  TRP  70           HB2      TRP  70  70.268  -6.499   6.240
  538    HB3  TRP  70           HB1      TRP  70  69.405  -6.581   7.773
  539    H    GLU  71           HN       GLU  71  73.953  -5.958   8.644
  540    HA   GLU  71           HA       GLU  71  74.902  -5.574   5.852
  541    HB2  GLU  71           HB2      GLU  71  75.614  -3.410   6.162
  542    HB3  GLU  71           HB1      GLU  71  74.340  -3.398   7.364
  543    HG2  GLU  71           HG2      GLU  71  76.165  -2.612   8.602
  544    HG3  GLU  71           HG1      GLU  71  76.193  -4.337   8.967
  545    H    ALA  72           HN       ALA  72  75.242  -6.983   8.856
  546    HA   ALA  72           HA       ALA  72  78.107  -7.061   9.124
  547    HB1  ALA  72           HB1      ALA  72  76.717  -7.597  11.031
  548    HB2  ALA  72           HB2      ALA  72  77.635  -9.041  10.605
  549    HB3  ALA  72           HB3      ALA  72  75.936  -8.909  10.149
  550    H1U  RCY  73           H1U      RCY  73  70.958  -6.620   4.105
  551    H1S  RCY  73           H1S      RCY  73  75.115  -8.247   2.849
  552    HB1  RCY  73           HB1      RCY  73  77.249  -9.759   3.684
  553    HB2  RCY  73           HB2      RCY  73  78.644  -8.688   3.786
  554    HA   RCY  73           HA       RCY  73  77.458 -10.421   5.847
  555    HN1  RCY  73           HN1      RCY  73  77.402  -7.591   6.405
  556    H    ASN  74           HN       ASN  74  79.661  -8.792   7.487
  557    HA   ASN  74           HA       ASN  74  81.943  -9.091   7.917
  558    HB2  ASN  74           HB2      ASN  74  81.098 -11.517   7.841
  559    HB3  ASN  74           HB1      ASN  74  81.758 -11.576   6.207
  560   HD21  ASN  74          HD21      ASN  74  82.749 -10.745   9.573
  561   HD22  ASN  74          HD22      ASN  74  84.360 -11.244   9.377
  562    H    HIS  75           HN       HIS  75  84.031 -10.028   6.376
  563    HA   HIS  75           HA       HIS  75  85.463  -9.316   4.663
  564    HD1  HIS  75           HD1      HIS  75  81.496 -11.008   3.038
  565    HD2  HIS  75           HD2      HIS  75  85.470 -11.977   3.857
  566    HE1  HIS  75           HE1      HIS  75  81.564 -13.516   3.384
  567    HE2  HIS  75           HE2      HIS  75  83.978 -14.119   3.883
  568    HB2  HIS  75           HB2      HIS  75  82.939  -8.987   3.025
  569    HB3  HIS  75           HB1      HIS  75  84.564  -9.351   2.444
  570    H1U  RCY  76           H1U      RCY  76  79.612  -3.791   1.882
  571    H1S  RCY  76           H1S      RCY  76  82.013  -5.021   4.969
  572    HB1  RCY  76           HB1      RCY  76  84.426  -4.311   7.538
  573    HB2  RCY  76           HB2      RCY  76  83.355  -5.708   7.634
  574    HA   RCY  76           HA       RCY  76  83.446  -4.952   4.899
  575    HN1  RCY  76           HN1      RCY  76  83.918  -7.322   6.433
  576    H    GLU  77           HN       GLU  77  86.320  -6.600   5.580
  577    HA   GLU  77           HA       GLU  77  88.181  -4.468   5.907
  578    HB2  GLU  77           HB2      GLU  77  89.782  -6.163   4.758
  579    HB3  GLU  77           HB1      GLU  77  89.043  -6.631   6.289
  580    HG2  GLU  77           HG2      GLU  77  87.444  -8.022   5.220
  581    HG3  GLU  77           HG1      GLU  77  87.762  -7.307   3.639
  582    H    LEU  78           HN       LEU  78  87.255  -2.848   4.406
  583    HA   LEU  78           HA       LEU  78  87.094  -3.240   1.586
  584    HG   LEU  78           HG       LEU  78  87.715  -1.070   0.347
  585    HB2  LEU  78           HB2      LEU  78  86.173  -1.272   2.909
  586    HB3  LEU  78           HB1      LEU  78  87.820  -0.644   2.969
  587   HD11  LEU  78          HD11      LEU  78  85.386  -2.072   0.615
  588   HD12  LEU  78          HD12      LEU  78  85.527  -0.794  -0.592
  589   HD13  LEU  78          HD13      LEU  78  84.823  -0.442   0.987
  590   HD21  LEU  78          HD21      LEU  78  86.445   1.250   1.831
  591   HD22  LEU  78          HD22      LEU  78  86.842   1.288   0.113
  592   HD23  LEU  78          HD23      LEU  78  88.124   1.113   1.312
  593    H    HIS  79           HN       HIS  79  88.755  -3.777   0.264
  594    HA   HIS  79           HA       HIS  79  91.313  -2.328   0.481
  595    HD1  HIS  79           HD1      HIS  79  90.709  -5.532   3.328
  596    HD2  HIS  79           HD2      HIS  79  93.223  -2.328   2.426
  597    HE1  HIS  79           HE1      HIS  79  91.433  -4.545   5.545
  598    HE2  HIS  79           HE2      HIS  79  92.964  -2.594   5.010
  599    HB2  HIS  79           HB2      HIS  79  91.067  -5.321   0.873
  600    HB3  HIS  79           HB1      HIS  79  92.581  -4.536   0.423
  601    H    GLU  80           HN       GLU  80  91.620  -5.315  -1.069
  602    HA   GLU  80           HA       GLU  80  91.326  -3.995  -3.720
  603    HB2  GLU  80           HB2      GLU  80  93.468  -5.150  -3.190
  604    HB3  GLU  80           HB1      GLU  80  92.580  -6.662  -2.994
  605    HG2  GLU  80           HG2      GLU  80  91.828  -6.560  -5.320
  606    HG3  GLU  80           HG1      GLU  80  92.628  -5.002  -5.531
  607    H    LEU  81           HN       LEU  81  90.009  -6.556  -1.731
  608    HA   LEU  81           HA       LEU  81  88.628  -8.040  -3.722
  609    HG   LEU  81           HG       LEU  81  88.750  -9.819  -0.538
  610    HB2  LEU  81           HB2      LEU  81  88.056  -7.502  -0.803
  611    HB3  LEU  81           HB1      LEU  81  86.997  -8.518  -1.777
  612   HD11  LEU  81          HD11      LEU  81  89.458 -10.088  -3.424
  613   HD12  LEU  81          HD12      LEU  81  87.759 -10.269  -2.988
  614   HD13  LEU  81          HD13      LEU  81  88.972 -11.327  -2.267
  615   HD21  LEU  81          HD21      LEU  81  90.706  -8.595  -2.490
  616   HD22  LEU  81          HD22      LEU  81  91.054  -9.582  -1.071
  617   HD23  LEU  81          HD23      LEU  81  90.471  -7.929  -0.874
  618    H    ALA  82           HN       ALA  82  87.826  -5.019  -2.081
  619    HA   ALA  82           HA       ALA  82  85.106  -4.861  -2.999
  620    HB1  ALA  82           HB1      ALA  82  85.235  -2.507  -2.371
  621    HB2  ALA  82           HB2      ALA  82  86.997  -2.582  -2.337
  622    HB3  ALA  82           HB3      ALA  82  86.053  -3.476  -1.145
  623    H    GLN  83           HN       GLN  83  87.993  -4.761  -4.717
  624    HA   GLN  83           HA       GLN  83  87.265  -2.755  -6.693
  625    HB2  GLN  83           HB2      GLN  83  89.627  -3.660  -6.144
  626    HB3  GLN  83           HB1      GLN  83  89.191  -5.035  -7.158
  627    HG2  GLN  83           HG2      GLN  83  90.235  -3.543  -8.660
  628    HG3  GLN  83           HG1      GLN  83  88.513  -3.263  -8.920
  629   HE21  GLN  83          HE21      GLN  83  90.735  -2.096  -6.325
  630   HE22  GLN  83          HE22      GLN  83  90.396  -0.452  -6.574
  631    H    TYR  84           HN       TYR  84  86.889  -6.257  -6.383
  632    HA   TYR  84           HA       TYR  84  85.960  -6.692  -9.079
  633    HD1  TYR  84           HD1      TYR  84  87.180  -8.590  -9.881
  634    HD2  TYR  84           HD2      TYR  84  87.525  -8.839  -5.607
  635    HE1  TYR  84           HE1      TYR  84  89.538  -9.319 -10.114
  636    HE2  TYR  84           HE2      TYR  84  89.884  -9.569  -5.840
  637    HH   TYR  84           HH       TYR  84  91.484 -10.184  -7.259
  638    HB2  TYR  84           HB2      TYR  84  85.464  -8.297  -6.551
  639    HB3  TYR  84           HB1      TYR  84  85.131  -8.856  -8.190
  640    H    GLY  85           HN       GLY  85  83.622  -8.067  -7.152
  641    HA2  GLY  85           HA2      GLY  85  81.787  -5.747  -7.210
  642    HA3  GLY  85           HA1      GLY  85  81.348  -7.129  -8.215
  643    H    ILE  86           HN       ILE  86  83.012  -8.318  -5.594
  644    HA   ILE  86           HA       ILE  86  80.665  -9.531  -4.449
  645    HB   ILE  86           HB       ILE  86  83.429  -9.253  -3.228
  646   HG12  ILE  86          HG12      ILE  86  82.279 -11.521  -4.882
  647   HG13  ILE  86          HG11      ILE  86  83.371 -10.293  -5.523
  648   HG21  ILE  86          HG21      ILE  86  81.004 -10.940  -2.627
  649   HG22  ILE  86          HG22      ILE  86  81.994  -9.996  -1.514
  650   HG23  ILE  86          HG23      ILE  86  82.619 -11.499  -2.192
  651   HD11  ILE  86          HD11      ILE  86  84.008 -12.108  -3.178
  652   HD12  ILE  86          HD12      ILE  86  85.102 -10.946  -3.930
  653   HD13  ILE  86          HD13      ILE  86  84.571 -12.367  -4.829
  654    H1U  RCY  87           H1U      RCY  87  75.185  -4.715   2.087
  655    H1S  RCY  87           H1S      RCY  87  76.115  -5.098  -2.230
  656    HB1  RCY  87           HB1      RCY  87  77.662  -6.609  -0.469
  657    HB2  RCY  87           HB2      RCY  87  77.932  -8.313  -0.833
  658    HA   RCY  87           HA       RCY  87  79.478  -5.994  -2.040
  659    HN1  RCY  87           HN1      RCY  87  79.274  -8.667  -2.977
  Start of MODEL   41
    1    HA   MET   1           HA       MET   1  61.084 -14.225   2.740
    2    HB2  MET   1           HB2      MET   1  62.798 -12.061   3.956
    3    HB3  MET   1           HB1      MET   1  61.752 -13.227   4.767
    4    HG2  MET   1           HG2      MET   1  64.409 -13.759   3.420
    5    HG3  MET   1           HG1      MET   1  64.001 -13.980   5.121
    6    HE1  MET   1           HE1      MET   1  64.624 -15.929   1.933
    7    HE2  MET   1           HE2      MET   1  64.639 -17.368   2.951
    8    HE3  MET   1           HE3      MET   1  65.462 -15.906   3.490
    9    H    ASN   2           HN       ASN   2  59.197 -13.153   2.460
   10    HA   ASN   2           HA       ASN   2  57.684 -11.495   1.812
   11    HB2  ASN   2           HB2      ASN   2  57.919  -9.463   2.903
   12    HB3  ASN   2           HB1      ASN   2  59.054 -10.443   3.829
   13   HD21  ASN   2          HD21      ASN   2  61.171  -9.653   3.940
   14   HD22  ASN   2          HD22      ASN   2  61.821  -8.476   2.905
   15    H    LEU   3           HN       LEU   3  57.255 -10.990  -0.263
   16    HA   LEU   3           HA       LEU   3  59.314  -9.546  -1.857
   17    HG   LEU   3           HG       LEU   3  60.561 -11.602  -1.686
   18    HB2  LEU   3           HB2      LEU   3  58.112 -12.233  -2.452
   19    HB3  LEU   3           HB1      LEU   3  58.475 -11.154  -3.798
   20   HD11  LEU   3          HD11      LEU   3  59.902 -13.867  -2.251
   21   HD12  LEU   3          HD12      LEU   3  61.416 -13.512  -3.083
   22   HD13  LEU   3          HD13      LEU   3  59.892 -13.480  -3.971
   23   HD21  LEU   3          HD21      LEU   3  62.041 -11.249  -3.654
   24   HD22  LEU   3          HD22      LEU   3  60.925  -9.904  -3.423
   25   HD23  LEU   3          HD23      LEU   3  60.614 -11.101  -4.680
   26    H    GLU   4           HN       GLU   4  56.357  -9.410  -0.632
   27    HA   GLU   4           HA       GLU   4  54.795  -8.735  -3.004
   28    HB2  GLU   4           HB2      GLU   4  54.337  -8.556  -0.030
   29    HB3  GLU   4           HB1      GLU   4  53.217  -7.787  -1.154
   30    HG2  GLU   4           HG2      GLU   4  52.917  -9.960  -2.316
   31    HG3  GLU   4           HG1      GLU   4  53.992 -10.720  -1.141
   32    HA   PRO   5           HA       PRO   5  55.838  -4.538  -3.849
   33    HB2  PRO   5           HB2      PRO   5  53.020  -3.915  -3.026
   34    HB3  PRO   5           HB1      PRO   5  53.918  -3.371  -4.456
   35    HG2  PRO   5           HG2      PRO   5  52.121  -5.359  -4.563
   36    HG3  PRO   5           HG1      PRO   5  53.562  -5.324  -5.590
   37    HD2  PRO   5           HD2      PRO   5  52.937  -7.122  -3.339
   38    HD3  PRO   5           HD1      PRO   5  54.146  -7.312  -4.626
   39    HA   PRO   6           HA       PRO   6  56.532  -3.206   0.431
   40    HB2  PRO   6           HB2      PRO   6  58.525  -1.431  -0.061
   41    HB3  PRO   6           HB1      PRO   6  58.786  -3.186  -0.112
   42    HG2  PRO   6           HG2      PRO   6  58.422  -1.270  -2.357
   43    HG3  PRO   6           HG1      PRO   6  59.496  -2.672  -2.231
   44    HD2  PRO   6           HD2      PRO   6  57.076  -2.685  -3.583
   45    HD3  PRO   6           HD1      PRO   6  57.871  -4.139  -2.940
   46    H    LYS   7           HN       LYS   7  55.810  -1.435   1.656
   47    HA   LYS   7           HA       LYS   7  55.164   1.101   0.266
   48    HB2  LYS   7           HB2      LYS   7  53.160  -0.526   0.200
   49    HB3  LYS   7           HB1      LYS   7  53.056  -0.270   1.942
   50    HG2  LYS   7           HG2      LYS   7  53.068   2.247   1.401
   51    HG3  LYS   7           HG1      LYS   7  52.742   1.768  -0.266
   52    HD2  LYS   7           HD2      LYS   7  51.059   1.023   2.145
   53    HD3  LYS   7           HD1      LYS   7  50.638   2.232   0.931
   54    HE2  LYS   7           HE2      LYS   7  50.897   0.346  -0.797
   55    HE3  LYS   7           HE1      LYS   7  50.880  -0.758   0.578
   56    HZ1  LYS   7           HZ1      LYS   7  48.720   0.684  -0.628
   57    HZ2  LYS   7           HZ2      LYS   7  48.786   0.909   1.054
   58    HZ3  LYS   7           HZ3      LYS   7  48.678  -0.659   0.408
   59    H    ALA   8           HN       ALA   8  55.990  -0.693   3.068
   60    HA   ALA   8           HA       ALA   8  55.340   1.225   5.097
   61    HB1  ALA   8           HB1      ALA   8  57.654  -0.737   5.072
   62    HB2  ALA   8           HB2      ALA   8  56.003  -1.150   5.537
   63    HB3  ALA   8           HB3      ALA   8  56.924   0.011   6.494
   64    H    GLU   9           HN       GLU   9  57.333   1.598   2.484
   65    HA   GLU   9           HA       GLU   9  59.335   3.270   3.918
   66    HB2  GLU   9           HB2      GLU   9  60.525   3.332   1.783
   67    HB3  GLU   9           HB1      GLU   9  60.127   1.661   2.186
   68    HG2  GLU   9           HG2      GLU   9  58.043   1.921   0.767
   69    HG3  GLU   9           HG1      GLU   9  58.696   3.466   0.222
   70    H1U  RCY  10           H1U      RCY  10  54.268   4.488  -4.581
   71    H1S  RCY  10           H1S      RCY  10  52.517   5.789  -0.316
   72    HB1  RCY  10           HB1      RCY  10  54.194   4.897   2.345
   73    HB2  RCY  10           HB2      RCY  10  54.760   4.728   0.683
   74    HA   RCY  10           HA       RCY  10  56.699   6.147   1.174
   75    HN1  RCY  10           HN1      RCY  10  56.309   3.636   2.584
   76    H    ARG  11           HN       ARG  11  55.886   5.218   4.486
   77    HA   ARG  11           HA       ARG  11  55.090   7.786   5.433
   78    HE   ARG  11           HE       ARG  11  53.377   7.528   5.121
   79    HB2  ARG  11           HB2      ARG  11  56.163   5.288   6.682
   80    HB3  ARG  11           HB1      ARG  11  56.193   6.760   7.653
   81    HG2  ARG  11           HG2      ARG  11  54.086   5.449   7.950
   82    HG3  ARG  11           HG1      ARG  11  53.797   7.074   7.329
   83    HD2  ARG  11           HD2      ARG  11  54.229   4.915   5.320
   84    HD3  ARG  11           HD1      ARG  11  52.698   4.901   6.196
   85   HH11  ARG  11          HH21      ARG  11  51.974   4.431   4.551
   86   HH12  ARG  11          HH22      ARG  11  50.935   4.987   3.282
   87   HH21  ARG  11          HH11      ARG  11  52.029   8.273   3.467
   88   HH22  ARG  11          HH12      ARG  11  50.966   7.163   2.668
   89    H    SER  12           HN       SER  12  56.272   9.621   5.584
   90    HA   SER  12           HA       SER  12  58.970   9.870   4.825
   91    HG   SER  12           HG       SER  12  56.337  12.283   5.297
   92    HB2  SER  12           HB2      SER  12  57.577  11.646   6.844
   93    HB3  SER  12           HB1      SER  12  58.901  12.087   5.769
   94    H    ALA  13           HN       ALA  13  57.702   9.904   8.181
   95    HA   ALA  13           HA       ALA  13  60.078   8.400   9.068
   96    HB1  ALA  13           HB1      ALA  13  61.009  10.582   9.266
   97    HB2  ALA  13           HB2      ALA  13  60.469  10.167  10.892
   98    HB3  ALA  13           HB3      ALA  13  59.503  11.252   9.892
   99    H    THR  14           HN       THR  14  59.300   6.903  10.464
  100    HA   THR  14           HA       THR  14  56.627   7.184  11.605
  101    HB   THR  14           HB       THR  14  58.694   5.070  12.264
  102    HG1  THR  14           HG1      THR  14  58.429   5.169  10.032
  103   HG21  THR  14          HG21      THR  14  56.802   3.729  12.861
  104   HG22  THR  14          HG22      THR  14  55.676   4.892  12.161
  105   HG23  THR  14          HG23      THR  14  56.561   5.296  13.631
  106    H    ARG  15           HN       ARG  15  59.847   6.657  13.100
  107    HA   ARG  15           HA       ARG  15  59.481   8.742  15.048
  108    HE   ARG  15           HE       ARG  15  59.222   5.255  18.533
  109    HB2  ARG  15           HB2      ARG  15  59.214   7.292  17.052
  110    HB3  ARG  15           HB1      ARG  15  57.817   7.201  15.980
  111    HG2  ARG  15           HG2      ARG  15  58.932   5.161  14.920
  112    HG3  ARG  15           HG1      ARG  15  60.053   5.187  16.283
  113    HD2  ARG  15           HD2      ARG  15  57.039   5.095  16.585
  114    HD3  ARG  15           HD1      ARG  15  58.073   3.667  16.622
  115   HH11  ARG  15          HH21      ARG  15  55.988   4.295  17.821
  116   HH12  ARG  15          HH22      ARG  15  55.467   4.351  19.472
  117   HH21  ARG  15          HH11      ARG  15  58.560   5.333  20.693
  118   HH22  ARG  15          HH12      ARG  15  56.923   4.939  21.097
  119    H    VAL  16           HN       VAL  16  61.397   7.006  13.245
  120    HA   VAL  16           HA       VAL  16  63.580   6.687  15.266
  121    HB   VAL  16           HB       VAL  16  63.339   5.569  12.456
  122   HG11  VAL  16          HG11      VAL  16  65.658   5.854  12.937
  123   HG12  VAL  16          HG12      VAL  16  65.307   4.164  13.302
  124   HG13  VAL  16          HG13      VAL  16  65.449   5.338  14.611
  125   HG21  VAL  16          HG21      VAL  16  62.964   4.364  15.210
  126   HG22  VAL  16          HG22      VAL  16  63.204   3.388  13.761
  127   HG23  VAL  16          HG23      VAL  16  61.789   4.431  13.897
  128    H    MET  17           HN       MET  17  63.716   7.274  11.755
  129    HA   MET  17           HA       MET  17  65.705   9.412  12.264
  130    HB2  MET  17           HB2      MET  17  66.223   9.249   9.908
  131    HB3  MET  17           HB1      MET  17  66.109   7.608  10.545
  132    HG2  MET  17           HG2      MET  17  64.800   7.424   8.628
  133    HG3  MET  17           HG1      MET  17  63.576   7.833   9.829
  134    HE1  MET  17           HE1      MET  17  62.709   9.586   6.384
  135    HE2  MET  17           HE2      MET  17  62.590   8.094   7.313
  136    HE3  MET  17           HE3      MET  17  64.028   8.410   6.346
  137    H    GLY  18           HN       GLY  18  65.402  11.558  11.540
  138    HA2  GLY  18           HA2      GLY  18  63.661  12.801   9.923
  139    HA3  GLY  18           HA1      GLY  18  62.565  12.345  11.229
  140    H    GLY  19           HN       GLY  19  62.989  15.039  10.652
  141    HA2  GLY  19           HA2      GLY  19  63.287  16.978  11.979
  142    HA3  GLY  19           HA1      GLY  19  64.017  15.970  13.229
  143    HA   PRO  20           HA       PRO  20  67.314  18.726  11.326
  144    HB2  PRO  20           HB2      PRO  20  68.335  18.119  14.077
  145    HB3  PRO  20           HB1      PRO  20  68.358  19.649  13.178
  146    HG2  PRO  20           HG2      PRO  20  66.616  19.221  15.142
  147    HG3  PRO  20           HG1      PRO  20  66.170  20.137  13.692
  148    HD2  PRO  20           HD2      PRO  20  65.387  17.368  14.481
  149    HD3  PRO  20           HD1      PRO  20  64.501  18.557  13.502
  150    H1U  RCY  21           H1U      RCY  21  66.830   8.949   6.476
  151    H1S  RCY  21           H1S      RCY  21  68.089  12.944   7.316
  152    HB1  RCY  21           HB1      RCY  21  68.687  15.117   8.198
  153    HB2  RCY  21           HB2      RCY  21  67.742  14.239   9.401
  154    HA   RCY  21           HA       RCY  21  69.556  14.773  11.081
  155    HN1  RCY  21           HN1      RCY  21  67.829  16.881   9.915
  156    H    THR  22           HN       THR  22  71.528  15.804  11.498
  157    HA   THR  22           HA       THR  22  72.826  17.242   9.232
  158    HB   THR  22           HB       THR  22  73.748  17.101  12.110
  159    HG1  THR  22           HG1      THR  22  71.617  18.027  11.795
  160   HG21  THR  22          HG21      THR  22  74.989  19.134  11.485
  161   HG22  THR  22          HG22      THR  22  74.338  19.033   9.849
  162   HG23  THR  22          HG23      THR  22  75.434  17.784  10.441
  163    HA   PRO  23           HA       PRO  23  75.251  13.616   8.225
  164    HB2  PRO  23           HB2      PRO  23  77.393  15.695   7.916
  165    HB3  PRO  23           HB1      PRO  23  76.945  14.370   6.823
  166    HG2  PRO  23           HG2      PRO  23  76.197  16.896   6.364
  167    HG3  PRO  23           HG1      PRO  23  75.166  15.520   5.943
  168    HD2  PRO  23           HD2      PRO  23  74.814  17.523   8.098
  169    HD3  PRO  23           HD1      PRO  23  73.604  16.483   7.317
  170    H    ARG  24           HN       ARG  24  76.750  12.295   9.321
  171    HA   ARG  24           HA       ARG  24  77.571  13.253  11.995
  172    HE   ARG  24           HE       ARG  24  80.303  10.742  10.615
  173    HB2  ARG  24           HB2      ARG  24  78.242  10.865  12.331
  174    HB3  ARG  24           HB1      ARG  24  76.547  11.050  11.885
  175    HG2  ARG  24           HG2      ARG  24  76.852   9.787  10.045
  176    HG3  ARG  24           HG1      ARG  24  78.145  10.853   9.495
  177    HD2  ARG  24           HD2      ARG  24  78.504   8.641  11.537
  178    HD3  ARG  24           HD1      ARG  24  78.908   8.495   9.827
  179   HH11  ARG  24          HH21      ARG  24  79.974   7.506  11.758
  180   HH12  ARG  24          HH22      ARG  24  81.578   7.431  12.406
  181   HH21  ARG  24          HH11      ARG  24  82.400  10.662  11.454
  182   HH22  ARG  24          HH12      ARG  24  82.952   9.218  12.234
  183    H    LYS  25           HN       LYS  25  79.751  13.354  12.658
  184    HA   LYS  25           HA       LYS  25  81.970  12.473  11.093
  185    HB2  LYS  25           HB2      LYS  25  80.850  14.631   9.894
  186    HB3  LYS  25           HB1      LYS  25  81.923  15.456  11.021
  187    HG2  LYS  25           HG2      LYS  25  83.265  15.137   9.105
  188    HG3  LYS  25           HG1      LYS  25  83.744  13.819  10.174
  189    HD2  LYS  25           HD2      LYS  25  83.386  12.644   8.207
  190    HD3  LYS  25           HD1      LYS  25  81.782  12.539   8.932
  191    HE2  LYS  25           HE2      LYS  25  81.355  14.793   7.660
  192    HE3  LYS  25           HE1      LYS  25  82.723  14.281   6.671
  193    HZ1  LYS  25           HZ1      LYS  25  80.694  12.269   7.197
  194    HZ2  LYS  25           HZ2      LYS  25  81.565  12.591   5.775
  195    HZ3  LYS  25           HZ3      LYS  25  80.222  13.547   6.187
  196    H    GLY  26           HN       GLY  26  82.288  11.811  13.374
  197    HA2  GLY  26           HA2      GLY  26  83.874  13.852  14.814
  198    HA3  GLY  26           HA1      GLY  26  82.516  13.144  15.691
  199    HA   PRO  27           HA       PRO  27  84.987   9.868  17.326
  200    HB2  PRO  27           HB2      PRO  27  82.884   8.103  16.113
  201    HB3  PRO  27           HB1      PRO  27  83.582   8.060  17.744
  202    HG2  PRO  27           HG2      PRO  27  81.176   9.133  17.245
  203    HG3  PRO  27           HG1      PRO  27  82.251   9.757  18.505
  204    HD2  PRO  27           HD2      PRO  27  81.493  10.992  15.933
  205    HD3  PRO  27           HD1      PRO  27  82.191  11.748  17.382
  206    HA   PRO  28           HA       PRO  28  87.596   8.904  13.794
  207    HB2  PRO  28           HB2      PRO  28  88.155   6.459  15.440
  208    HB3  PRO  28           HB1      PRO  28  89.292   7.548  14.622
  209    HG2  PRO  28           HG2      PRO  28  88.862   7.665  17.262
  210    HG3  PRO  28           HG1      PRO  28  89.213   9.108  16.298
  211    HD2  PRO  28           HD2      PRO  28  86.667   8.291  17.569
  212    HD3  PRO  28           HD1      PRO  28  87.201   9.905  17.051
  213    H    LYS  29           HN       LYS  29  86.929   7.970  11.922
  214    HA   LYS  29           HA       LYS  29  86.209   5.256  11.567
  215    HB2  LYS  29           HB2      LYS  29  84.165   6.177  12.922
  216    HB3  LYS  29           HB1      LYS  29  83.734   6.982  11.417
  217    HG2  LYS  29           HG2      LYS  29  82.603   4.956  11.194
  218    HG3  LYS  29           HG1      LYS  29  84.119   4.600  10.366
  219    HD2  LYS  29           HD2      LYS  29  84.853   3.930  12.860
  220    HD3  LYS  29           HD1      LYS  29  83.122   3.622  12.999
  221    HE2  LYS  29           HE2      LYS  29  85.071   2.393  11.039
  222    HE3  LYS  29           HE1      LYS  29  84.085   1.569  12.247
  223    HZ1  LYS  29           HZ1      LYS  29  82.506   1.363  10.732
  224    HZ2  LYS  29           HZ2      LYS  29  83.422   2.232   9.596
  225    HZ3  LYS  29           HZ3      LYS  29  82.364   3.051  10.643
  226    H1U  RCY  30           H1U      RCY  30  82.505   6.321   2.893
  227    H1S  RCY  30           H1S      RCY  30  84.491   7.936   6.022
  228    HB1  RCY  30           HB1      RCY  30  85.729  10.568   8.741
  229    HB2  RCY  30           HB2      RCY  30  84.308   9.533   8.739
  230    HA   RCY  30           HA       RCY  30  85.850   7.735   7.706
  231    HN1  RCY  30           HN1      RCY  30  86.119   8.577  10.558
  232    H    LYS  31           HN       LYS  31  87.156   9.516   6.292
  233    HA   LYS  31           HA       LYS  31  89.339   9.998   5.551
  234    HB2  LYS  31           HB2      LYS  31  89.558  10.908   8.437
  235    HB3  LYS  31           HB1      LYS  31  90.615  11.407   7.117
  236    HG2  LYS  31           HG2      LYS  31  88.898  12.615   6.038
  237    HG3  LYS  31           HG1      LYS  31  87.629  11.790   6.944
  238    HD2  LYS  31           HD2      LYS  31  88.218  12.939   8.972
  239    HD3  LYS  31           HD1      LYS  31  89.688  13.589   8.245
  240    HE2  LYS  31           HE2      LYS  31  87.544  15.103   8.403
  241    HE3  LYS  31           HE1      LYS  31  88.519  15.127   6.934
  242    HZ1  LYS  31           HZ1      LYS  31  86.372  13.148   7.138
  243    HZ2  LYS  31           HZ2      LYS  31  86.975  13.957   5.771
  244    HZ3  LYS  31           HZ3      LYS  31  85.938  14.763   6.849
  245    H    GLN  32           HN       GLN  32  88.780   7.386   7.243
  246    HA   GLN  32           HA       GLN  32  91.268   6.739   8.508
  247    HB2  GLN  32           HB2      GLN  32  89.295   5.428   9.016
  248    HB3  GLN  32           HB1      GLN  32  89.109   4.975   7.322
  249    HG2  GLN  32           HG2      GLN  32  90.176   3.187   8.744
  250    HG3  GLN  32           HG1      GLN  32  91.162   3.693   7.372
  251   HE21  GLN  32          HE21      GLN  32  93.311   3.796   8.034
  252   HE22  GLN  32          HE22      GLN  32  93.845   4.438   9.512
  253    H    ARG  33           HN       ARG  33  90.109   6.469   5.211
  254    HA   ARG  33           HA       ARG  33  91.192   5.758   3.244
  255    HE   ARG  33           HE       ARG  33  95.413   8.641   4.078
  256    HB2  ARG  33           HB2      ARG  33  92.401   7.881   3.867
  257    HB3  ARG  33           HB1      ARG  33  93.627   6.885   4.652
  258    HG2  ARG  33           HG2      ARG  33  94.060   5.726   2.521
  259    HG3  ARG  33           HG1      ARG  33  92.829   6.711   1.731
  260    HD2  ARG  33           HD2      ARG  33  95.183   7.549   1.394
  261    HD3  ARG  33           HD1      ARG  33  94.096   8.731   2.123
  262   HH11  ARG  33          HH21      ARG  33  95.940   5.918   2.031
  263   HH12  ARG  33          HH22      ARG  33  97.248   5.291   2.977
  264   HH21  ARG  33          HH11      ARG  33  97.118   7.839   5.326
  265   HH22  ARG  33          HH12      ARG  33  97.916   6.379   4.843
  266    H    GLN  34           HN       GLN  34  91.183   3.527   3.238
  267    HA   GLN  34           HA       GLN  34  93.634   2.199   4.317
  268    HB2  GLN  34           HB2      GLN  34  91.878   0.203   4.651
  269    HB3  GLN  34           HB1      GLN  34  92.162   1.402   5.911
  270    HG2  GLN  34           HG2      GLN  34  89.735   1.052   5.471
  271    HG3  GLN  34           HG1      GLN  34  90.242   2.711   5.150
  272   HE21  GLN  34          HE21      GLN  34  88.689  -0.016   3.767
  273   HE22  GLN  34          HE22      GLN  34  88.675   0.520   2.157
  274    H    THR  35           HN       THR  35  93.192  -0.348   3.400
  275    HA   THR  35           HA       THR  35  93.992  -0.327   0.742
  276    HB   THR  35           HB       THR  35  93.369  -2.654   0.628
  277    HG1  THR  35           HG1      THR  35  91.799  -2.278   2.944
  278   HG21  THR  35          HG21      THR  35  95.129  -1.919   2.314
  279   HG22  THR  35          HG22      THR  35  94.393  -3.492   2.621
  280   HG23  THR  35          HG23      THR  35  93.884  -2.084   3.553
  281    H    ARG  36           HN       ARG  36  92.821   1.190  -0.509
  282    HA   ARG  36           HA       ARG  36  90.066   1.537  -0.714
  283    HE   ARG  36           HE       ARG  36  92.388   6.253  -2.182
  284    HB2  ARG  36           HB2      ARG  36  91.976   1.490  -3.070
  285    HB3  ARG  36           HB1      ARG  36  90.444   2.359  -2.972
  286    HG2  ARG  36           HG2      ARG  36  91.356   3.676  -1.059
  287    HG3  ARG  36           HG1      ARG  36  92.907   2.865  -1.278
  288    HD2  ARG  36           HD2      ARG  36  93.132   3.776  -3.517
  289    HD3  ARG  36           HD1      ARG  36  91.509   4.462  -3.442
  290   HH11  ARG  36          HH21      ARG  36  94.511   3.538  -2.247
  291   HH12  ARG  36          HH22      ARG  36  95.810   4.365  -1.455
  292   HH21  ARG  36          HH11      ARG  36  94.072   7.350  -1.147
  293   HH22  ARG  36          HH12      ARG  36  95.561   6.524  -0.831
  294    H    GLN  37           HN       GLN  37  91.927  -1.226  -1.626
  295    HA   GLN  37           HA       GLN  37  89.936  -2.306  -3.475
  296    HB2  GLN  37           HB2      GLN  37  92.203  -3.748  -2.067
  297    HB3  GLN  37           HB1      GLN  37  91.334  -4.294  -3.501
  298    HG2  GLN  37           HG2      GLN  37  93.330  -3.340  -4.352
  299    HG3  GLN  37           HG1      GLN  37  92.108  -2.090  -4.591
  300   HE21  GLN  37          HE21      GLN  37  94.120  -0.619  -4.544
  301   HE22  GLN  37          HE22      GLN  37  94.673  -0.095  -3.027
  302    H1U  RCY  38           H1U      RCY  38  86.272  -0.000  -2.157
  303    H1S  RCY  38           H1S      RCY  38  84.891  -3.319   0.811
  304    HB1  RCY  38           HB1      RCY  38  86.846  -5.731  -1.614
  305    HB2  RCY  38           HB2      RCY  38  87.170  -4.015  -1.369
  306    HA   RCY  38           HA       RCY  38  88.985  -5.022   0.342
  307    HN1  RCY  38           HN1      RCY  38  90.103  -5.039  -2.304
  308    H    LYS  39           HN       LYS  39  88.986  -7.117   1.123
  309    HA   LYS  39           HA       LYS  39  89.595  -9.392   1.107
  310    HB2  LYS  39           HB2      LYS  39  87.598  -9.155  -1.156
  311    HB3  LYS  39           HB1      LYS  39  88.263 -10.707  -0.655
  312    HG2  LYS  39           HG2      LYS  39  86.280 -10.523   0.612
  313    HG3  LYS  39           HG1      LYS  39  87.539 -10.013   1.737
  314    HD2  LYS  39           HD2      LYS  39  86.801  -7.693   0.311
  315    HD3  LYS  39           HD1      LYS  39  85.290  -8.501   0.730
  316    HE2  LYS  39           HE2      LYS  39  86.208  -8.726   3.095
  317    HE3  LYS  39           HE1      LYS  39  87.499  -7.629   2.605
  318    HZ1  LYS  39           HZ1      LYS  39  86.129  -5.884   2.636
  319    HZ2  LYS  39           HZ2      LYS  39  85.101  -6.864   3.569
  320    HZ3  LYS  39           HZ3      LYS  39  84.858  -6.727   1.893
  321    H    SER  40           HN       SER  40  89.238 -10.318  -2.054
  322    HA   SER  40           HA       SER  40  91.390  -9.385  -3.527
  323    HG   SER  40           HG       SER  40  94.068  -9.828  -1.497
  324    HB2  SER  40           HB2      SER  40  92.255 -11.138  -1.278
  325    HB3  SER  40           HB1      SER  40  93.014 -11.429  -2.841
  326    H    LYS  41           HN       LYS  41  88.831 -11.165  -3.294
  327    HA   LYS  41           HA       LYS  41  89.673 -13.531  -4.839
  328    HB2  LYS  41           HB2      LYS  41  86.820 -12.711  -4.300
  329    HB3  LYS  41           HB1      LYS  41  87.473 -14.334  -4.533
  330    HG2  LYS  41           HG2      LYS  41  88.827 -13.952  -2.403
  331    HG3  LYS  41           HG1      LYS  41  87.829 -12.522  -2.138
  332    HD2  LYS  41           HD2      LYS  41  85.810 -14.097  -2.445
  333    HD3  LYS  41           HD1      LYS  41  86.965 -15.413  -2.233
  334    HE2  LYS  41           HE2      LYS  41  86.125 -13.301  -0.264
  335    HE3  LYS  41           HE1      LYS  41  86.239 -15.047  -0.039
  336    HZ1  LYS  41           HZ1      LYS  41  88.490 -13.132  -0.308
  337    HZ2  LYS  41           HZ2      LYS  41  88.674 -14.821  -0.284
  338    HZ3  LYS  41           HZ3      LYS  41  88.059 -14.011   1.077
  339    HA   PRO  42           HA       PRO  42  88.924 -11.572  -8.748
  340    HB2  PRO  42           HB2      PRO  42  88.457 -13.762 -10.315
  341    HB3  PRO  42           HB1      PRO  42  90.068 -13.341  -9.701
  342    HG2  PRO  42           HG2      PRO  42  88.136 -15.365  -8.686
  343    HG3  PRO  42           HG1      PRO  42  89.898 -15.464  -8.843
  344    HD2  PRO  42           HD2      PRO  42  88.634 -14.953  -6.461
  345    HD3  PRO  42           HD1      PRO  42  90.272 -14.374  -6.837
  346    HA   PRO  43           HA       PRO  43  84.487 -11.283  -9.140
  347    HB2  PRO  43           HB2      PRO  43  84.277 -10.012 -11.525
  348    HB3  PRO  43           HB1      PRO  43  84.935  -9.209 -10.084
  349    HG2  PRO  43           HG2      PRO  43  86.384 -10.405 -12.395
  350    HG3  PRO  43           HG1      PRO  43  86.703  -8.898 -11.520
  351    HD2  PRO  43           HD2      PRO  43  88.092 -11.239 -11.077
  352    HD3  PRO  43           HD1      PRO  43  87.895  -9.963  -9.855
  353    H    LYS  44           HN       LYS  44  82.689 -12.252 -10.258
  354    HA   LYS  44           HA       LYS  44  83.461 -14.546 -11.980
  355    HB2  LYS  44           HB2      LYS  44  80.697 -13.899 -10.933
  356    HB3  LYS  44           HB1      LYS  44  81.306 -15.455 -11.494
  357    HG2  LYS  44           HG2      LYS  44  81.682 -15.869  -9.288
  358    HG3  LYS  44           HG1      LYS  44  83.102 -14.846  -9.507
  359    HD2  LYS  44           HD2      LYS  44  82.036 -13.847  -7.671
  360    HD3  LYS  44           HD1      LYS  44  81.453 -12.878  -9.025
  361    HE2  LYS  44           HE2      LYS  44  79.476 -13.375  -7.859
  362    HE3  LYS  44           HE1      LYS  44  79.506 -14.610  -9.117
  363    HZ1  LYS  44           HZ1      LYS  44  80.630 -15.023  -6.406
  364    HZ2  LYS  44           HZ2      LYS  44  80.347 -16.196  -7.601
  365    HZ3  LYS  44           HZ3      LYS  44  79.040 -15.439  -6.824
  366    H    LYS  45           HN       LYS  45  81.677 -11.515 -12.088
  367    HA   LYS  45           HA       LYS  45  81.738 -11.544 -14.998
  368    HB2  LYS  45           HB2      LYS  45  79.556 -12.815 -13.828
  369    HB3  LYS  45           HB1      LYS  45  78.942 -11.198 -14.146
  370    HG2  LYS  45           HG2      LYS  45  80.453 -12.743 -16.255
  371    HG3  LYS  45           HG1      LYS  45  78.713 -12.939 -16.043
  372    HD2  LYS  45           HD2      LYS  45  80.102 -10.285 -16.516
  373    HD3  LYS  45           HD1      LYS  45  79.272 -11.220 -17.761
  374    HE2  LYS  45           HE2      LYS  45  78.144  -9.603 -15.543
  375    HE3  LYS  45           HE1      LYS  45  77.486  -9.930 -17.147
  376    HZ1  LYS  45           HZ1      LYS  45  76.740 -12.040 -16.472
  377    HZ2  LYS  45           HZ2      LYS  45  76.285 -10.981 -15.224
  378    HZ3  LYS  45           HZ3      LYS  45  77.633 -11.996 -15.031
  379    H    GLY  46           HN       GLY  46  81.042 -10.061 -11.950
  380    HA2  GLY  46           HA2      GLY  46  80.138  -7.513 -13.009
  381    HA3  GLY  46           HA1      GLY  46  80.672  -7.810 -11.354
  382    H    VAL  47           HN       VAL  47  82.650  -8.599 -14.151
  383    HA   VAL  47           HA       VAL  47  84.847  -7.906 -14.635
  384    HB   VAL  47           HB       VAL  47  84.071  -5.076 -14.080
  385   HG11  VAL  47          HG11      VAL  47  86.150  -5.978 -15.335
  386   HG12  VAL  47          HG12      VAL  47  85.245  -4.666 -16.091
  387   HG13  VAL  47          HG13      VAL  47  85.031  -6.323 -16.654
  388   HG21  VAL  47          HG21      VAL  47  81.933  -5.808 -14.815
  389   HG22  VAL  47          HG22      VAL  47  82.631  -6.922 -15.990
  390   HG23  VAL  47          HG23      VAL  47  82.710  -5.183 -16.269
  391    H    GLN  48           HN       GLN  48  86.259  -5.620 -13.635
  392    HA   GLN  48           HA       GLN  48  87.495  -6.613 -11.338
  393    HB2  GLN  48           HB2      GLN  48  88.228  -4.638 -12.783
  394    HB3  GLN  48           HB1      GLN  48  87.110  -3.653 -11.838
  395    HG2  GLN  48           HG2      GLN  48  88.295  -4.511  -9.758
  396    HG3  GLN  48           HG1      GLN  48  89.520  -5.183 -10.835
  397   HE21  GLN  48          HE21      GLN  48  90.005  -3.029  -8.902
  398   HE22  GLN  48          HE22      GLN  48  90.452  -1.656  -9.794
  399    H    GLY  49           HN       GLY  49  85.955  -7.398  -9.830
  400    HA2  GLY  49           HA2      GLY  49  84.047  -5.454  -8.661
  401    HA3  GLY  49           HA1      GLY  49  84.076  -7.188  -8.338
  402    H1U  RCY  50           H1U      RCY  50  85.338   0.935  -1.964
  403    H1S  RCY  50           H1S      RCY  50  84.911  -3.530  -3.588
  404    HB1  RCY  50           HB1      RCY  50  88.093  -3.546  -6.553
  405    HB2  RCY  50           HB2      RCY  50  88.119  -3.989  -4.847
  406    HA   RCY  50           HA       RCY  50  88.688  -5.881  -6.421
  407    HN1  RCY  50           HN1      RCY  50  87.185  -5.876  -8.257
  408    H    GLY  51           HN       GLY  51  86.462  -7.861  -6.209
  409    HA2  GLY  51           HA2      GLY  51  86.768  -9.330  -4.073
  410    HA3  GLY  51           HA1      GLY  51  86.078  -7.930  -3.250
  411    H    ASP  52           HN       ASP  52  85.163 -10.852  -4.063
  412    HA   ASP  52           HA       ASP  52  82.464 -10.017  -5.066
  413    HB2  ASP  52           HB2      ASP  52  82.250 -12.280  -5.988
  414    HB3  ASP  52           HB1      ASP  52  83.703 -11.505  -6.620
  415    H    ASP  53           HN       ASP  53  81.474 -12.751  -4.445
  416    HA   ASP  53           HA       ASP  53  80.324 -13.776  -2.680
  417    HB2  ASP  53           HB2      ASP  53  82.888 -12.948  -1.296
  418    HB3  ASP  53           HB1      ASP  53  81.652 -13.939  -0.523
  419    H    ILE  54           HN       ILE  54  79.179 -13.309  -0.613
  420    HA   ILE  54           HA       ILE  54  78.526 -10.429  -0.461
  421    HB   ILE  54           HB       ILE  54  76.800 -11.496   1.277
  422   HG12  ILE  54          HG12      ILE  54  78.164 -13.738   0.813
  423   HG13  ILE  54          HG11      ILE  54  76.418 -13.774   1.059
  424   HG21  ILE  54          HG21      ILE  54  75.976 -10.425  -0.669
  425   HG22  ILE  54          HG22      ILE  54  75.350 -12.070  -0.782
  426   HG23  ILE  54          HG23      ILE  54  76.751 -11.592  -1.741
  427   HD11  ILE  54          HD11      ILE  54  75.972 -14.012  -1.235
  428   HD12  ILE  54          HD12      ILE  54  77.405 -15.015  -1.010
  429   HD13  ILE  54          HD13      ILE  54  77.559 -13.400  -1.703
  430    HA   PRO  55           HA       PRO  55  81.184 -10.336   3.188
  431    HB2  PRO  55           HB2      PRO  55  81.092  -7.657   3.634
  432    HB3  PRO  55           HB1      PRO  55  82.041  -8.368   2.315
  433    HG2  PRO  55           HG2      PRO  55  79.385  -7.035   2.217
  434    HG3  PRO  55           HG1      PRO  55  80.736  -6.948   1.075
  435    HD2  PRO  55           HD2      PRO  55  78.493  -8.529   0.701
  436    HD3  PRO  55           HD1      PRO  55  80.073  -8.846  -0.049
  437    H    GLY  56           HN       GLY  56  78.549 -11.221   3.658
  438    HA2  GLY  56           HA2      GLY  56  77.076 -11.418   5.478
  439    HA3  GLY  56           HA1      GLY  56  78.144 -10.337   6.374
  440    H    MET  57           HN       MET  57  75.450 -10.430   4.083
  441    HA   MET  57           HA       MET  57  74.974  -7.714   3.655
  442    HB2  MET  57           HB2      MET  57  73.134 -10.067   4.031
  443    HB3  MET  57           HB1      MET  57  72.457  -8.450   3.838
  444    HG2  MET  57           HG2      MET  57  74.510  -9.561   1.919
  445    HG3  MET  57           HG1      MET  57  72.781  -9.818   1.689
  446    HE1  MET  57           HE1      MET  57  75.154  -8.283  -0.018
  447    HE2  MET  57           HE2      MET  57  74.227  -6.997  -0.787
  448    HE3  MET  57           HE3      MET  57  73.568  -8.629  -0.720
  449    H    GLU  58           HN       GLU  58  73.220  -9.515   6.200
  450    HA   GLU  58           HA       GLU  58  72.311  -7.317   7.659
  451    HB2  GLU  58           HB2      GLU  58  73.336  -9.711   9.160
  452    HB3  GLU  58           HB1      GLU  58  71.830  -8.816   9.378
  453    HG2  GLU  58           HG2      GLU  58  71.161  -9.685   7.057
  454    HG3  GLU  58           HG1      GLU  58  72.514 -10.807   7.211
  455    H    GLY  59           HN       GLY  59  73.581  -5.607   8.258
  456    HA2  GLY  59           HA2      GLY  59  75.772  -6.066  10.134
  457    HA3  GLY  59           HA1      GLY  59  76.317  -5.457   8.571
  458    H1U  RCY  60           H1U      RCY  60  73.934   4.418   7.012
  459    H1S  RCY  60           H1S      RCY  60  73.833   0.932   9.539
  460    HB1  RCY  60           HB1      RCY  60  73.051  -0.776   9.420
  461    HB2  RCY  60           HB2      RCY  60  73.981  -2.010   8.572
  462    HA   RCY  60           HA       RCY  60  73.975  -2.263  11.523
  463    HN1  RCY  60           HN1      RCY  60  73.302  -4.643  10.253
  464    H    GLY  61           HN       GLY  61  71.643  -2.093   8.897
  465    HA2  GLY  61           HA2      GLY  61  69.455  -2.288  10.923
  466    HA3  GLY  61           HA1      GLY  61  69.346  -1.354   9.430
  467    H    THR  62           HN       THR  62  69.244  -4.581  10.797
  468    HA   THR  62           HA       THR  62  69.012  -6.018   8.317
  469    HB   THR  62           HB       THR  62  68.340  -7.883   9.649
  470    HG1  THR  62           HG1      THR  62  67.464  -5.864  11.400
  471   HG21  THR  62          HG21      THR  62  70.654  -6.901  10.067
  472   HG22  THR  62          HG22      THR  62  70.024  -7.940  11.345
  473   HG23  THR  62          HG23      THR  62  69.986  -6.187  11.534
  474    H    ASP  63           HN       ASP  63  67.329  -3.630   8.391
  475    HA   ASP  63           HA       ASP  63  64.575  -4.386   8.799
  476    HB2  ASP  63           HB2      ASP  63  65.505  -2.015   8.721
  477    HB3  ASP  63           HB1      ASP  63  65.586  -2.198   6.968
  478    H    ILE  64           HN       ILE  64  66.707  -5.601   6.626
  479    HA   ILE  64           HA       ILE  64  64.519  -6.396   4.810
  480    HB   ILE  64           HB       ILE  64  65.495  -4.342   3.802
  481   HG12  ILE  64          HG12      ILE  64  65.922  -5.345   1.579
  482   HG13  ILE  64          HG11      ILE  64  66.101  -6.930   2.334
  483   HG21  ILE  64          HG21      ILE  64  67.778  -4.280   3.099
  484   HG22  ILE  64          HG22      ILE  64  68.008  -5.992   3.458
  485   HG23  ILE  64          HG23      ILE  64  67.808  -4.834   4.773
  486   HD11  ILE  64          HD11      ILE  64  63.611  -5.396   2.930
  487   HD12  ILE  64          HD12      ILE  64  63.846  -7.136   2.763
  488   HD13  ILE  64          HD13      ILE  64  63.760  -6.116   1.327
  489    H    THR  65           HN       THR  65  67.961  -6.655   5.637
  490    HA   THR  65           HA       THR  65  69.126  -8.699   6.067
  491    HB   THR  65           HB       THR  65  67.182 -10.230   4.356
  492    HG1  THR  65           HG1      THR  65  66.456 -10.424   6.872
  493   HG21  THR  65          HG21      THR  65  69.238 -11.309   5.219
  494   HG22  THR  65          HG22      THR  65  67.785 -12.032   5.908
  495   HG23  THR  65          HG23      THR  65  68.747 -10.904   6.863
  496    H    VAL  66           HN       VAL  66  67.859  -7.697   2.955
  497    HA   VAL  66           HA       VAL  66  70.440  -8.580   1.727
  498    HB   VAL  66           HB       VAL  66  67.822  -8.598   0.226
  499   HG11  VAL  66          HG11      VAL  66  70.135  -8.613  -0.901
  500   HG12  VAL  66          HG12      VAL  66  69.021  -9.900  -1.362
  501   HG13  VAL  66          HG13      VAL  66  70.327 -10.229  -0.223
  502   HG21  VAL  66          HG21      VAL  66  69.085 -10.768   1.918
  503   HG22  VAL  66          HG22      VAL  66  67.937 -11.123   0.627
  504   HG23  VAL  66          HG23      VAL  66  67.436 -10.148   2.009
  505    H    ILE  67           HN       ILE  67  67.640  -6.819   0.376
  506    HA   ILE  67           HA       ILE  67  69.410  -4.416   0.104
  507    HB   ILE  67           HB       ILE  67  67.805  -5.779  -2.068
  508   HG12  ILE  67          HG12      ILE  67  70.655  -4.789  -2.163
  509   HG13  ILE  67          HG11      ILE  67  70.266  -6.367  -1.477
  510   HG21  ILE  67          HG21      ILE  67  68.848  -2.956  -1.860
  511   HG22  ILE  67          HG22      ILE  67  67.261  -3.506  -2.397
  512   HG23  ILE  67          HG23      ILE  67  68.672  -3.744  -3.428
  513   HD11  ILE  67          HD11      ILE  67  69.296  -5.534  -4.215
  514   HD12  ILE  67          HD12      ILE  67  69.371  -7.159  -3.533
  515   HD13  ILE  67          HD13      ILE  67  70.857  -6.319  -3.976
  516    H1U  RCY  68           H1U      RCY  68  73.489   0.381   4.651
  517    H1S  RCY  68           H1S      RCY  68  68.700   0.205   4.293
  518    HB1  RCY  68           HB1      RCY  68  67.191  -2.208   3.512
  519    HB2  RCY  68           HB2      RCY  68  65.820  -1.136   3.243
  520    HA   RCY  68           HA       RCY  68  65.443  -3.043   1.838
  521    HN1  RCY  68           HN1      RCY  68  68.289  -3.176   1.596
  522    HA   PRO  69           HA       PRO  69  64.309  -0.627  -1.685
  523    HB2  PRO  69           HB2      PRO  69  62.284   0.929  -0.596
  524    HB3  PRO  69           HB1      PRO  69  62.088  -0.751  -1.129
  525    HG2  PRO  69           HG2      PRO  69  62.466   0.328   1.612
  526    HG3  PRO  69           HG1      PRO  69  61.471  -1.028   1.055
  527    HD2  PRO  69           HD2      PRO  69  63.868  -1.392   2.304
  528    HD3  PRO  69           HD1      PRO  69  63.251  -2.520   1.075
  529    H    TRP  70           HN       TRP  70  65.594   0.808   1.138
  530    HA   TRP  70           HA       TRP  70  65.502   3.566   0.164
  531    HD1  TRP  70           HD1      TRP  70  66.042   5.630   0.788
  532    HE1  TRP  70           HE1      TRP  70  67.741   7.440   1.479
  533    HE3  TRP  70           HE3      TRP  70  68.953   2.928   3.997
  534    HZ2  TRP  70           HZ2      TRP  70  70.036   7.708   3.173
  535    HZ3  TRP  70           HZ3      TRP  70  70.884   3.981   5.133
  536    HH2  TRP  70           HH2      TRP  70  71.430   6.364   4.727
  537    HB2  TRP  70           HB2      TRP  70  65.562   3.136   2.582
  538    HB3  TRP  70           HB1      TRP  70  67.101   2.294   2.410
  539    H    GLU  71           HN       GLU  71  66.882   1.169  -1.266
  540    HA   GLU  71           HA       GLU  71  69.626   2.296  -1.517
  541    HB2  GLU  71           HB2      GLU  71  68.451  -0.351  -1.726
  542    HB3  GLU  71           HB1      GLU  71  69.317   0.038  -3.211
  543    HG2  GLU  71           HG2      GLU  71  71.260   0.781  -1.731
  544    HG3  GLU  71           HG1      GLU  71  70.401   0.032  -0.384
  545    H    ALA  72           HN       ALA  72  66.577   2.139  -3.125
  546    HA   ALA  72           HA       ALA  72  67.325   2.414  -5.837
  547    HB1  ALA  72           HB1      ALA  72  65.133   3.398  -6.184
  548    HB2  ALA  72           HB2      ALA  72  65.001   3.802  -4.472
  549    HB3  ALA  72           HB3      ALA  72  64.984   2.114  -4.984
  550    H1U  RCY  73           H1U      RCY  73  74.823   4.529  -0.871
  551    H1S  RCY  73           H1S      RCY  73  70.686   5.018  -2.717
  552    HB1  RCY  73           HB1      RCY  73  67.447   7.561  -2.410
  553    HB2  RCY  73           HB2      RCY  73  69.146   7.842  -2.784
  554    HA   RCY  73           HA       RCY  73  67.435   7.189  -4.703
  555    HN1  RCY  73           HN1      RCY  73  67.302   4.807  -3.235
  556    H    ASN  74           HN       ASN  74  68.628   7.281  -6.574
  557    HA   ASN  74           HA       ASN  74  71.346   6.136  -6.656
  558    HB2  ASN  74           HB2      ASN  74  71.206   7.176  -9.050
  559    HB3  ASN  74           HB1      ASN  74  70.208   5.770  -8.678
  560   HD21  ASN  74          HD21      ASN  74  70.089   8.960  -9.871
  561   HD22  ASN  74          HD22      ASN  74  68.416   9.206  -9.731
  562    H    HIS  75           HN       HIS  75  70.634   9.106  -8.343
  563    HA   HIS  75           HA       HIS  75  71.633  11.222  -8.225
  564    HD1  HIS  75           HD1      HIS  75  71.261  13.146  -8.029
  565    HD2  HIS  75           HD2      HIS  75  72.824  13.141  -4.162
  566    HE1  HIS  75           HE1      HIS  75  71.982  15.525  -7.546
  567    HE2  HIS  75           HE2      HIS  75  72.936  15.536  -5.195
  568    HB2  HIS  75           HB2      HIS  75  70.559  11.020  -5.877
  569    HB3  HIS  75           HB1      HIS  75  72.191  10.669  -5.309
  570    H1U  RCY  76           H1U      RCY  76  77.022   8.731  -0.546
  571    H1S  RCY  76           H1S      RCY  76  77.552  10.115  -4.653
  572    HB1  RCY  76           HB1      RCY  76  75.600  11.526  -6.594
  573    HB2  RCY  76           HB2      RCY  76  77.173  11.571  -7.388
  574    HA   RCY  76           HA       RCY  76  75.945  11.600  -9.308
  575    HN1  RCY  76           HN1      RCY  76  73.610  11.604  -9.063
  576    H    GLU  77           HN       GLU  77  74.422   8.608  -8.175
  577    HA   GLU  77           HA       GLU  77  76.456   6.872  -9.285
  578    HB2  GLU  77           HB2      GLU  77  73.621   6.447  -8.334
  579    HB3  GLU  77           HB1      GLU  77  74.550   5.139  -9.067
  580    HG2  GLU  77           HG2      GLU  77  75.643   6.776  -6.776
  581    HG3  GLU  77           HG1      GLU  77  74.662   5.335  -6.506
  582    H    LEU  78           HN       LEU  78  76.751   6.417 -11.411
  583    HA   LEU  78           HA       LEU  78  74.754   7.326 -13.371
  584    HG   LEU  78           HG       LEU  78  75.359   6.714 -15.664
  585    HB2  LEU  78           HB2      LEU  78  77.365   7.452 -13.559
  586    HB3  LEU  78           HB1      LEU  78  77.239   5.765 -14.058
  587   HD11  LEU  78          HD11      LEU  78  75.657   8.974 -16.337
  588   HD12  LEU  78          HD12      LEU  78  77.188   9.112 -15.472
  589   HD13  LEU  78          HD13      LEU  78  75.672   9.024 -14.574
  590   HD21  LEU  78          HD21      LEU  78  77.364   5.616 -16.478
  591   HD22  LEU  78          HD22      LEU  78  78.348   7.025 -16.082
  592   HD23  LEU  78          HD23      LEU  78  77.159   7.116 -17.382
  593    H    HIS  79           HN       HIS  79  73.664   5.334 -11.795
  594    HA   HIS  79           HA       HIS  79  72.883   3.385 -13.772
  595    HD1  HIS  79           HD1      HIS  79  76.765   2.743 -13.699
  596    HD2  HIS  79           HD2      HIS  79  73.332   0.663 -14.831
  597    HE1  HIS  79           HE1      HIS  79  77.260   1.725 -15.965
  598    HE2  HIS  79           HE2      HIS  79  75.178   0.456 -16.666
  599    HB2  HIS  79           HB2      HIS  79  75.053   2.694 -11.864
  600    HB3  HIS  79           HB1      HIS  79  73.767   1.497 -12.011
  601    H    GLU  80           HN       GLU  80  70.977   4.601 -12.858
  602    HA   GLU  80           HA       GLU  80  70.129   3.890 -10.136
  603    HB2  GLU  80           HB2      GLU  80  68.174   5.056 -12.063
  604    HB3  GLU  80           HB1      GLU  80  68.512   5.508 -10.393
  605    HG2  GLU  80           HG2      GLU  80  69.392   7.329 -11.567
  606    HG3  GLU  80           HG1      GLU  80  70.817   6.311 -11.359
  607    H    LEU  81           HN       LEU  81  70.248   2.203 -12.944
  608    HA   LEU  81           HA       LEU  81  67.624   0.841 -12.568
  609    HG   LEU  81           HG       LEU  81  68.584   2.779 -14.632
  610    HB2  LEU  81           HB2      LEU  81  69.691   0.510 -14.766
  611    HB3  LEU  81           HB1      LEU  81  68.080  -0.207 -14.739
  612   HD11  LEU  81          HD11      LEU  81  67.686   2.636 -17.037
  613   HD12  LEU  81          HD12      LEU  81  68.066   0.916 -16.955
  614   HD13  LEU  81          HD13      LEU  81  69.351   2.112 -16.783
  615   HD21  LEU  81          HD21      LEU  81  66.118   2.655 -15.468
  616   HD22  LEU  81          HD22      LEU  81  66.436   2.353 -13.760
  617   HD23  LEU  81          HD23      LEU  81  66.159   1.001 -14.858
  618    H    ALA  82           HN       ALA  82  70.913  -0.297 -13.412
  619    HA   ALA  82           HA       ALA  82  70.480  -2.879 -12.212
  620    HB1  ALA  82           HB1      ALA  82  72.886  -3.220 -12.583
  621    HB2  ALA  82           HB2      ALA  82  73.095  -1.496 -12.891
  622    HB3  ALA  82           HB3      ALA  82  72.147  -2.482 -14.005
  623    H    GLN  83           HN       GLN  83  69.951  -0.610 -10.405
  624    HA   GLN  83           HA       GLN  83  72.025  -0.218  -8.513
  625    HB2  GLN  83           HB2      GLN  83  69.013  -0.210  -8.246
  626    HB3  GLN  83           HB1      GLN  83  70.079   0.179  -6.895
  627    HG2  GLN  83           HG2      GLN  83  70.967   2.082  -7.996
  628    HG3  GLN  83           HG1      GLN  83  70.344   1.568  -9.564
  629   HE21  GLN  83          HE21      GLN  83  69.790   4.124  -8.042
  630   HE22  GLN  83          HE22      GLN  83  68.101   4.182  -7.877
  631    H    TYR  84           HN       TYR  84  69.393  -2.648  -8.514
  632    HA   TYR  84           HA       TYR  84  70.713  -4.053  -6.270
  633    HD1  TYR  84           HD1      TYR  84  68.353  -5.642  -9.354
  634    HD2  TYR  84           HD2      TYR  84  67.038  -2.460  -6.785
  635    HE1  TYR  84           HE1      TYR  84  66.831  -4.832 -11.136
  636    HE2  TYR  84           HE2      TYR  84  65.516  -1.650  -8.567
  637    HH   TYR  84           HH       TYR  84  64.326  -2.904 -10.676
  638    HB2  TYR  84           HB2      TYR  84  68.669  -5.673  -6.812
  639    HB3  TYR  84           HB1      TYR  84  68.422  -4.172  -5.921
  640    H    GLY  85           HN       GLY  85  71.736  -3.865  -9.168
  641    HA2  GLY  85           HA2      GLY  85  72.194  -6.803  -9.490
  642    HA3  GLY  85           HA1      GLY  85  71.864  -5.782 -10.892
  643    H    ILE  86           HN       ILE  86  73.423  -3.582  -9.426
  644    HA   ILE  86           HA       ILE  86  76.128  -4.415  -9.097
  645    HB   ILE  86           HB       ILE  86  75.419  -4.601 -11.756
  646   HG12  ILE  86          HG12      ILE  86  78.005  -4.178 -12.081
  647   HG13  ILE  86          HG11      ILE  86  78.009  -4.098 -10.319
  648   HG21  ILE  86          HG21      ILE  86  75.106  -2.075 -11.719
  649   HG22  ILE  86          HG22      ILE  86  76.225  -2.677 -12.942
  650   HG23  ILE  86          HG23      ILE  86  76.846  -1.947 -11.462
  651   HD11  ILE  86          HD11      ILE  86  78.448  -6.401 -11.136
  652   HD12  ILE  86          HD12      ILE  86  76.885  -6.393 -11.952
  653   HD13  ILE  86          HD13      ILE  86  76.960  -6.312 -10.192
  654    H1U  RCY  87           H1U      RCY  87  80.590  -3.521  -2.728
  655    H1S  RCY  87           H1S      RCY  87  77.443  -0.435  -4.789
  656    HB1  RCY  87           HB1      RCY  87  78.907   0.488  -8.897
  657    HB2  RCY  87           HB2      RCY  87  78.901  -1.098  -8.128
  658    HA   RCY  87           HA       RCY  87  76.253  -0.202  -7.911
  659    HN1  RCY  87           HN1      RCY  87  77.615  -2.344  -9.351
  Start of MODEL   42
    1    HA   MET   1           HA       MET   1  58.637   5.238 -17.991
    2    HB2  MET   1           HB2      MET   1  60.516   6.181 -19.513
    3    HB3  MET   1           HB1      MET   1  59.662   7.314 -18.464
    4    HG2  MET   1           HG2      MET   1  62.181   5.940 -17.537
    5    HG3  MET   1           HG1      MET   1  62.252   7.419 -18.494
    6    HE1  MET   1           HE1      MET   1  62.708   9.643 -15.651
    7    HE2  MET   1           HE2      MET   1  62.508   9.594 -17.401
    8    HE3  MET   1           HE3      MET   1  63.602   8.459 -16.613
    9    H    ASN   2           HN       ASN   2  59.207   3.789 -19.743
   10    HA   ASN   2           HA       ASN   2  59.877   1.606 -20.355
   11    HB2  ASN   2           HB2      ASN   2  62.370   1.492 -20.676
   12    HB3  ASN   2           HB1      ASN   2  61.628   2.933 -21.371
   13   HD21  ASN   2          HD21      ASN   2  62.388   4.949 -20.632
   14   HD22  ASN   2          HD22      ASN   2  63.452   5.145 -19.324
   15    H    LEU   3           HN       LEU   3  59.267   1.860 -17.512
   16    HA   LEU   3           HA       LEU   3  61.279   0.005 -16.305
   17    HG   LEU   3           HG       LEU   3  60.408  -0.560 -13.928
   18    HB2  LEU   3           HB2      LEU   3  60.685   2.182 -15.122
   19    HB3  LEU   3           HB1      LEU   3  59.073   1.511 -14.880
   20   HD11  LEU   3          HD11      LEU   3  62.635   0.252 -14.497
   21   HD12  LEU   3          HD12      LEU   3  62.469   0.216 -12.741
   22   HD13  LEU   3          HD13      LEU   3  62.350   1.748 -13.607
   23   HD21  LEU   3          HD21      LEU   3  60.109   2.058 -12.420
   24   HD22  LEU   3          HD22      LEU   3  60.286   0.470 -11.675
   25   HD23  LEU   3          HD23      LEU   3  58.851   0.840 -12.631
   26    H    GLU   4           HN       GLU   4  60.484  -1.949 -17.227
   27    HA   GLU   4           HA       GLU   4  57.641  -2.628 -16.890
   28    HB2  GLU   4           HB2      GLU   4  58.221  -4.707 -18.046
   29    HB3  GLU   4           HB1      GLU   4  58.904  -3.335 -18.919
   30    HG2  GLU   4           HG2      GLU   4  61.050  -3.724 -17.603
   31    HG3  GLU   4           HG1      GLU   4  60.343  -5.250 -17.071
   32    HA   PRO   5           HA       PRO   5  57.644  -4.514 -12.894
   33    HB2  PRO   5           HB2      PRO   5  56.820  -6.977 -14.400
   34    HB3  PRO   5           HB1      PRO   5  56.128  -6.279 -12.922
   35    HG2  PRO   5           HG2      PRO   5  55.008  -5.943 -15.344
   36    HG3  PRO   5           HG1      PRO   5  54.911  -4.723 -14.065
   37    HD2  PRO   5           HD2      PRO   5  56.390  -4.616 -16.603
   38    HD3  PRO   5           HD1      PRO   5  55.991  -3.297 -15.482
   39    HA   PRO   6           HA       PRO   6  61.627  -6.690 -13.564
   40    HB2  PRO   6           HB2      PRO   6  63.006  -5.515 -11.558
   41    HB3  PRO   6           HB1      PRO   6  62.703  -4.687 -13.098
   42    HG2  PRO   6           HG2      PRO   6  61.394  -4.311 -10.466
   43    HG3  PRO   6           HG1      PRO   6  61.752  -3.127 -11.732
   44    HD2  PRO   6           HD2      PRO   6  59.252  -4.337 -11.275
   45    HD3  PRO   6           HD1      PRO   6  59.725  -3.448 -12.739
   46    H    LYS   7           HN       LYS   7  62.026  -8.691 -12.703
   47    HA   LYS   7           HA       LYS   7  60.616  -9.566 -10.311
   48    HB2  LYS   7           HB2      LYS   7  62.198 -11.644 -10.758
   49    HB3  LYS   7           HB1      LYS   7  60.846 -11.310 -11.839
   50    HG2  LYS   7           HG2      LYS   7  62.246 -10.345 -13.483
   51    HG3  LYS   7           HG1      LYS   7  63.582 -10.144 -12.349
   52    HD2  LYS   7           HD2      LYS   7  62.560 -12.910 -12.857
   53    HD3  LYS   7           HD1      LYS   7  63.568 -12.151 -14.090
   54    HE2  LYS   7           HE2      LYS   7  65.298 -11.694 -12.373
   55    HE3  LYS   7           HE1      LYS   7  64.299 -12.506 -11.167
   56    HZ1  LYS   7           HZ1      LYS   7  65.600 -13.678 -13.553
   57    HZ2  LYS   7           HZ2      LYS   7  64.349 -14.474 -12.723
   58    HZ3  LYS   7           HZ3      LYS   7  65.805 -14.111 -11.926
   59    H    ALA   8           HN       ALA   8  61.552  -8.068  -8.738
   60    HA   ALA   8           HA       ALA   8  63.856  -9.188  -7.381
   61    HB1  ALA   8           HB1      ALA   8  65.167  -8.013  -9.002
   62    HB2  ALA   8           HB2      ALA   8  65.202  -7.025  -7.542
   63    HB3  ALA   8           HB3      ALA   8  64.149  -6.577  -8.884
   64    H    GLU   9           HN       GLU   9  61.018  -7.541  -7.416
   65    HA   GLU   9           HA       GLU   9  61.487  -5.705  -5.193
   66    HB2  GLU   9           HB2      GLU   9  59.049  -5.393  -5.236
   67    HB3  GLU   9           HB1      GLU   9  59.705  -5.295  -6.871
   68    HG2  GLU   9           HG2      GLU   9  59.151  -7.745  -7.146
   69    HG3  GLU   9           HG1      GLU   9  58.303  -7.661  -5.601
   70    H1U  RCY  10           H1U      RCY  10  60.306  -5.275  -5.264
   71    H1S  RCY  10           H1S      RCY  10  58.929  -8.734  -6.976
   72    HB1  RCY  10           HB1      RCY  10  58.123 -10.358  -3.559
   73    HB2  RCY  10           HB2      RCY  10  59.279 -11.681  -3.659
   74    HA   RCY  10           HA       RCY  10  59.862  -9.198  -2.668
   75    HN1  RCY  10           HN1      RCY  10  60.486  -9.044  -5.581
   76    H    ARG  11           HN       ARG  11  60.803 -10.971  -1.441
   77    HA   ARG  11           HA       ARG  11  63.108 -12.393  -2.585
   78    HE   ARG  11           HE       ARG  11  67.027 -11.504   1.592
   79    HB2  ARG  11           HB2      ARG  11  64.085 -10.211  -1.975
   80    HB3  ARG  11           HB1      ARG  11  63.443 -10.374  -0.341
   81    HG2  ARG  11           HG2      ARG  11  64.782 -12.444  -0.039
   82    HG3  ARG  11           HG1      ARG  11  65.460 -12.222  -1.652
   83    HD2  ARG  11           HD2      ARG  11  66.644 -10.289  -1.026
   84    HD3  ARG  11           HD1      ARG  11  65.635 -10.020   0.395
   85   HH11  ARG  11          HH21      ARG  11  67.415 -11.814  -1.820
   86   HH12  ARG  11          HH22      ARG  11  68.761 -12.897  -1.702
   87   HH21  ARG  11          HH11      ARG  11  68.783 -12.917   1.765
   88   HH22  ARG  11          HH12      ARG  11  69.536 -13.521   0.327
   89    H    SER  12           HN       SER  12  61.212 -11.540   0.297
   90    HA   SER  12           HA       SER  12  61.038 -14.384   1.013
   91    HG   SER  12           HG       SER  12  61.918 -11.883   3.703
   92    HB2  SER  12           HB2      SER  12  61.876 -13.965   3.341
   93    HB3  SER  12           HB1      SER  12  63.128 -13.816   2.112
   94    H    ALA  13           HN       ALA  13  60.526 -11.107   2.380
   95    HA   ALA  13           HA       ALA  13  58.629 -10.184   3.408
   96    HB1  ALA  13           HB1      ALA  13  57.764 -10.589   1.078
   97    HB2  ALA  13           HB2      ALA  13  56.513 -10.638   2.320
   98    HB3  ALA  13           HB3      ALA  13  57.137 -12.140   1.636
   99    H    THR  14           HN       THR  14  59.880 -12.510   4.684
  100    HA   THR  14           HA       THR  14  57.691 -13.167   6.509
  101    HB   THR  14           HB       THR  14  57.396 -14.847   4.686
  102    HG1  THR  14           HG1      THR  14  56.770 -15.928   6.358
  103   HG21  THR  14          HG21      THR  14  59.867 -14.876   4.110
  104   HG22  THR  14          HG22      THR  14  59.106 -16.464   4.215
  105   HG23  THR  14          HG23      THR  14  60.110 -15.878   5.542
  106    H    ARG  15           HN       ARG  15  60.915 -12.653   5.810
  107    HA   ARG  15           HA       ARG  15  61.677 -13.177   8.586
  108    HE   ARG  15           HE       ARG  15  65.711 -15.552   9.917
  109    HB2  ARG  15           HB2      ARG  15  61.956 -15.399   7.370
  110    HB3  ARG  15           HB1      ARG  15  63.215 -14.618   6.413
  111    HG2  ARG  15           HG2      ARG  15  64.304 -13.961   8.626
  112    HG3  ARG  15           HG1      ARG  15  63.176 -15.072   9.403
  113    HD2  ARG  15           HD2      ARG  15  64.031 -16.938   8.117
  114    HD3  ARG  15           HD1      ARG  15  65.042 -15.864   7.150
  115   HH11  ARG  15          HH21      ARG  15  65.898 -17.744   7.263
  116   HH12  ARG  15          HH22      ARG  15  67.351 -18.504   7.821
  117   HH21  ARG  15          HH11      ARG  15  67.607 -16.532  10.661
  118   HH22  ARG  15          HH12      ARG  15  68.318 -17.818   9.745
  119    H    VAL  16           HN       VAL  16  62.532 -11.175   8.930
  120    HA   VAL  16           HA       VAL  16  64.895 -10.390   7.346
  121    HB   VAL  16           HB       VAL  16  63.983  -8.092   6.976
  122   HG11  VAL  16          HG11      VAL  16  63.846 -10.001   5.278
  123   HG12  VAL  16          HG12      VAL  16  62.716  -8.669   5.035
  124   HG13  VAL  16          HG13      VAL  16  62.159 -10.177   5.761
  125   HG21  VAL  16          HG21      VAL  16  61.405  -9.391   7.916
  126   HG22  VAL  16          HG22      VAL  16  61.527  -7.785   7.196
  127   HG23  VAL  16          HG23      VAL  16  62.284  -8.113   8.755
  128    H    MET  17           HN       MET  17  64.426  -7.595   8.558
  129    HA   MET  17           HA       MET  17  64.494  -8.009  11.434
  130    HB2  MET  17           HB2      MET  17  66.855  -8.641  10.232
  131    HB3  MET  17           HB1      MET  17  67.096  -6.915  10.497
  132    HG2  MET  17           HG2      MET  17  66.463  -9.031  12.568
  133    HG3  MET  17           HG1      MET  17  67.900  -8.013  12.470
  134    HE1  MET  17           HE1      MET  17  68.087  -6.364  14.425
  135    HE2  MET  17           HE2      MET  17  67.354  -7.866  14.981
  136    HE3  MET  17           HE3      MET  17  66.721  -6.322  15.547
  137    H    GLY  18           HN       GLY  18  63.178  -6.308   9.404
  138    HA2  GLY  18           HA2      GLY  18  64.160  -3.620  10.278
  139    HA3  GLY  18           HA1      GLY  18  63.282  -3.907   8.774
  140    H    GLY  19           HN       GLY  19  62.961  -3.701  12.277
  141    HA2  GLY  19           HA2      GLY  19  60.199  -4.326  12.504
  142    HA3  GLY  19           HA1      GLY  19  61.075  -3.263  13.606
  143    HA   PRO  20           HA       PRO  20  57.879  -0.667  11.460
  144    HB2  PRO  20           HB2      PRO  20  58.051   0.802  14.033
  145    HB3  PRO  20           HB1      PRO  20  56.624   0.174  13.187
  146    HG2  PRO  20           HG2      PRO  20  57.568  -0.948  15.426
  147    HG3  PRO  20           HG1      PRO  20  56.809  -1.898  14.138
  148    HD2  PRO  20           HD2      PRO  20  59.718  -1.623  14.812
  149    HD3  PRO  20           HD1      PRO  20  58.826  -3.044  14.219
  150    H1U  RCY  21           H1U      RCY  21  62.318   1.311   3.841
  151    H1S  RCY  21           H1S      RCY  21  63.493   1.316   8.006
  152    HB1  RCY  21           HB1      RCY  21  63.212   0.646  11.248
  153    HB2  RCY  21           HB2      RCY  21  63.334   1.790   9.911
  154    HA   RCY  21           HA       RCY  21  61.489   2.297  11.575
  155    HN1  RCY  21           HN1      RCY  21  60.591  -0.394  10.809
  156    H    THR  22           HN       THR  22  61.919   3.956   9.904
  157    HA   THR  22           HA       THR  22  59.816   3.906   7.780
  158    HB   THR  22           HB       THR  22  59.489   6.141   8.155
  159    HG1  THR  22           HG1      THR  22  62.209   6.443   8.874
  160   HG21  THR  22          HG21      THR  22  59.780   6.753  10.460
  161   HG22  THR  22          HG22      THR  22  61.131   5.635  10.647
  162   HG23  THR  22          HG23      THR  22  59.496   5.013  10.425
  163    HA   PRO  23           HA       PRO  23  62.909   3.733   4.628
  164    HB2  PRO  23           HB2      PRO  23  61.805   5.398   2.714
  165    HB3  PRO  23           HB1      PRO  23  61.276   3.731   3.009
  166    HG2  PRO  23           HG2      PRO  23  60.064   6.284   3.933
  167    HG3  PRO  23           HG1      PRO  23  59.281   4.798   3.371
  168    HD2  PRO  23           HD2      PRO  23  59.453   5.431   6.012
  169    HD3  PRO  23           HD1      PRO  23  59.478   3.748   5.437
  170    H    ARG  24           HN       ARG  24  64.594   5.001   3.582
  171    HA   ARG  24           HA       ARG  24  65.159   7.521   5.033
  172    HE   ARG  24           HE       ARG  24  68.921   3.045   4.076
  173    HB2  ARG  24           HB2      ARG  24  66.998   6.255   3.014
  174    HB3  ARG  24           HB1      ARG  24  67.406   7.204   4.444
  175    HG2  ARG  24           HG2      ARG  24  66.375   5.301   5.815
  176    HG3  ARG  24           HG1      ARG  24  66.407   4.354   4.327
  177    HD2  ARG  24           HD2      ARG  24  68.946   5.398   4.374
  178    HD3  ARG  24           HD1      ARG  24  68.628   5.153   6.091
  179   HH11  ARG  24          HH21      ARG  24  67.706   4.022   7.151
  180   HH12  ARG  24          HH22      ARG  24  67.662   2.415   7.793
  181   HH21  ARG  24          HH11      ARG  24  68.870   0.940   4.897
  182   HH22  ARG  24          HH12      ARG  24  68.321   0.669   6.517
  183    H    LYS  25           HN       LYS  25  63.480   8.737   3.841
  184    HA   LYS  25           HA       LYS  25  62.746  10.115   2.083
  185    HB2  LYS  25           HB2      LYS  25  65.615  10.284   1.189
  186    HB3  LYS  25           HB1      LYS  25  64.396  11.557   1.259
  187    HG2  LYS  25           HG2      LYS  25  65.763  10.240   3.623
  188    HG3  LYS  25           HG1      LYS  25  65.993  11.898   3.067
  189    HD2  LYS  25           HD2      LYS  25  63.538  12.294   3.471
  190    HD3  LYS  25           HD1      LYS  25  63.458  10.695   4.212
  191    HE2  LYS  25           HE2      LYS  25  63.779  12.540   5.879
  192    HE3  LYS  25           HE1      LYS  25  65.074  11.342   5.908
  193    HZ1  LYS  25           HZ1      LYS  25  65.818  13.711   5.919
  194    HZ2  LYS  25           HZ2      LYS  25  65.214  13.853   4.338
  195    HZ3  LYS  25           HZ3      LYS  25  66.477  12.768   4.673
  196    H    GLY  26           HN       GLY  26  64.308  10.337  -0.482
  197    HA2  GLY  26           HA2      GLY  26  64.473   7.765  -1.731
  198    HA3  GLY  26           HA1      GLY  26  62.882   8.460  -2.042
  199    HA   PRO  27           HA       PRO  27  64.153  11.134  -5.285
  200    HB2  PRO  27           HB2      PRO  27  63.893  13.534  -3.515
  201    HB3  PRO  27           HB1      PRO  27  63.173  13.226  -5.107
  202    HG2  PRO  27           HG2      PRO  27  61.745  13.058  -2.858
  203    HG3  PRO  27           HG1      PRO  27  61.450  11.992  -4.241
  204    HD2  PRO  27           HD2      PRO  27  62.711  11.360  -1.621
  205    HD3  PRO  27           HD1      PRO  27  61.828  10.295  -2.736
  206    HA   PRO  28           HA       PRO  28  68.427  12.254  -4.984
  207    HB2  PRO  28           HB2      PRO  28  67.978  14.997  -6.026
  208    HB3  PRO  28           HB1      PRO  28  68.940  13.675  -6.712
  209    HG2  PRO  28           HG2      PRO  28  66.601  14.441  -7.769
  210    HG3  PRO  28           HG1      PRO  28  67.149  12.757  -7.799
  211    HD2  PRO  28           HD2      PRO  28  65.070  14.031  -6.057
  212    HD3  PRO  28           HD1      PRO  28  65.122  12.388  -6.736
  213    H    LYS  29           HN       LYS  29  69.745  13.010  -3.340
  214    HA   LYS  29           HA       LYS  29  69.395  15.580  -2.086
  215    HB2  LYS  29           HB2      LYS  29  67.460  14.056  -1.184
  216    HB3  LYS  29           HB1      LYS  29  68.733  13.312  -0.218
  217    HG2  LYS  29           HG2      LYS  29  69.368  15.691   0.501
  218    HG3  LYS  29           HG1      LYS  29  67.829  16.197  -0.197
  219    HD2  LYS  29           HD2      LYS  29  67.143  15.772   1.969
  220    HD3  LYS  29           HD1      LYS  29  66.910  14.170   1.270
  221    HE2  LYS  29           HE2      LYS  29  69.348  13.707   1.980
  222    HE3  LYS  29           HE1      LYS  29  69.192  15.147   2.987
  223    HZ1  LYS  29           HZ1      LYS  29  68.334  13.749   4.479
  224    HZ2  LYS  29           HZ2      LYS  29  68.045  12.530   3.332
  225    HZ3  LYS  29           HZ3      LYS  29  66.926  13.792   3.534
  226    H1U  RCY  30           H1U      RCY  30  78.685  12.308  -7.974
  227    H1S  RCY  30           H1S      RCY  30  75.652  13.774  -4.701
  228    HB1  RCY  30           HB1      RCY  30  73.882  13.977  -3.778
  229    HB2  RCY  30           HB2      RCY  30  73.626  12.254  -3.502
  230    HA   RCY  30           HA       RCY  30  73.117  12.642  -1.165
  231    HN1  RCY  30           HN1      RCY  30  71.489  13.776  -3.187
  232    H    LYS  31           HN       LYS  31  73.149  14.013   0.679
  233    HA   LYS  31           HA       LYS  31  74.445  16.679   0.312
  234    HB2  LYS  31           HB2      LYS  31  73.434  17.369   2.338
  235    HB3  LYS  31           HB1      LYS  31  72.184  16.435   1.521
  236    HG2  LYS  31           HG2      LYS  31  74.022  15.446   3.725
  237    HG3  LYS  31           HG1      LYS  31  72.287  15.737   3.857
  238    HD2  LYS  31           HD2      LYS  31  72.014  14.034   1.958
  239    HD3  LYS  31           HD1      LYS  31  73.698  13.599   2.253
  240    HE2  LYS  31           HE2      LYS  31  71.313  13.252   4.045
  241    HE3  LYS  31           HE1      LYS  31  72.583  12.095   3.645
  242    HZ1  LYS  31           HZ1      LYS  31  73.018  14.556   5.246
  243    HZ2  LYS  31           HZ2      LYS  31  74.131  13.302   4.973
  244    HZ3  LYS  31           HZ3      LYS  31  72.748  13.022   5.918
  245    H    GLN  32           HN       GLN  32  75.612  13.787   0.600
  246    HA   GLN  32           HA       GLN  32  77.161  13.973   3.072
  247    HB2  GLN  32           HB2      GLN  32  77.470  12.146   0.669
  248    HB3  GLN  32           HB1      GLN  32  78.320  11.961   2.203
  249    HG2  GLN  32           HG2      GLN  32  75.303  11.948   1.894
  250    HG3  GLN  32           HG1      GLN  32  76.301  10.502   2.052
  251   HE21  GLN  32          HE21      GLN  32  78.006  10.915   4.073
  252   HE22  GLN  32          HE22      GLN  32  77.226  11.395   5.502
  253    H    ARG  33           HN       ARG  33  79.554  14.065   3.047
  254    HA   ARG  33           HA       ARG  33  80.691  15.485   0.679
  255    HE   ARG  33           HE       ARG  33  78.247  16.019   3.330
  256    HB2  ARG  33           HB2      ARG  33  80.823  16.354   3.578
  257    HB3  ARG  33           HB1      ARG  33  81.925  16.964   2.346
  258    HG2  ARG  33           HG2      ARG  33  80.372  18.435   1.642
  259    HG3  ARG  33           HG1      ARG  33  79.234  17.120   1.344
  260    HD2  ARG  33           HD2      ARG  33  79.706  18.446   4.032
  261    HD3  ARG  33           HD1      ARG  33  78.327  18.751   2.974
  262   HH11  ARG  33          HH21      ARG  33  78.485  18.767   5.397
  263   HH12  ARG  33          HH22      ARG  33  77.648  18.016   6.714
  264   HH21  ARG  33          HH11      ARG  33  77.153  15.021   5.038
  265   HH22  ARG  33          HH12      ARG  33  76.894  15.895   6.511
  266    H    GLN  34           HN       GLN  34  80.846  12.766   2.246
  267    HA   GLN  34           HA       GLN  34  82.520  11.201   2.743
  268    HB2  GLN  34           HB2      GLN  34  84.137  12.969   0.882
  269    HB3  GLN  34           HB1      GLN  34  84.509  11.300   1.313
  270    HG2  GLN  34           HG2      GLN  34  82.454  10.521   0.268
  271    HG3  GLN  34           HG1      GLN  34  81.953  12.181  -0.059
  272   HE21  GLN  34          HE21      GLN  34  84.134  13.395  -1.153
  273   HE22  GLN  34          HE22      GLN  34  84.679  12.572  -2.534
  274    H    THR  35           HN       THR  35  82.318  13.731   4.385
  275    HA   THR  35           HA       THR  35  84.828  14.753   5.134
  276    HB   THR  35           HB       THR  35  83.816  15.429   7.173
  277    HG1  THR  35           HG1      THR  35  83.184  13.203   7.671
  278   HG21  THR  35          HG21      THR  35  81.413  15.006   5.395
  279   HG22  THR  35          HG22      THR  35  82.677  16.168   4.991
  280   HG23  THR  35          HG23      THR  35  81.747  16.358   6.477
  281    H    ARG  36           HN       ARG  36  83.185  11.821   6.332
  282    HA   ARG  36           HA       ARG  36  85.332  11.061   8.102
  283    HE   ARG  36           HE       ARG  36  81.431  11.273   7.097
  284    HB2  ARG  36           HB2      ARG  36  84.182   8.881   8.193
  285    HB3  ARG  36           HB1      ARG  36  83.029  10.205   8.361
  286    HG2  ARG  36           HG2      ARG  36  83.107   9.876   5.632
  287    HG3  ARG  36           HG1      ARG  36  83.298   8.218   6.202
  288    HD2  ARG  36           HD2      ARG  36  80.947   8.545   6.041
  289    HD3  ARG  36           HD1      ARG  36  81.314   8.693   7.760
  290   HH11  ARG  36          HH21      ARG  36  79.316   8.794   5.971
  291   HH12  ARG  36          HH22      ARG  36  77.999   9.874   5.660
  292   HH21  ARG  36          HH11      ARG  36  79.723  12.698   6.698
  293   HH22  ARG  36          HH12      ARG  36  78.229  12.085   6.072
  294    H    GLN  37           HN       GLN  37  84.581  10.407   4.723
  295    HA   GLN  37           HA       GLN  37  85.765   9.180   3.096
  296    HB2  GLN  37           HB2      GLN  37  87.173  11.278   3.646
  297    HB3  GLN  37           HB1      GLN  37  88.224  10.180   4.539
  298    HG2  GLN  37           HG2      GLN  37  88.529   8.811   2.511
  299    HG3  GLN  37           HG1      GLN  37  87.472   9.900   1.613
  300   HE21  GLN  37          HE21      GLN  37  90.669   9.256   1.967
  301   HE22  GLN  37          HE22      GLN  37  91.318  10.809   1.747
  302    H1U  RCY  38           H1U      RCY  38  84.985   1.319   2.091
  303    H1S  RCY  38           H1S      RCY  38  86.387   4.829   3.467
  304    HB1  RCY  38           HB1      RCY  38  88.118   4.599   4.286
  305    HB2  RCY  38           HB2      RCY  38  89.693   5.204   3.776
  306    HA   RCY  38           HA       RCY  38  88.008   6.153   5.921
  307    HN1  RCY  38           HN1      RCY  38  88.705   8.501   4.295
  308    H    LYS  39           HN       LYS  39  90.347   8.249   4.390
  309    HA   LYS  39           HA       LYS  39  92.624   8.633   4.848
  310    HB2  LYS  39           HB2      LYS  39  91.020   8.831   7.231
  311    HB3  LYS  39           HB1      LYS  39  92.606   8.204   7.674
  312    HG2  LYS  39           HG2      LYS  39  92.836  10.572   7.752
  313    HG3  LYS  39           HG1      LYS  39  93.580  10.091   6.227
  314    HD2  LYS  39           HD2      LYS  39  91.272  10.505   5.167
  315    HD3  LYS  39           HD1      LYS  39  90.865  11.339   6.667
  316    HE2  LYS  39           HE2      LYS  39  91.678  13.057   5.255
  317    HE3  LYS  39           HE1      LYS  39  93.047  12.671   6.298
  318    HZ1  LYS  39           HZ1      LYS  39  93.388  10.930   4.295
  319    HZ2  LYS  39           HZ2      LYS  39  94.127  12.458   4.364
  320    HZ3  LYS  39           HZ3      LYS  39  92.707  12.239   3.458
  321    H    SER  40           HN       SER  40  91.663   5.689   4.590
  322    HA   SER  40           HA       SER  40  94.231   4.487   4.950
  323    HG   SER  40           HG       SER  40  91.331   3.432   6.966
  324    HB2  SER  40           HB2      SER  40  93.447   2.870   6.812
  325    HB3  SER  40           HB1      SER  40  93.934   4.492   7.294
  326    H    LYS  41           HN       LYS  41  94.069   3.232   3.155
  327    HA   LYS  41           HA       LYS  41  91.616   1.542   2.832
  328    HB2  LYS  41           HB2      LYS  41  91.898   3.217   1.033
  329    HB3  LYS  41           HB1      LYS  41  93.504   2.574   0.694
  330    HG2  LYS  41           HG2      LYS  41  91.657   0.385   0.734
  331    HG3  LYS  41           HG1      LYS  41  90.999   1.645  -0.311
  332    HD2  LYS  41           HD2      LYS  41  93.885   0.794  -0.521
  333    HD3  LYS  41           HD1      LYS  41  92.612  -0.072  -1.382
  334    HE2  LYS  41           HE2      LYS  41  92.927   2.928  -1.579
  335    HE3  LYS  41           HE1      LYS  41  93.766   1.824  -2.668
  336    HZ1  LYS  41           HZ1      LYS  41  91.182   0.933  -2.632
  337    HZ2  LYS  41           HZ2      LYS  41  91.918   1.832  -3.871
  338    HZ3  LYS  41           HZ3      LYS  41  91.027   2.622  -2.659
  339    HA   PRO  42           HA       PRO  42  95.202  -1.290   3.480
  340    HB2  PRO  42           HB2      PRO  42  93.949  -3.014   5.180
  341    HB3  PRO  42           HB1      PRO  42  94.706  -1.505   5.725
  342    HG2  PRO  42           HG2      PRO  42  91.840  -2.130   5.283
  343    HG3  PRO  42           HG1      PRO  42  92.598  -1.098   6.505
  344    HD2  PRO  42           HD2      PRO  42  91.352  -0.164   4.197
  345    HD3  PRO  42           HD1      PRO  42  92.540   0.751   5.149
  346    HA   PRO  43           HA       PRO  43  93.893  -4.355   0.561
  347    HB2  PRO  43           HB2      PRO  43  95.500  -6.471   1.231
  348    HB3  PRO  43           HB1      PRO  43  96.101  -5.016   0.413
  349    HG2  PRO  43           HG2      PRO  43  96.262  -5.762   3.289
  350    HG3  PRO  43           HG1      PRO  43  97.473  -4.988   2.253
  351    HD2  PRO  43           HD2      PRO  43  95.931  -3.589   4.031
  352    HD3  PRO  43           HD1      PRO  43  96.555  -2.879   2.525
  353    H    LYS  44           HN       LYS  44  92.933  -6.583   0.393
  354    HA   LYS  44           HA       LYS  44  91.059  -7.865   1.067
  355    HB2  LYS  44           HB2      LYS  44  91.737  -9.367   3.028
  356    HB3  LYS  44           HB1      LYS  44  92.793  -9.387   1.619
  357    HG2  LYS  44           HG2      LYS  44  94.311  -7.787   2.705
  358    HG3  LYS  44           HG1      LYS  44  93.243  -7.709   4.107
  359    HD2  LYS  44           HD2      LYS  44  94.647  -9.336   4.898
  360    HD3  LYS  44           HD1      LYS  44  93.591 -10.387   3.954
  361    HE2  LYS  44           HE2      LYS  44  96.301  -9.291   3.194
  362    HE3  LYS  44           HE1      LYS  44  95.783 -10.976   3.265
  363    HZ1  LYS  44           HZ1      LYS  44  94.634  -8.983   1.393
  364    HZ2  LYS  44           HZ2      LYS  44  94.391 -10.664   1.388
  365    HZ3  LYS  44           HZ3      LYS  44  95.911 -10.022   0.986
  366    H    LYS  45           HN       LYS  45  91.495  -8.188   4.346
  367    HA   LYS  45           HA       LYS  45  89.483  -6.035   4.906
  368    HB2  LYS  45           HB2      LYS  45  88.834  -7.606   6.842
  369    HB3  LYS  45           HB1      LYS  45  88.364  -8.104   5.217
  370    HG2  LYS  45           HG2      LYS  45  90.224  -9.628   5.063
  371    HG3  LYS  45           HG1      LYS  45  90.922  -9.010   6.561
  372    HD2  LYS  45           HD2      LYS  45  89.097  -9.896   7.864
  373    HD3  LYS  45           HD1      LYS  45  88.196 -10.323   6.408
  374    HE2  LYS  45           HE2      LYS  45  90.078 -11.871   5.782
  375    HE3  LYS  45           HE1      LYS  45  90.807 -11.538   7.353
  376    HZ1  LYS  45           HZ1      LYS  45  88.434 -12.178   8.190
  377    HZ2  LYS  45           HZ2      LYS  45  89.579 -13.381   7.833
  378    HZ3  LYS  45           HZ3      LYS  45  88.354 -13.012   6.715
  379    H    GLY  46           HN       GLY  46  89.945  -4.644   6.568
  380    HA2  GLY  46           HA2      GLY  46  92.478  -5.138   8.082
  381    HA3  GLY  46           HA1      GLY  46  91.857  -3.532   7.696
  382    H    VAL  47           HN       VAL  47  90.341  -2.604   9.062
  383    HA   VAL  47           HA       VAL  47  90.064  -3.686  11.713
  384    HB   VAL  47           HB       VAL  47  88.474  -1.809  12.059
  385   HG11  VAL  47          HG11      VAL  47  90.064  -0.014  11.629
  386   HG12  VAL  47          HG12      VAL  47  90.894  -0.996  10.422
  387   HG13  VAL  47          HG13      VAL  47  90.952  -1.456  12.123
  388   HG21  VAL  47          HG21      VAL  47  88.825  -1.493   9.063
  389   HG22  VAL  47          HG22      VAL  47  88.110  -0.262  10.104
  390   HG23  VAL  47          HG23      VAL  47  87.323  -1.830   9.923
  391    H    GLN  48           HN       GLN  48  87.133  -2.901  11.850
  392    HA   GLN  48           HA       GLN  48  85.834  -5.073  10.324
  393    HB2  GLN  48           HB2      GLN  48  84.845  -6.046  12.391
  394    HB3  GLN  48           HB1      GLN  48  86.601  -6.212  12.360
  395    HG2  GLN  48           HG2      GLN  48  86.766  -4.122  13.735
  396    HG3  GLN  48           HG1      GLN  48  85.007  -4.120  13.867
  397   HE21  GLN  48          HE21      GLN  48  87.909  -5.447  15.198
  398   HE22  GLN  48          HE22      GLN  48  87.176  -6.562  16.247
  399    H    GLY  49           HN       GLY  49  85.618  -2.211  10.230
  400    HA2  GLY  49           HA2      GLY  49  82.764  -1.919  10.364
  401    HA3  GLY  49           HA1      GLY  49  83.517  -1.080  11.721
  402    H1U  RCY  50           H1U      RCY  50  79.091   0.672   6.967
  403    H1S  RCY  50           H1S      RCY  50  83.140  -1.833   6.126
  404    HB1  RCY  50           HB1      RCY  50  85.656   1.417   6.540
  405    HB2  RCY  50           HB2      RCY  50  84.057   1.263   7.267
  406    HA   RCY  50           HA       RCY  50  86.758   1.107   8.580
  407    HN1  RCY  50           HN1      RCY  50  85.962  -0.630   9.940
  408    H    GLY  51           HN       GLY  51  84.643   1.528  10.953
  409    HA2  GLY  51           HA2      GLY  51  83.527   4.137  10.396
  410    HA3  GLY  51           HA1      GLY  51  83.633   3.384  11.987
  411    H    ASP  52           HN       ASP  52  85.534   5.183   9.575
  412    HA   ASP  52           HA       ASP  52  87.888   5.576  11.073
  413    HB2  ASP  52           HB2      ASP  52  87.603   6.331   8.724
  414    HB3  ASP  52           HB1      ASP  52  86.509   7.599   9.279
  415    H    ASP  53           HN       ASP  53  84.735   6.518  11.835
  416    HA   ASP  53           HA       ASP  53  85.668   7.982  14.189
  417    HB2  ASP  53           HB2      ASP  53  84.130   9.378  11.982
  418    HB3  ASP  53           HB1      ASP  53  84.221   9.995  13.632
  419    H    ILE  54           HN       ILE  54  82.546   8.557  12.695
  420    HA   ILE  54           HA       ILE  54  81.293   6.551  14.522
  421    HB   ILE  54           HB       ILE  54  80.460   9.444  14.166
  422   HG12  ILE  54          HG12      ILE  54  81.263   7.953  16.678
  423   HG13  ILE  54          HG11      ILE  54  82.399   8.906  15.722
  424   HG21  ILE  54          HG21      ILE  54  79.143   7.094  15.543
  425   HG22  ILE  54          HG22      ILE  54  78.456   8.150  14.308
  426   HG23  ILE  54          HG23      ILE  54  78.744   8.767  15.935
  427   HD11  ILE  54          HD11      ILE  54  79.830   9.972  16.932
  428   HD12  ILE  54          HD12      ILE  54  81.027  10.910  16.039
  429   HD13  ILE  54          HD13      ILE  54  81.441  10.216  17.606
  430    HA   PRO  55           HA       PRO  55  79.408   6.161  10.373
  431    HB2  PRO  55           HB2      PRO  55  79.174   3.470  10.349
  432    HB3  PRO  55           HB1      PRO  55  80.729   4.276  10.063
  433    HG2  PRO  55           HG2      PRO  55  79.735   2.911  12.504
  434    HG3  PRO  55           HG1      PRO  55  81.369   2.971  11.827
  435    HD2  PRO  55           HD2      PRO  55  80.441   4.545  13.953
  436    HD3  PRO  55           HD1      PRO  55  81.894   4.875  12.985
  437    H    GLY  56           HN       GLY  56  77.293   5.076   9.672
  438    HA2  GLY  56           HA2      GLY  56  75.005   4.675   9.999
  439    HA3  GLY  56           HA1      GLY  56  75.419   4.099  11.613
  440    H    MET  57           HN       MET  57  76.354   7.315  10.643
  441    HA   MET  57           HA       MET  57  74.645   8.421  12.773
  442    HB2  MET  57           HB2      MET  57  75.835  10.541  12.282
  443    HB3  MET  57           HB1      MET  57  76.959   9.217  12.583
  444    HG2  MET  57           HG2      MET  57  76.065   9.853   9.776
  445    HG3  MET  57           HG1      MET  57  77.389  10.750  10.521
  446    HE1  MET  57           HE1      MET  57  79.556   9.743   8.900
  447    HE2  MET  57           HE2      MET  57  77.958   9.780   8.159
  448    HE3  MET  57           HE3      MET  57  78.972   8.350   7.981
  449    H    GLU  58           HN       GLU  58  73.572   7.374  10.126
  450    HA   GLU  58           HA       GLU  58  71.651   7.949   8.894
  451    HB2  GLU  58           HB2      GLU  58  70.346   9.678   9.605
  452    HB3  GLU  58           HB1      GLU  58  71.493   9.767  10.933
  453    HG2  GLU  58           HG2      GLU  58  71.619  11.962  10.217
  454    HG3  GLU  58           HG1      GLU  58  72.846  11.261   9.160
  455    H    GLY  59           HN       GLY  59  74.733   8.919   8.547
  456    HA2  GLY  59           HA2      GLY  59  74.899  10.923   6.638
  457    HA3  GLY  59           HA1      GLY  59  75.933   9.495   6.604
  458    H1U  RCY  60           H1U      RCY  60  76.488   2.330   6.901
  459    H1S  RCY  60           H1S      RCY  60  73.161   4.950   7.171
  460    HB1  RCY  60           HB1      RCY  60  73.746   5.798   4.421
  461    HB2  RCY  60           HB2      RCY  60  72.355   5.818   3.338
  462    HA   RCY  60           HA       RCY  60  73.374   8.019   3.313
  463    HN1  RCY  60           HN1      RCY  60  73.489   7.744   6.250
  464    H    GLY  61           HN       GLY  61  71.853   9.416   2.554
  465    HA2  GLY  61           HA2      GLY  61  69.311   9.742   4.052
  466    HA3  GLY  61           HA1      GLY  61  69.883  10.797   2.759
  467    H    THR  62           HN       THR  62  69.821   9.907   0.536
  468    HA   THR  62           HA       THR  62  67.322   8.533   0.035
  469    HB   THR  62           HB       THR  62  67.789   8.866  -2.269
  470    HG1  THR  62           HG1      THR  62  70.374   9.640  -2.131
  471   HG21  THR  62          HG21      THR  62  68.582  11.188  -2.381
  472   HG22  THR  62          HG22      THR  62  69.260  11.045  -0.759
  473   HG23  THR  62          HG23      THR  62  67.513  10.970  -0.995
  474    H    ASP  63           HN       ASP  63  67.462   6.444   0.971
  475    HA   ASP  63           HA       ASP  63  69.680   4.660   0.529
  476    HB2  ASP  63           HB2      ASP  63  68.126   2.895   1.325
  477    HB3  ASP  63           HB1      ASP  63  68.097   4.308   2.379
  478    H    ILE  64           HN       ILE  64  67.675   5.956  -1.680
  479    HA   ILE  64           HA       ILE  64  67.796   3.533  -3.438
  480    HB   ILE  64           HB       ILE  64  65.619   5.609  -3.127
  481   HG12  ILE  64          HG12      ILE  64  65.394   2.611  -3.433
  482   HG13  ILE  64          HG11      ILE  64  65.694   3.359  -1.864
  483   HG21  ILE  64          HG21      ILE  64  65.826   5.613  -5.462
  484   HG22  ILE  64          HG22      ILE  64  64.655   4.322  -5.193
  485   HG23  ILE  64          HG23      ILE  64  66.343   3.928  -5.515
  486   HD11  ILE  64          HD11      ILE  64  63.395   4.178  -3.652
  487   HD12  ILE  64          HD12      ILE  64  63.638   4.585  -1.954
  488   HD13  ILE  64          HD13      ILE  64  63.245   2.929  -2.416
  489    H    THR  65           HN       THR  65  68.271   6.977  -3.057
  490    HA   THR  65           HA       THR  65  69.245   8.570  -4.483
  491    HB   THR  65           HB       THR  65  70.714   6.052  -5.319
  492    HG1  THR  65           HG1      THR  65  70.747   7.604  -3.143
  493   HG21  THR  65          HG21      THR  65  71.392   7.413  -7.025
  494   HG22  THR  65          HG22      THR  65  72.450   8.077  -5.780
  495   HG23  THR  65          HG23      THR  65  70.932   8.885  -6.169
  496    H    VAL  66           HN       VAL  66  66.842   7.051  -5.436
  497    HA   VAL  66           HA       VAL  66  65.515   7.040  -7.364
  498    HB   VAL  66           HB       VAL  66  67.693   8.597  -8.761
  499   HG11  VAL  66          HG11      VAL  66  64.663   8.559  -8.918
  500   HG12  VAL  66          HG12      VAL  66  65.781   7.911 -10.119
  501   HG13  VAL  66          HG13      VAL  66  65.701   9.650  -9.837
  502   HG21  VAL  66          HG21      VAL  66  66.269  10.597  -7.816
  503   HG22  VAL  66          HG22      VAL  66  67.522   9.874  -6.808
  504   HG23  VAL  66          HG23      VAL  66  65.831   9.443  -6.556
  505    H    ILE  67           HN       ILE  67  68.956   6.321  -7.766
  506    HA   ILE  67           HA       ILE  67  68.162   4.101  -9.597
  507    HB   ILE  67           HB       ILE  67  70.528   5.962  -9.957
  508   HG12  ILE  67          HG12      ILE  67  68.181   5.426 -11.799
  509   HG13  ILE  67          HG11      ILE  67  68.234   6.782 -10.672
  510   HG21  ILE  67          HG21      ILE  67  71.233   3.761 -10.581
  511   HG22  ILE  67          HG22      ILE  67  70.798   4.575 -12.084
  512   HG23  ILE  67          HG23      ILE  67  69.688   3.414 -11.357
  513   HD11  ILE  67          HD11      ILE  67  69.013   7.570 -12.826
  514   HD12  ILE  67          HD12      ILE  67  70.157   6.234 -12.949
  515   HD13  ILE  67          HD13      ILE  67  70.399   7.493 -11.738
  516    H1U  RCY  68           H1U      RCY  68  73.999  -3.862  -5.570
  517    H1S  RCY  68           H1S      RCY  68  70.580  -1.102  -4.948
  518    HB1  RCY  68           HB1      RCY  68  68.654   0.902  -5.740
  519    HB2  RCY  68           HB2      RCY  68  68.955   2.569  -5.255
  520    HA   RCY  68           HA       RCY  68  71.111   2.360  -6.711
  521    HN1  RCY  68           HN1      RCY  68  68.380   2.628  -7.886
  522    HA   PRO  69           HA       PRO  69  72.350  -1.033  -9.262
  523    HB2  PRO  69           HB2      PRO  69  72.348  -2.462  -6.615
  524    HB3  PRO  69           HB1      PRO  69  73.536  -2.547  -7.933
  525    HG2  PRO  69           HG2      PRO  69  73.849  -0.971  -5.748
  526    HG3  PRO  69           HG1      PRO  69  74.530  -0.583  -7.334
  527    HD2  PRO  69           HD2      PRO  69  72.439   0.827  -5.886
  528    HD3  PRO  69           HD1      PRO  69  73.214   1.277  -7.422
  529    H    TRP  70           HN       TRP  70  69.928  -1.885  -6.729
  530    HA   TRP  70           HA       TRP  70  68.950  -4.150  -8.218
  531    HD1  TRP  70           HD1      TRP  70  70.483  -3.345  -5.388
  532    HE1  TRP  70           HE1      TRP  70  70.755  -1.611  -3.501
  533    HE3  TRP  70           HE3      TRP  70  65.742  -1.456  -5.238
  534    HZ2  TRP  70           HZ2      TRP  70  69.168   0.326  -2.109
  535    HZ3  TRP  70           HZ3      TRP  70  65.150   0.327  -3.628
  536    HH2  TRP  70           HH2      TRP  70  66.852   1.221  -2.064
  537    HB2  TRP  70           HB2      TRP  70  66.808  -3.208  -6.625
  538    HB3  TRP  70           HB1      TRP  70  67.933  -4.503  -6.236
  539    H    GLU  71           HN       GLU  71  69.154  -1.545  -9.708
  540    HA   GLU  71           HA       GLU  71  66.435  -1.673 -10.893
  541    HB2  GLU  71           HB2      GLU  71  67.805   0.885 -10.008
  542    HB3  GLU  71           HB1      GLU  71  66.368   0.825 -11.029
  543    HG2  GLU  71           HG2      GLU  71  65.191  -0.448  -9.231
  544    HG3  GLU  71           HG1      GLU  71  66.610  -0.246  -8.203
  545    H    ALA  72           HN       ALA  72  69.317   0.412 -11.315
  546    HA   ALA  72           HA       ALA  72  69.183   0.075 -14.207
  547    HB1  ALA  72           HB1      ALA  72  71.125   1.454 -12.349
  548    HB2  ALA  72           HB2      ALA  72  69.969   2.191 -13.458
  549    HB3  ALA  72           HB3      ALA  72  71.394   1.368 -14.090
  550    H1U  RCY  73           H1U      RCY  73  76.959  -0.351  -6.859
  551    H1S  RCY  73           H1S      RCY  73  76.684   0.247 -11.327
  552    HB1  RCY  73           HB1      RCY  73  74.937  -2.605 -12.285
  553    HB2  RCY  73           HB2      RCY  73  73.885  -1.763 -11.148
  554    HA   RCY  73           HA       RCY  73  73.319  -2.185 -14.097
  555    HN1  RCY  73           HN1      RCY  73  72.194  -0.250 -12.380
  556    H    ASN  74           HN       ASN  74  72.041  -2.826 -10.802
  557    HA   ASN  74           HA       ASN  74  71.248  -4.836  -9.879
  558    HB2  ASN  74           HB2      ASN  74  69.388  -5.726 -10.991
  559    HB3  ASN  74           HB1      ASN  74  69.479  -4.098 -11.660
  560   HD21  ASN  74          HD21      ASN  74  69.653  -3.942 -13.917
  561   HD22  ASN  74          HD22      ASN  74  70.022  -5.241 -14.945
  562    H    HIS  75           HN       HIS  75  73.827  -4.826 -11.615
  563    HA   HIS  75           HA       HIS  75  73.907  -7.718 -12.329
  564    HD1  HIS  75           HD1      HIS  75  77.721  -5.269 -14.212
  565    HD2  HIS  75           HD2      HIS  75  75.604  -4.669 -10.668
  566    HE1  HIS  75           HE1      HIS  75  78.994  -3.510 -12.908
  567    HE2  HIS  75           HE2      HIS  75  77.716  -3.136 -10.748
  568    HB2  HIS  75           HB2      HIS  75  75.926  -7.209 -13.535
  569    HB3  HIS  75           HB1      HIS  75  74.764  -5.941 -13.927
  570    H1U  RCY  76           H1U      RCY  76  76.705  -4.915  -0.405
  571    H1S  RCY  76           H1S      RCY  76  76.343  -4.349  -5.007
  572    HB1  RCY  76           HB1      RCY  76  74.415  -6.147  -6.997
  573    HB2  RCY  76           HB2      RCY  76  75.636  -5.180  -7.823
  574    HA   RCY  76           HA       RCY  76  76.669  -7.344  -8.629
  575    HN1  RCY  76           HN1      RCY  76  73.968  -6.499  -9.534
  576    H    GLU  77           HN       GLU  77  76.704  -9.558  -8.457
  577    HA   GLU  77           HA       GLU  77  74.549 -11.284  -7.987
  578    HB2  GLU  77           HB2      GLU  77  76.928 -11.946  -8.577
  579    HB3  GLU  77           HB1      GLU  77  77.330 -11.732  -6.872
  580    HG2  GLU  77           HG2      GLU  77  75.700 -13.419  -6.227
  581    HG3  GLU  77           HG1      GLU  77  75.148 -13.571  -7.895
  582    H    LEU  78           HN       LEU  78  73.371 -11.842  -6.201
  583    HA   LEU  78           HA       LEU  78  73.298 -10.201  -3.909
  584    HG   LEU  78           HG       LEU  78  71.298 -10.633  -5.248
  585    HB2  LEU  78           HB2      LEU  78  72.287 -12.975  -4.496
  586    HB3  LEU  78           HB1      LEU  78  72.100 -12.289  -2.883
  587   HD11  LEU  78          HD11      LEU  78  70.194 -12.723  -5.742
  588   HD12  LEU  78          HD12      LEU  78  68.993 -11.645  -5.033
  589   HD13  LEU  78          HD13      LEU  78  69.714 -12.925  -4.058
  590   HD21  LEU  78          HD21      LEU  78  71.336  -9.839  -2.825
  591   HD22  LEU  78          HD22      LEU  78  70.024 -10.977  -2.522
  592   HD23  LEU  78          HD23      LEU  78  69.793  -9.648  -3.658
  593    H    HIS  79           HN       HIS  79  73.344 -11.984  -1.709
  594    HA   HIS  79           HA       HIS  79  74.795 -13.139  -0.248
  595    HD1  HIS  79           HD1      HIS  79  76.555 -13.592   1.036
  596    HD2  HIS  79           HD2      HIS  79  77.228 -16.375  -1.998
  597    HE1  HIS  79           HE1      HIS  79  77.371 -15.705   2.170
  598    HE2  HIS  79           HE2      HIS  79  77.784 -17.407   0.334
  599    HB2  HIS  79           HB2      HIS  79  75.797 -13.971  -2.613
  600    HB3  HIS  79           HB1      HIS  79  77.142 -12.957  -2.091
  601    H    GLU  80           HN       GLU  80  74.889 -11.416   1.190
  602    HA   GLU  80           HA       GLU  80  76.354  -8.991   0.706
  603    HB2  GLU  80           HB2      GLU  80  75.339 -10.297   3.242
  604    HB3  GLU  80           HB1      GLU  80  76.143  -8.726   3.229
  605    HG2  GLU  80           HG2      GLU  80  74.450  -7.808   1.752
  606    HG3  GLU  80           HG1      GLU  80  73.694  -9.392   1.572
  607    H    LEU  81           HN       LEU  81  77.207 -12.057   2.275
  608    HA   LEU  81           HA       LEU  81  79.684 -11.232   3.404
  609    HG   LEU  81           HG       LEU  81  78.523 -14.464   4.704
  610    HB2  LEU  81           HB2      LEU  81  78.912 -13.940   2.268
  611    HB3  LEU  81           HB1      LEU  81  80.312 -13.639   3.290
  612   HD11  LEU  81          HD11      LEU  81  79.953 -12.340   5.321
  613   HD12  LEU  81          HD12      LEU  81  78.598 -12.809   6.347
  614   HD13  LEU  81          HD13      LEU  81  78.409 -11.501   5.180
  615   HD21  LEU  81          HD21      LEU  81  76.784 -13.537   2.932
  616   HD22  LEU  81          HD22      LEU  81  76.774 -12.132   3.997
  617   HD23  LEU  81          HD23      LEU  81  76.321 -13.717   4.624
  618    H    ALA  82           HN       ALA  82  78.807 -11.011   0.256
  619    HA   ALA  82           HA       ALA  82  81.119 -12.037  -1.110
  620    HB1  ALA  82           HB1      ALA  82  79.245 -11.603  -2.478
  621    HB2  ALA  82           HB2      ALA  82  80.357 -10.295  -2.875
  622    HB3  ALA  82           HB3      ALA  82  79.002  -9.999  -1.789
  623    H    GLN  83           HN       GLN  83  82.479 -11.000   0.849
  624    HA   GLN  83           HA       GLN  83  83.067  -8.286   1.033
  625    HB2  GLN  83           HB2      GLN  83  84.274 -10.681   1.898
  626    HB3  GLN  83           HB1      GLN  83  85.539  -9.836   1.009
  627    HG2  GLN  83           HG2      GLN  83  83.876  -8.689   3.272
  628    HG3  GLN  83           HG1      GLN  83  85.578  -9.144   3.359
  629   HE21  GLN  83          HE21      GLN  83  86.340  -8.105   0.740
  630   HE22  GLN  83          HE22      GLN  83  86.261  -6.411   0.829
  631    H    TYR  84           HN       TYR  84  83.729 -10.463  -1.601
  632    HA   TYR  84           HA       TYR  84  84.694  -8.187  -3.213
  633    HD1  TYR  84           HD1      TYR  84  86.801  -7.011  -3.457
  634    HD2  TYR  84           HD2      TYR  84  87.398 -10.170  -0.608
  635    HE1  TYR  84           HE1      TYR  84  88.052  -5.451  -1.989
  636    HE2  TYR  84           HE2      TYR  84  88.648  -8.610   0.859
  637    HH   TYR  84           HH       TYR  84  90.057  -6.292   0.298
  638    HB2  TYR  84           HB2      TYR  84  86.359 -10.649  -2.645
  639    HB3  TYR  84           HB1      TYR  84  86.658  -9.589  -4.024
  640    H    GLY  85           HN       GLY  85  82.326 -10.041  -3.198
  641    HA2  GLY  85           HA2      GLY  85  82.416 -12.060  -5.131
  642    HA3  GLY  85           HA1      GLY  85  81.017 -11.004  -4.913
  643    H    ILE  86           HN       ILE  86  82.096  -8.556  -5.649
  644    HA   ILE  86           HA       ILE  86  83.113  -8.968  -8.422
  645    HB   ILE  86           HB       ILE  86  80.840  -7.089  -7.707
  646   HG12  ILE  86          HG12      ILE  86  79.725  -8.881  -9.381
  647   HG13  ILE  86          HG11      ILE  86  80.907  -9.932  -8.600
  648   HG21  ILE  86          HG21      ILE  86  82.269  -6.410  -9.621
  649   HG22  ILE  86          HG22      ILE  86  80.643  -6.850 -10.143
  650   HG23  ILE  86          HG23      ILE  86  81.979  -7.978 -10.376
  651   HD11  ILE  86          HD11      ILE  86  79.154 -10.148  -7.107
  652   HD12  ILE  86          HD12      ILE  86  78.551  -8.520  -7.418
  653   HD13  ILE  86          HD13      ILE  86  79.973  -8.754  -6.402
  654    H1U  RCY  87           H1U      RCY  87  80.453  -3.979  -2.181
  655    H1S  RCY  87           H1S      RCY  87  83.686  -3.094  -4.880
  656    HB1  RCY  87           HB1      RCY  87  81.983  -3.594  -7.292
  657    HB2  RCY  87           HB2      RCY  87  82.993  -3.349  -8.716
  658    HA   RCY  87           HA       RCY  87  84.709  -4.747  -7.869
  659    HN1  RCY  87           HN1      RCY  87  82.058  -5.828  -7.849
  Start of MODEL   43
    1    HA   MET   1           HA       MET   1  68.038 -12.086 -16.388
    2    HB2  MET   1           HB2      MET   1  70.597 -11.717 -16.387
    3    HB3  MET   1           HB1      MET   1  70.230 -10.079 -16.932
    4    HG2  MET   1           HG2      MET   1  70.352  -9.943 -14.554
    5    HG3  MET   1           HG1      MET   1  68.630  -9.931 -14.938
    6    HE1  MET   1           HE1      MET   1  67.047 -11.340 -13.456
    7    HE2  MET   1           HE2      MET   1  68.216 -10.356 -12.578
    8    HE3  MET   1           HE3      MET   1  67.857 -11.991 -12.025
    9    H    ASN   2           HN       ASN   2  68.207 -10.424 -19.379
   10    HA   ASN   2           HA       ASN   2  66.980  -8.615 -20.233
   11    HB2  ASN   2           HB2      ASN   2  65.154  -8.969 -17.851
   12    HB3  ASN   2           HB1      ASN   2  64.739  -8.406 -19.470
   13   HD21  ASN   2          HD21      ASN   2  64.621 -11.126 -17.487
   14   HD22  ASN   2          HD22      ASN   2  64.494 -12.318 -18.689
   15    H    LEU   3           HN       LEU   3  65.894  -6.408 -19.354
   16    HA   LEU   3           HA       LEU   3  68.017  -4.968 -18.064
   17    HG   LEU   3           HG       LEU   3  66.193  -2.823 -20.369
   18    HB2  LEU   3           HB2      LEU   3  65.155  -4.297 -18.754
   19    HB3  LEU   3           HB1      LEU   3  66.167  -3.157 -17.869
   20   HD11  LEU   3          HD11      LEU   3  68.400  -2.153 -20.320
   21   HD12  LEU   3          HD12      LEU   3  68.954  -3.668 -19.607
   22   HD13  LEU   3          HD13      LEU   3  68.166  -2.455 -18.598
   23   HD21  LEU   3          HD21      LEU   3  67.225  -4.433 -21.788
   24   HD22  LEU   3          HD22      LEU   3  66.125  -5.364 -20.772
   25   HD23  LEU   3          HD23      LEU   3  67.853  -5.350 -20.418
   26    H    GLU   4           HN       GLU   4  64.872  -4.364 -16.720
   27    HA   GLU   4           HA       GLU   4  65.913  -4.670 -14.025
   28    HB2  GLU   4           HB2      GLU   4  63.136  -4.100 -15.090
   29    HB3  GLU   4           HB1      GLU   4  63.535  -4.130 -13.372
   30    HG2  GLU   4           HG2      GLU   4  65.286  -2.391 -13.801
   31    HG3  GLU   4           HG1      GLU   4  64.728  -2.297 -15.472
   32    HA   PRO   5           HA       PRO   5  65.286  -9.110 -13.726
   33    HB2  PRO   5           HB2      PRO   5  64.674  -8.319 -10.896
   34    HB3  PRO   5           HB1      PRO   5  65.712  -9.627 -11.498
   35    HG2  PRO   5           HG2      PRO   5  66.727  -7.330 -10.588
   36    HG3  PRO   5           HG1      PRO   5  67.467  -8.213 -11.933
   37    HD2  PRO   5           HD2      PRO   5  65.962  -5.657 -11.979
   38    HD3  PRO   5           HD1      PRO   5  67.153  -6.285 -13.138
   39    HA   PRO   6           HA       PRO   6  60.846  -9.430 -13.900
   40    HB2  PRO   6           HB2      PRO   6  60.521 -12.111 -13.538
   41    HB3  PRO   6           HB1      PRO   6  61.201 -11.423 -15.026
   42    HG2  PRO   6           HG2      PRO   6  62.606 -12.672 -12.717
   43    HG3  PRO   6           HG1      PRO   6  62.927 -12.827 -14.453
   44    HD2  PRO   6           HD2      PRO   6  64.379 -11.184 -12.796
   45    HD3  PRO   6           HD1      PRO   6  64.166 -10.877 -14.534
   46    H    LYS   7           HN       LYS   7  59.166  -9.204 -12.438
   47    HA   LYS   7           HA       LYS   7  59.732  -9.364  -9.601
   48    HB2  LYS   7           HB2      LYS   7  57.081  -9.017 -11.038
   49    HB3  LYS   7           HB1      LYS   7  57.367  -8.721  -9.323
   50    HG2  LYS   7           HG2      LYS   7  59.203  -7.086 -10.089
   51    HG3  LYS   7           HG1      LYS   7  58.467  -7.201 -11.689
   52    HD2  LYS   7           HD2      LYS   7  57.104  -6.301  -9.135
   53    HD3  LYS   7           HD1      LYS   7  57.508  -5.292 -10.523
   54    HE2  LYS   7           HE2      LYS   7  55.230  -5.792 -10.861
   55    HE3  LYS   7           HE1      LYS   7  56.061  -6.961 -11.887
   56    HZ1  LYS   7           HZ1      LYS   7  54.239  -7.558  -9.971
   57    HZ2  LYS   7           HZ2      LYS   7  55.714  -7.868  -9.187
   58    HZ3  LYS   7           HZ3      LYS   7  55.346  -8.650 -10.650
   59    H    ALA   8           HN       ALA   8  58.234 -10.654  -8.114
   60    HA   ALA   8           HA       ALA   8  56.988 -13.055  -9.170
   61    HB1  ALA   8           HB1      ALA   8  58.560 -14.661  -8.111
   62    HB2  ALA   8           HB2      ALA   8  59.634 -13.321  -7.709
   63    HB3  ALA   8           HB3      ALA   8  59.336 -13.736  -9.397
   64    H    GLU   9           HN       GLU   9  58.646 -13.486  -6.193
   65    HA   GLU   9           HA       GLU   9  56.724 -12.162  -4.476
   66    HB2  GLU   9           HB2      GLU   9  55.828 -14.386  -3.549
   67    HB3  GLU   9           HB1      GLU   9  55.183 -13.866  -5.106
   68    HG2  GLU   9           HG2      GLU   9  56.729 -15.336  -6.286
   69    HG3  GLU   9           HG1      GLU   9  57.498 -15.794  -4.767
   70    H1U  RCY  10           H1U      RCY  10  59.428 -13.879   6.458
   71    H1S  RCY  10           H1S      RCY  10  58.019 -14.252   2.528
   72    HB1  RCY  10           HB1      RCY  10  58.725 -11.283  -0.688
   73    HB2  RCY  10           HB2      RCY  10  59.902 -12.178   0.269
   74    HA   RCY  10           HA       RCY  10  60.079 -13.202  -1.833
   75    HN1  RCY  10           HN1      RCY  10  57.241 -12.538  -2.194
   76    H    ARG  11           HN       ARG  11  56.931 -14.482  -0.780
   77    HA   ARG  11           HA       ARG  11  56.379 -16.537   0.208
   78    HE   ARG  11           HE       ARG  11  55.532 -19.725  -2.463
   79    HB2  ARG  11           HB2      ARG  11  57.129 -17.445  -1.905
   80    HB3  ARG  11           HB1      ARG  11  58.818 -17.312  -1.419
   81    HG2  ARG  11           HG2      ARG  11  58.687 -19.115   0.040
   82    HG3  ARG  11           HG1      ARG  11  56.953 -18.912   0.297
   83    HD2  ARG  11           HD2      ARG  11  57.885 -19.602  -2.458
   84    HD3  ARG  11           HD1      ARG  11  57.898 -20.876  -1.238
   85   HH11  ARG  11          HH21      ARG  11  56.894 -21.114   0.384
   86   HH12  ARG  11          HH22      ARG  11  55.380 -21.711   0.977
   87   HH21  ARG  11          HH11      ARG  11  53.547 -20.498  -1.704
   88   HH22  ARG  11          HH12      ARG  11  53.486 -21.363  -0.205
   89    H    SER  12           HN       SER  12  58.889 -14.751   1.207
   90    HA   SER  12           HA       SER  12  59.924 -16.765   3.154
   91    HG   SER  12           HG       SER  12  61.433 -15.157   4.611
   92    HB2  SER  12           HB2      SER  12  61.568 -15.424   1.807
   93    HB3  SER  12           HB1      SER  12  60.948 -13.969   2.582
   94    H    ALA  13           HN       ALA  13  58.256 -13.658   2.905
   95    HA   ALA  13           HA       ALA  13  57.214 -12.347   4.559
   96    HB1  ALA  13           HB1      ALA  13  56.786 -14.998   5.952
   97    HB2  ALA  13           HB2      ALA  13  55.868 -14.520   4.524
   98    HB3  ALA  13           HB3      ALA  13  55.754 -13.569   6.006
   99    H    THR  14           HN       THR  14  60.005 -12.481   4.884
  100    HA   THR  14           HA       THR  14  60.692 -13.208   7.612
  101    HB   THR  14           HB       THR  14  62.214 -11.305   5.816
  102    HG1  THR  14           HG1      THR  14  62.196 -12.981   4.529
  103   HG21  THR  14          HG21      THR  14  64.133 -12.070   7.066
  104   HG22  THR  14          HG22      THR  14  63.171 -13.304   7.880
  105   HG23  THR  14          HG23      THR  14  62.891 -11.597   8.226
  106    H    ARG  15           HN       ARG  15  58.694 -11.899   8.394
  107    HA   ARG  15           HA       ARG  15  58.596  -9.081   8.375
  108    HE   ARG  15           HE       ARG  15  54.048  -8.837  10.149
  109    HB2  ARG  15           HB2      ARG  15  56.850 -10.661   9.306
  110    HB3  ARG  15           HB1      ARG  15  57.863 -10.825  10.741
  111    HG2  ARG  15           HG2      ARG  15  57.763  -8.372  11.078
  112    HG3  ARG  15           HG1      ARG  15  56.711  -8.232   9.670
  113    HD2  ARG  15           HD2      ARG  15  56.026 -10.019  12.009
  114    HD3  ARG  15           HD1      ARG  15  55.548  -8.322  11.955
  115   HH11  ARG  15          HH21      ARG  15  55.975 -11.489  11.217
  116   HH12  ARG  15          HH22      ARG  15  55.025 -12.682  10.397
  117   HH21  ARG  15          HH11      ARG  15  52.795 -10.380   9.073
  118   HH22  ARG  15          HH12      ARG  15  53.224 -12.055   9.183
  119    H    VAL  16           HN       VAL  16  60.037 -11.160  10.916
  120    HA   VAL  16           HA       VAL  16  61.624  -8.807  11.832
  121    HB   VAL  16           HB       VAL  16  60.306 -10.050  13.536
  122   HG11  VAL  16          HG11      VAL  16  60.800 -12.338  14.064
  123   HG12  VAL  16          HG12      VAL  16  62.191 -12.353  12.980
  124   HG13  VAL  16          HG13      VAL  16  60.558 -12.270  12.318
  125   HG21  VAL  16          HG21      VAL  16  63.276 -10.531  13.899
  126   HG22  VAL  16          HG22      VAL  16  62.078 -10.219  15.156
  127   HG23  VAL  16          HG23      VAL  16  62.535  -8.936  14.036
  128    H    MET  17           HN       MET  17  63.877  -8.855  11.753
  129    HA   MET  17           HA       MET  17  65.043 -10.958  10.035
  130    HB2  MET  17           HB2      MET  17  65.454  -8.349   9.935
  131    HB3  MET  17           HB1      MET  17  66.641  -8.691  11.192
  132    HG2  MET  17           HG2      MET  17  66.523 -10.031   8.473
  133    HG3  MET  17           HG1      MET  17  67.678  -8.788   8.954
  134    HE1  MET  17           HE1      MET  17  68.410 -11.613   7.757
  135    HE2  MET  17           HE2      MET  17  67.003 -12.357   8.512
  136    HE3  MET  17           HE3      MET  17  68.617 -12.946   8.900
  137    H    GLY  18           HN       GLY  18  66.476  -9.329  12.872
  138    HA2  GLY  18           HA2      GLY  18  67.403 -12.014  13.794
  139    HA3  GLY  18           HA1      GLY  18  68.200 -10.489  14.185
  140    H    GLY  19           HN       GLY  19  65.271 -12.401  14.802
  141    HA2  GLY  19           HA2      GLY  19  63.751 -12.308  16.595
  142    HA3  GLY  19           HA1      GLY  19  65.193 -11.996  17.563
  143    HA   PRO  20           HA       PRO  20  62.234  -8.390  18.051
  144    HB2  PRO  20           HB2      PRO  20  63.929  -8.295  20.518
  145    HB3  PRO  20           HB1      PRO  20  62.177  -8.070  20.344
  146    HG2  PRO  20           HG2      PRO  20  63.202 -10.328  21.314
  147    HG3  PRO  20           HG1      PRO  20  61.759 -10.329  20.286
  148    HD2  PRO  20           HD2      PRO  20  64.540 -11.175  19.621
  149    HD3  PRO  20           HD1      PRO  20  62.995 -11.753  18.959
  150    H1U  RCY  21           H1U      RCY  21  63.810  -3.018  10.167
  151    H1S  RCY  21           H1S      RCY  21  64.619  -4.680  13.747
  152    HB1  RCY  21           HB1      RCY  21  65.083  -6.660  14.648
  153    HB2  RCY  21           HB2      RCY  21  66.415  -6.996  15.754
  154    HA   RCY  21           HA       RCY  21  65.530  -5.457  17.394
  155    HN1  RCY  21           HN1      RCY  21  63.163  -7.030  16.480
  156    H    THR  22           HN       THR  22  64.833  -3.387  17.574
  157    HA   THR  22           HA       THR  22  62.423  -2.461  16.259
  158    HB   THR  22           HB       THR  22  63.145  -1.595  18.467
  159    HG1  THR  22           HG1      THR  22  61.935  -0.070  17.659
  160   HG21  THR  22          HG21      THR  22  65.326  -0.130  16.973
  161   HG22  THR  22          HG22      THR  22  65.614  -1.656  17.808
  162   HG23  THR  22          HG23      THR  22  65.090  -0.239  18.718
  163    HA   PRO  23           HA       PRO  23  63.832  -1.222  12.244
  164    HB2  PRO  23           HB2      PRO  23  62.699   1.443  13.042
  165    HB3  PRO  23           HB1      PRO  23  62.474   0.532  11.535
  166    HG2  PRO  23           HG2      PRO  23  60.620   0.576  13.476
  167    HG3  PRO  23           HG1      PRO  23  60.883  -0.838  12.443
  168    HD2  PRO  23           HD2      PRO  23  61.489  -0.500  15.310
  169    HD3  PRO  23           HD1      PRO  23  61.344  -1.994  14.360
  170    H    ARG  24           HN       ARG  24  64.131   1.608  14.429
  171    HA   ARG  24           HA       ARG  24  67.057   1.538  14.213
  172    HE   ARG  24           HE       ARG  24  65.920   6.078  13.178
  173    HB2  ARG  24           HB2      ARG  24  66.981   4.006  13.366
  174    HB3  ARG  24           HB1      ARG  24  66.773   2.707  12.192
  175    HG2  ARG  24           HG2      ARG  24  64.346   2.950  12.292
  176    HG3  ARG  24           HG1      ARG  24  64.495   4.173  13.555
  177    HD2  ARG  24           HD2      ARG  24  65.830   4.508  10.867
  178    HD3  ARG  24           HD1      ARG  24  64.164   5.018  11.142
  179   HH11  ARG  24          HH21      ARG  24  64.880   6.377   9.904
  180   HH12  ARG  24          HH22      ARG  24  65.220   8.072   9.811
  181   HH21  ARG  24          HH11      ARG  24  66.370   8.291  13.075
  182   HH22  ARG  24          HH12      ARG  24  66.063   9.156  11.606
  183    H    LYS  25           HN       LYS  25  67.832   2.229  16.148
  184    HA   LYS  25           HA       LYS  25  66.089   3.236  18.195
  185    HB2  LYS  25           HB2      LYS  25  69.088   3.554  18.237
  186    HB3  LYS  25           HB1      LYS  25  67.994   3.250  19.588
  187    HG2  LYS  25           HG2      LYS  25  67.453   1.019  18.492
  188    HG3  LYS  25           HG1      LYS  25  68.802   1.325  17.398
  189    HD2  LYS  25           HD2      LYS  25  68.939   1.136  20.421
  190    HD3  LYS  25           HD1      LYS  25  69.594  -0.024  19.265
  191    HE2  LYS  25           HE2      LYS  25  70.927   2.007  18.330
  192    HE3  LYS  25           HE1      LYS  25  70.547   2.768  19.875
  193    HZ1  LYS  25           HZ1      LYS  25  72.206   1.633  20.766
  194    HZ2  LYS  25           HZ2      LYS  25  72.499   0.820  19.303
  195    HZ3  LYS  25           HZ3      LYS  25  71.394   0.182  20.425
  196    H    GLY  26           HN       GLY  26  68.899   4.881  16.686
  197    HA2  GLY  26           HA2      GLY  26  67.321   7.394  16.627
  198    HA3  GLY  26           HA1      GLY  26  68.828   7.401  17.543
  199    HA   PRO  27           HA       PRO  27  69.900   8.405  13.157
  200    HB2  PRO  27           HB2      PRO  27  71.313  10.674  13.660
  201    HB3  PRO  27           HB1      PRO  27  69.545  10.665  13.510
  202    HG2  PRO  27           HG2      PRO  27  71.233  10.775  15.951
  203    HG3  PRO  27           HG1      PRO  27  69.690  11.572  15.605
  204    HD2  PRO  27           HD2      PRO  27  69.966   9.269  17.141
  205    HD3  PRO  27           HD1      PRO  27  68.462   9.778  16.343
  206    HA   PRO  28           HA       PRO  28  73.898   6.560  12.837
  207    HB2  PRO  28           HB2      PRO  28  74.846   9.205  11.776
  208    HB3  PRO  28           HB1      PRO  28  75.121   7.573  11.135
  209    HG2  PRO  28           HG2      PRO  28  73.290   9.234  10.092
  210    HG3  PRO  28           HG1      PRO  28  73.072   7.477  10.125
  211    HD2  PRO  28           HD2      PRO  28  71.645   9.550  11.662
  212    HD3  PRO  28           HD1      PRO  28  71.186   7.861  11.357
  213    H    LYS  29           HN       LYS  29  75.586   6.314  14.271
  214    HA   LYS  29           HA       LYS  29  76.309   8.661  15.987
  215    HB2  LYS  29           HB2      LYS  29  76.900   6.594  17.620
  216    HB3  LYS  29           HB1      LYS  29  75.317   7.366  17.610
  217    HG2  LYS  29           HG2      LYS  29  75.020   4.950  17.465
  218    HG3  LYS  29           HG1      LYS  29  74.550   5.680  15.929
  219    HD2  LYS  29           HD2      LYS  29  76.703   5.105  14.945
  220    HD3  LYS  29           HD1      LYS  29  77.280   4.487  16.493
  221    HE2  LYS  29           HE2      LYS  29  74.846   3.382  15.072
  222    HE3  LYS  29           HE1      LYS  29  76.465   2.709  14.880
  223    HZ1  LYS  29           HZ1      LYS  29  75.526   3.134  17.606
  224    HZ2  LYS  29           HZ2      LYS  29  76.472   1.877  16.964
  225    HZ3  LYS  29           HZ3      LYS  29  74.788   1.878  16.737
  226    H1U  RCY  30           H1U      RCY  30  82.157   9.033   7.466
  227    H1S  RCY  30           H1S      RCY  30  82.587   6.375  10.495
  228    HB1  RCY  30           HB1      RCY  30  79.733   8.068  12.067
  229    HB2  RCY  30           HB2      RCY  30  79.199   6.525  12.733
  230    HA   RCY  30           HA       RCY  30  80.365   7.257  14.908
  231    HN1  RCY  30           HN1      RCY  30  77.980   8.915  14.241
  232    H    LYS  31           HN       LYS  31  82.288   8.427  13.477
  233    HA   LYS  31           HA       LYS  31  82.250  11.224  14.469
  234    HB2  LYS  31           HB2      LYS  31  84.157   9.792  15.091
  235    HB3  LYS  31           HB1      LYS  31  84.514   9.519  13.388
  236    HG2  LYS  31           HG2      LYS  31  84.318  12.328  13.721
  237    HG3  LYS  31           HG1      LYS  31  85.309  11.734  15.054
  238    HD2  LYS  31           HD2      LYS  31  85.780  10.879  12.193
  239    HD3  LYS  31           HD1      LYS  31  86.556  12.301  12.891
  240    HE2  LYS  31           HE2      LYS  31  87.612  10.958  14.608
  241    HE3  LYS  31           HE1      LYS  31  86.715   9.527  14.101
  242    HZ1  LYS  31           HZ1      LYS  31  87.826   9.630  11.960
  243    HZ2  LYS  31           HZ2      LYS  31  88.962   9.519  13.219
  244    HZ3  LYS  31           HZ3      LYS  31  88.689  11.008  12.447
  245    H    GLN  32           HN       GLN  32  80.683  11.672  12.601
  246    HA   GLN  32           HA       GLN  32  80.290  12.666  10.516
  247    HB2  GLN  32           HB2      GLN  32  83.277  13.118  10.389
  248    HB3  GLN  32           HB1      GLN  32  81.998  14.096   9.671
  249    HG2  GLN  32           HG2      GLN  32  81.179  14.637  11.970
  250    HG3  GLN  32           HG1      GLN  32  82.559  13.760  12.631
  251   HE21  GLN  32          HE21      GLN  32  84.771  14.614  11.982
  252   HE22  GLN  32          HE22      GLN  32  84.937  16.273  11.664
  253    H    ARG  33           HN       ARG  33  80.450  12.219   8.239
  254    HA   ARG  33           HA       ARG  33  81.670   9.561   7.669
  255    HE   ARG  33           HE       ARG  33  77.922  11.492   7.294
  256    HB2  ARG  33           HB2      ARG  33  79.475  11.188   6.385
  257    HB3  ARG  33           HB1      ARG  33  80.250   9.873   5.505
  258    HG2  ARG  33           HG2      ARG  33  78.309   8.954   6.608
  259    HG3  ARG  33           HG1      ARG  33  79.732   8.368   7.470
  260    HD2  ARG  33           HD2      ARG  33  77.881   9.218   8.968
  261    HD3  ARG  33           HD1      ARG  33  79.440  10.004   9.216
  262   HH11  ARG  33          HH21      ARG  33  78.089  10.656  10.634
  263   HH12  ARG  33          HH22      ARG  33  77.341  12.122  11.175
  264   HH21  ARG  33          HH11      ARG  33  76.944  13.411   7.981
  265   HH22  ARG  33          HH12      ARG  33  76.693  13.681   9.673
  266    H    GLN  34           HN       GLN  34  83.743  11.108   7.756
  267    HA   GLN  34           HA       GLN  34  84.650  11.357   5.017
  268    HB2  GLN  34           HB2      GLN  34  83.274  13.454   5.315
  269    HB3  GLN  34           HB1      GLN  34  84.403  13.941   6.580
  270    HG2  GLN  34           HG2      GLN  34  86.261  13.889   4.994
  271    HG3  GLN  34           HG1      GLN  34  85.190  13.297   3.723
  272   HE21  GLN  34          HE21      GLN  34  84.647  15.902   6.153
  273   HE22  GLN  34          HE22      GLN  34  84.354  17.116   5.004
  274    H    THR  35           HN       THR  35  86.248   9.941   6.012
  275    HA   THR  35           HA       THR  35  88.553  11.396   7.011
  276    HB   THR  35           HB       THR  35  87.503   9.320   8.926
  277    HG1  THR  35           HG1      THR  35  85.909  10.651   9.258
  278   HG21  THR  35          HG21      THR  35  88.963  10.426  10.478
  279   HG22  THR  35          HG22      THR  35  89.190  11.790   9.383
  280   HG23  THR  35          HG23      THR  35  89.875  10.214   8.983
  281    H    ARG  36           HN       ARG  36  87.208   8.971   5.309
  282    HA   ARG  36           HA       ARG  36  89.777   7.582   5.024
  283    HE   ARG  36           HE       ARG  36  87.825   4.032   7.924
  284    HB2  ARG  36           HB2      ARG  36  88.829   6.340   6.895
  285    HB3  ARG  36           HB1      ARG  36  87.307   6.134   6.028
  286    HG2  ARG  36           HG2      ARG  36  88.184   4.557   4.576
  287    HG3  ARG  36           HG1      ARG  36  89.822   5.203   4.699
  288    HD2  ARG  36           HD2      ARG  36  89.650   3.027   5.849
  289    HD3  ARG  36           HD1      ARG  36  89.999   4.319   6.998
  290   HH11  ARG  36          HH21      ARG  36  88.305   2.282   4.993
  291   HH12  ARG  36          HH22      ARG  36  86.851   1.353   5.154
  292   HH21  ARG  36          HH11      ARG  36  85.925   2.829   8.151
  293   HH22  ARG  36          HH12      ARG  36  85.504   1.663   6.942
  294    H    GLN  37           HN       GLN  37  86.663   8.483   3.931
  295    HA   GLN  37           HA       GLN  37  85.559   8.175   1.877
  296    HB2  GLN  37           HB2      GLN  37  88.314   7.777   0.709
  297    HB3  GLN  37           HB1      GLN  37  86.921   8.585  -0.010
  298    HG2  GLN  37           HG2      GLN  37  87.326  10.019   2.326
  299    HG3  GLN  37           HG1      GLN  37  88.969   9.661   1.791
  300   HE21  GLN  37          HE21      GLN  37  89.790  11.111   0.279
  301   HE22  GLN  37          HE22      GLN  37  88.853  12.083  -0.750
  302    H1U  RCY  38           H1U      RCY  38  83.033   2.429   0.259
  303    H1S  RCY  38           H1S      RCY  38  82.749   3.723   3.533
  304    HB1  RCY  38           HB1      RCY  38  84.459   2.881   0.360
  305    HB2  RCY  38           HB2      RCY  38  83.747   4.400  -0.183
  306    HA   RCY  38           HA       RCY  38  86.640   3.884   0.550
  307    HN1  RCY  38           HN1      RCY  38  85.798   6.588  -0.268
  308    H    LYS  39           HN       LYS  39  86.979   2.538  -1.214
  309    HA   LYS  39           HA       LYS  39  85.921   2.966  -3.847
  310    HB2  LYS  39           HB2      LYS  39  87.599   4.920  -3.541
  311    HB3  LYS  39           HB1      LYS  39  88.850   3.683  -3.628
  312    HG2  LYS  39           HG2      LYS  39  88.672   4.253  -5.873
  313    HG3  LYS  39           HG1      LYS  39  87.504   2.934  -5.787
  314    HD2  LYS  39           HD2      LYS  39  86.447   4.774  -6.943
  315    HD3  LYS  39           HD1      LYS  39  85.714   4.655  -5.342
  316    HE2  LYS  39           HE2      LYS  39  86.672   6.978  -6.365
  317    HE3  LYS  39           HE1      LYS  39  86.613   6.634  -4.636
  318    HZ1  LYS  39           HZ1      LYS  39  88.883   5.677  -4.875
  319    HZ2  LYS  39           HZ2      LYS  39  88.798   7.350  -5.156
  320    HZ3  LYS  39           HZ3      LYS  39  88.921   6.272  -6.464
  321    H    SER  40           HN       SER  40  88.794   2.089  -4.827
  322    HA   SER  40           HA       SER  40  88.301  -0.723  -4.800
  323    HG   SER  40           HG       SER  40  92.082   0.502  -5.306
  324    HB2  SER  40           HB2      SER  40  90.559  -0.955  -5.672
  325    HB3  SER  40           HB1      SER  40  89.846   0.485  -6.390
  326    H    LYS  41           HN       LYS  41  91.465  -0.110  -3.607
  327    HA   LYS  41           HA       LYS  41  90.682  -0.544  -0.796
  328    HB2  LYS  41           HB2      LYS  41  91.956  -2.560  -0.488
  329    HB3  LYS  41           HB1      LYS  41  90.870  -2.832  -1.843
  330    HG2  LYS  41           HG2      LYS  41  93.835  -2.217  -1.948
  331    HG3  LYS  41           HG1      LYS  41  93.013  -3.660  -2.542
  332    HD2  LYS  41           HD2      LYS  41  91.738  -2.130  -4.131
  333    HD3  LYS  41           HD1      LYS  41  92.868  -0.856  -3.669
  334    HE2  LYS  41           HE2      LYS  41  94.759  -2.270  -4.395
  335    HE3  LYS  41           HE1      LYS  41  93.627  -3.537  -4.868
  336    HZ1  LYS  41           HZ1      LYS  41  93.198  -0.854  -5.945
  337    HZ2  LYS  41           HZ2      LYS  41  92.911  -2.369  -6.658
  338    HZ3  LYS  41           HZ3      LYS  41  94.492  -1.752  -6.574
  339    HA   PRO  42           HA       PRO  42  94.496   1.958  -1.083
  340    HB2  PRO  42           HB2      PRO  42  93.450   4.400  -0.774
  341    HB3  PRO  42           HB1      PRO  42  93.279   3.543  -2.320
  342    HG2  PRO  42           HG2      PRO  42  91.261   4.075  -0.242
  343    HG3  PRO  42           HG1      PRO  42  91.053   3.791  -1.976
  344    HD2  PRO  42           HD2      PRO  42  90.792   1.876   0.193
  345    HD3  PRO  42           HD1      PRO  42  90.496   1.620  -1.543
  346    HA   PRO  43           HA       PRO  43  94.766   2.450   3.361
  347    HB2  PRO  43           HB2      PRO  43  96.872   4.139   3.602
  348    HB3  PRO  43           HB1      PRO  43  97.070   2.477   3.010
  349    HG2  PRO  43           HG2      PRO  43  96.981   5.024   1.476
  350    HG3  PRO  43           HG1      PRO  43  97.995   3.592   1.232
  351    HD2  PRO  43           HD2      PRO  43  95.707   4.147  -0.234
  352    HD3  PRO  43           HD1      PRO  43  96.395   2.521  -0.029
  353    H    LYS  44           HN       LYS  44  93.329   3.648   4.580
  354    HA   LYS  44           HA       LYS  44  92.046   5.478   5.305
  355    HB2  LYS  44           HB2      LYS  44  94.598   6.922   4.512
  356    HB3  LYS  44           HB1      LYS  44  93.290   7.643   5.446
  357    HG2  LYS  44           HG2      LYS  44  94.635   6.910   7.180
  358    HG3  LYS  44           HG1      LYS  44  93.645   5.469   6.950
  359    HD2  LYS  44           HD2      LYS  44  95.356   4.449   5.560
  360    HD3  LYS  44           HD1      LYS  44  96.322   5.924   5.602
  361    HE2  LYS  44           HE2      LYS  44  95.656   4.125   7.949
  362    HE3  LYS  44           HE1      LYS  44  97.243   4.366   7.218
  363    HZ1  LYS  44           HZ1      LYS  44  97.379   5.838   8.922
  364    HZ2  LYS  44           HZ2      LYS  44  95.707   6.138   8.963
  365    HZ3  LYS  44           HZ3      LYS  44  96.674   6.860   7.766
  366    H    LYS  45           HN       LYS  45  93.629   7.691   3.151
  367    HA   LYS  45           HA       LYS  45  91.107   7.926   1.602
  368    HB2  LYS  45           HB2      LYS  45  92.235   9.954   2.584
  369    HB3  LYS  45           HB1      LYS  45  93.587   9.670   1.492
  370    HG2  LYS  45           HG2      LYS  45  90.919   9.685   0.207
  371    HG3  LYS  45           HG1      LYS  45  91.446  11.236   0.860
  372    HD2  LYS  45           HD2      LYS  45  93.417   9.646  -0.729
  373    HD3  LYS  45           HD1      LYS  45  92.128  10.477  -1.602
  374    HE2  LYS  45           HE2      LYS  45  94.119  11.920  -1.393
  375    HE3  LYS  45           HE1      LYS  45  92.753  12.600  -0.510
  376    HZ1  LYS  45           HZ1      LYS  45  93.650  11.512   1.508
  377    HZ2  LYS  45           HZ2      LYS  45  94.673  12.710   0.871
  378    HZ3  LYS  45           HZ3      LYS  45  95.027  11.067   0.622
  379    H    GLY  46           HN       GLY  46  91.131   7.830  -0.731
  380    HA2  GLY  46           HA2      GLY  46  93.541   6.454  -1.863
  381    HA3  GLY  46           HA1      GLY  46  91.898   5.979  -2.294
  382    H    VAL  47           HN       VAL  47  91.514   6.637  -4.353
  383    HA   VAL  47           HA       VAL  47  92.879   8.899  -5.545
  384    HB   VAL  47           HB       VAL  47  90.378   7.612  -6.644
  385   HG11  VAL  47          HG11      VAL  47  91.283   8.234  -8.756
  386   HG12  VAL  47          HG12      VAL  47  92.880   8.529  -8.070
  387   HG13  VAL  47          HG13      VAL  47  91.550   9.631  -7.714
  388   HG21  VAL  47          HG21      VAL  47  93.203   6.529  -6.547
  389   HG22  VAL  47          HG22      VAL  47  92.026   5.993  -7.745
  390   HG23  VAL  47          HG23      VAL  47  91.719   5.728  -6.029
  391    H    GLN  48           HN       GLN  48  89.922   9.343  -6.779
  392    HA   GLN  48           HA       GLN  48  89.493  11.912  -5.763
  393    HB2  GLN  48           HB2      GLN  48  88.299  10.656  -7.709
  394    HB3  GLN  48           HB1      GLN  48  87.165  10.127  -6.467
  395    HG2  GLN  48           HG2      GLN  48  87.887  13.024  -6.992
  396    HG3  GLN  48           HG1      GLN  48  86.443  12.230  -7.621
  397   HE21  GLN  48          HE21      GLN  48  85.121  11.046  -5.758
  398   HE22  GLN  48          HE22      GLN  48  84.946  11.929  -4.319
  399    H    GLY  49           HN       GLY  49  88.175   8.830  -4.550
  400    HA2  GLY  49           HA2      GLY  49  88.103   8.662  -2.030
  401    HA3  GLY  49           HA1      GLY  49  87.400  10.280  -2.047
  402    H1U  RCY  50           H1U      RCY  50  82.950   3.551  -1.998
  403    H1S  RCY  50           H1S      RCY  50  83.767   7.837  -1.628
  404    HB1  RCY  50           HB1      RCY  50  81.737   9.902  -2.764
  405    HB2  RCY  50           HB2      RCY  50  83.073  10.984  -2.370
  406    HA   RCY  50           HA       RCY  50  83.626   8.048  -2.625
  407    HN1  RCY  50           HN1      RCY  50  85.241  10.528  -2.947
  408    H    GLY  51           HN       GLY  51  82.891  10.924  -4.574
  409    HA2  GLY  51           HA2      GLY  51  83.444  10.005  -7.144
  410    HA3  GLY  51           HA1      GLY  51  81.881   9.292  -6.744
  411    H    ASP  52           HN       ASP  52  82.523  12.280  -5.203
  412    HA   ASP  52           HA       ASP  52  81.418  13.960  -7.331
  413    HB2  ASP  52           HB2      ASP  52  79.424  14.628  -5.941
  414    HB3  ASP  52           HB1      ASP  52  79.349  12.973  -6.546
  415    H    ASP  53           HN       ASP  53  80.324  15.452  -4.697
  416    HA   ASP  53           HA       ASP  53  82.826  16.287  -3.444
  417    HB2  ASP  53           HB2      ASP  53  81.396  18.072  -5.424
  418    HB3  ASP  53           HB1      ASP  53  82.457  18.717  -4.171
  419    H    ILE  54           HN       ILE  54  79.842  15.451  -3.027
  420    HA   ILE  54           HA       ILE  54  79.364  17.413  -0.828
  421    HB   ILE  54           HB       ILE  54  77.198  16.367  -2.676
  422   HG12  ILE  54          HG12      ILE  54  78.455  19.127  -2.526
  423   HG13  ILE  54          HG11      ILE  54  78.728  17.960  -3.821
  424   HG21  ILE  54          HG21      ILE  54  75.792  18.000  -1.509
  425   HG22  ILE  54          HG22      ILE  54  77.168  18.516  -0.534
  426   HG23  ILE  54          HG23      ILE  54  76.512  16.891  -0.342
  427   HD11  ILE  54          HD11      ILE  54  76.140  19.346  -3.091
  428   HD12  ILE  54          HD12      ILE  54  76.196  17.939  -4.154
  429   HD13  ILE  54          HD13      ILE  54  77.018  19.429  -4.618
  430    HA   PRO  55           HA       PRO  55  78.895  13.039   0.589
  431    HB2  PRO  55           HB2      PRO  55  80.711  13.095   2.593
  432    HB3  PRO  55           HB1      PRO  55  81.188  12.860   0.900
  433    HG2  PRO  55           HG2      PRO  55  81.380  15.288   2.595
  434    HG3  PRO  55           HG1      PRO  55  82.472  14.700   1.332
  435    HD2  PRO  55           HD2      PRO  55  80.555  16.721   1.006
  436    HD3  PRO  55           HD1      PRO  55  81.351  15.833  -0.310
  437    H    GLY  56           HN       GLY  56  77.915  12.258   2.582
  438    HA2  GLY  56           HA2      GLY  56  76.778  12.469   4.646
  439    HA3  GLY  56           HA1      GLY  56  77.374  14.125   4.765
  440    H    MET  57           HN       MET  57  76.394  15.066   2.253
  441    HA   MET  57           HA       MET  57  74.456  16.102   1.428
  442    HB2  MET  57           HB2      MET  57  73.121  13.517   2.284
  443    HB3  MET  57           HB1      MET  57  72.565  14.637   1.040
  444    HG2  MET  57           HG2      MET  57  74.832  14.209  -0.109
  445    HG3  MET  57           HG1      MET  57  74.983  12.830   0.980
  446    HE1  MET  57           HE1      MET  57  72.322  13.401  -2.643
  447    HE2  MET  57           HE2      MET  57  74.016  13.837  -2.434
  448    HE3  MET  57           HE3      MET  57  72.775  14.685  -1.515
  449    H    GLU  58           HN       GLU  58  71.980  14.655   3.089
  450    HA   GLU  58           HA       GLU  58  72.134  16.082   5.608
  451    HB2  GLU  58           HB2      GLU  58  71.658  17.886   3.818
  452    HB3  GLU  58           HB1      GLU  58  70.066  17.142   3.675
  453    HG2  GLU  58           HG2      GLU  58  71.241  18.081   6.305
  454    HG3  GLU  58           HG1      GLU  58  70.165  19.063   5.311
  455    H    GLY  59           HN       GLY  59  71.319  14.314   6.688
  456    HA2  GLY  59           HA2      GLY  59  69.466  13.097   7.576
  457    HA3  GLY  59           HA1      GLY  59  68.490  13.633   6.208
  458    H1U  RCY  60           H1U      RCY  60  75.011   5.684   3.545
  459    H1S  RCY  60           H1S      RCY  60  74.653  10.187   5.240
  460    HB1  RCY  60           HB1      RCY  60  72.013   8.855   4.541
  461    HB2  RCY  60           HB2      RCY  60  70.682   9.170   5.654
  462    HA   RCY  60           HA       RCY  60  71.647  10.852   3.347
  463    HN1  RCY  60           HN1      RCY  60  71.103  12.738   4.634
  464    H    GLY  61           HN       GLY  61  68.593  11.704   4.037
  465    HA2  GLY  61           HA2      GLY  61  66.864   9.580   3.621
  466    HA3  GLY  61           HA1      GLY  61  66.587  11.170   2.907
  467    H    THR  62           HN       THR  62  68.183  11.545   0.942
  468    HA   THR  62           HA       THR  62  68.305  10.971  -1.357
  469    HB   THR  62           HB       THR  62  69.784   8.714  -1.406
  470    HG1  THR  62           HG1      THR  62  71.021   9.079   0.709
  471   HG21  THR  62          HG21      THR  62  70.549  10.935  -2.102
  472   HG22  THR  62          HG22      THR  62  71.761  10.177  -1.068
  473   HG23  THR  62          HG23      THR  62  70.702  11.429  -0.416
  474    H    ASP  63           HN       ASP  63  65.878   9.870  -0.009
  475    HA   ASP  63           HA       ASP  63  65.412   7.167  -0.758
  476    HB2  ASP  63           HB2      ASP  63  63.559   9.546  -0.488
  477    HB3  ASP  63           HB1      ASP  63  62.965   7.933  -0.885
  478    H    ILE  64           HN       ILE  64  66.655   7.232  -2.853
  479    HA   ILE  64           HA       ILE  64  66.834   7.579  -5.180
  480    HB   ILE  64           HB       ILE  64  65.504   5.615  -5.268
  481   HG12  ILE  64          HG12      ILE  64  63.707   7.458  -6.818
  482   HG13  ILE  64          HG11      ILE  64  65.404   7.323  -7.279
  483   HG21  ILE  64          HG21      ILE  64  63.162   7.385  -4.502
  484   HG22  ILE  64          HG22      ILE  64  63.939   6.182  -3.473
  485   HG23  ILE  64          HG23      ILE  64  63.040   5.672  -4.903
  486   HD11  ILE  64          HD11      ILE  64  65.171   4.888  -7.499
  487   HD12  ILE  64          HD12      ILE  64  63.991   5.708  -8.521
  488   HD13  ILE  64          HD13      ILE  64  63.485   4.992  -6.991
  489    H    THR  65           HN       THR  65  65.987   9.904  -3.573
  490    HA   THR  65           HA       THR  65  63.969  11.467  -4.729
  491    HB   THR  65           HB       THR  65  66.738  12.470  -3.989
  492    HG1  THR  65           HG1      THR  65  64.952  11.231  -2.505
  493   HG21  THR  65          HG21      THR  65  64.011  13.788  -4.089
  494   HG22  THR  65          HG22      THR  65  65.390  14.142  -5.130
  495   HG23  THR  65          HG23      THR  65  65.457  14.539  -3.413
  496    H    VAL  66           HN       VAL  66  66.798  10.191  -6.126
  497    HA   VAL  66           HA       VAL  66  66.160  11.509  -8.687
  498    HB   VAL  66           HB       VAL  66  69.055  11.453  -7.896
  499   HG11  VAL  66          HG11      VAL  66  69.251  13.147  -9.529
  500   HG12  VAL  66          HG12      VAL  66  67.540  13.563  -9.429
  501   HG13  VAL  66          HG13      VAL  66  68.038  12.059 -10.204
  502   HG21  VAL  66          HG21      VAL  66  68.821  13.745  -6.957
  503   HG22  VAL  66          HG22      VAL  66  67.961  12.548  -5.987
  504   HG23  VAL  66          HG23      VAL  66  67.068  13.601  -7.084
  505    H    ILE  67           HN       ILE  67  69.094   9.741  -7.706
  506    HA   ILE  67           HA       ILE  67  68.116   7.359  -9.198
  507    HB   ILE  67           HB       ILE  67  70.852   8.590  -9.624
  508   HG12  ILE  67          HG12      ILE  67  68.401   8.619 -11.416
  509   HG13  ILE  67          HG11      ILE  67  69.055  10.016 -10.560
  510   HG21  ILE  67          HG21      ILE  67  71.019   6.952 -11.425
  511   HG22  ILE  67          HG22      ILE  67  69.376   6.395 -11.109
  512   HG23  ILE  67          HG23      ILE  67  70.646   6.117  -9.917
  513   HD11  ILE  67          HD11      ILE  67  69.943  10.162 -12.766
  514   HD12  ILE  67          HD12      ILE  67  70.334   8.443 -12.802
  515   HD13  ILE  67          HD13      ILE  67  71.261   9.536 -11.774
  516    H1U  RCY  68           H1U      RCY  68  71.171   3.978   1.219
  517    H1S  RCY  68           H1S      RCY  68  68.779   6.321  -1.369
  518    HB1  RCY  68           HB1      RCY  68  68.951   4.230  -4.369
  519    HB2  RCY  68           HB2      RCY  68  67.670   5.051  -5.257
  520    HA   RCY  68           HA       RCY  68  70.479   6.040  -5.564
  521    HN1  RCY  68           HN1      RCY  68  68.005   6.198  -7.169
  522    HA   PRO  69           HA       PRO  69  72.210   2.819  -8.170
  523    HB2  PRO  69           HB2      PRO  69  73.276   1.973  -5.495
  524    HB3  PRO  69           HB1      PRO  69  74.121   2.118  -7.049
  525    HG2  PRO  69           HG2      PRO  69  74.348   3.980  -5.150
  526    HG3  PRO  69           HG1      PRO  69  74.332   4.399  -6.871
  527    HD2  PRO  69           HD2      PRO  69  72.243   4.864  -4.816
  528    HD3  PRO  69           HD1      PRO  69  72.522   5.712  -6.353
  529    H    TRP  70           HN       TRP  70  70.072   2.353  -5.516
  530    HA   TRP  70           HA       TRP  70  69.982  -0.528  -5.513
  531    HD1  TRP  70           HD1      TRP  70  69.628  -1.721  -3.372
  532    HE1  TRP  70           HE1      TRP  70  67.919  -3.546  -2.748
  533    HE3  TRP  70           HE3      TRP  70  65.309   0.580  -4.829
  534    HZ2  TRP  70           HZ2      TRP  70  65.089  -3.975  -2.853
  535    HZ3  TRP  70           HZ3      TRP  70  63.127  -0.555  -4.557
  536    HH2  TRP  70           HH2      TRP  70  63.008  -2.826  -3.573
  537    HB2  TRP  70           HB2      TRP  70  69.053   1.075  -3.737
  538    HB3  TRP  70           HB1      TRP  70  67.678   1.304  -4.816
  539    H    GLU  71           HN       GLU  71  69.274   1.565  -7.960
  540    HA   GLU  71           HA       GLU  71  67.484  -0.429  -9.251
  541    HB2  GLU  71           HB2      GLU  71  66.894   2.510  -8.866
  542    HB3  GLU  71           HB1      GLU  71  66.166   1.588 -10.182
  543    HG2  GLU  71           HG2      GLU  71  66.020   0.716  -7.286
  544    HG3  GLU  71           HG1      GLU  71  64.779   1.707  -8.054
  545    H    ALA  72           HN       ALA  72  69.686   2.315  -9.512
  546    HA   ALA  72           HA       ALA  72  69.796   2.219 -12.424
  547    HB1  ALA  72           HB1      ALA  72  70.337   4.325 -11.481
  548    HB2  ALA  72           HB2      ALA  72  71.887   3.669 -12.005
  549    HB3  ALA  72           HB3      ALA  72  71.433   3.608 -10.301
  550    H1U  RCY  73           H1U      RCY  73  76.491  -1.799  -4.137
  551    H1S  RCY  73           H1S      RCY  73  77.245  -1.109  -8.170
  552    HB1  RCY  73           HB1      RCY  73  73.862  -0.993  -9.008
  553    HB2  RCY  73           HB2      RCY  73  74.021   0.762  -8.959
  554    HA   RCY  73           HA       RCY  73  74.159   0.286 -11.657
  555    HN1  RCY  73           HN1      RCY  73  72.337   1.577  -9.976
  556    H    ASN  74           HN       ASN  74  71.752  -1.401  -9.598
  557    HA   ASN  74           HA       ASN  74  70.714  -3.483  -9.889
  558    HB2  ASN  74           HB2      ASN  74  70.829  -2.220 -12.555
  559    HB3  ASN  74           HB1      ASN  74  70.686  -3.976 -12.611
  560   HD21  ASN  74          HD21      ASN  74  69.347  -1.727 -10.146
  561   HD22  ASN  74          HD22      ASN  74  67.727  -2.151 -10.419
  562    H    HIS  75           HN       HIS  75  71.212  -5.723 -10.354
  563    HA   HIS  75           HA       HIS  75  72.649  -7.546 -10.688
  564    HD1  HIS  75           HD1      HIS  75  76.348  -7.457 -12.821
  565    HD2  HIS  75           HD2      HIS  75  72.556  -9.188 -12.664
  566    HE1  HIS  75           HE1      HIS  75  76.641  -9.882 -13.489
  567    HE2  HIS  75           HE2      HIS  75  74.340 -10.948 -13.397
  568    HB2  HIS  75           HB2      HIS  75  73.071  -6.123 -12.883
  569    HB3  HIS  75           HB1      HIS  75  74.631  -5.805 -12.125
  570    H1U  RCY  76           H1U      RCY  76  75.429  -0.087  -2.374
  571    H1S  RCY  76           H1S      RCY  76  75.304  -3.359  -5.175
  572    HB1  RCY  76           HB1      RCY  76  76.037  -5.002  -6.460
  573    HB2  RCY  76           HB2      RCY  76  74.688  -5.972  -7.052
  574    HA   RCY  76           HA       RCY  76  76.451  -4.217  -8.789
  575    HN1  RCY  76           HN1      RCY  76  74.675  -4.611 -10.275
  576    H    GLU  77           HN       GLU  77  78.185  -5.279  -9.766
  577    HA   GLU  77           HA       GLU  77  78.512  -8.146  -9.731
  578    HB2  GLU  77           HB2      GLU  77  80.657  -6.031 -10.074
  579    HB3  GLU  77           HB1      GLU  77  80.737  -7.713 -10.599
  580    HG2  GLU  77           HG2      GLU  77  78.722  -7.264 -12.055
  581    HG3  GLU  77           HG1      GLU  77  78.890  -5.555 -11.652
  582    H    LEU  78           HN       LEU  78  81.369  -8.031  -8.897
  583    HA   LEU  78           HA       LEU  78  82.614  -8.460  -6.963
  584    HG   LEU  78           HG       LEU  78  81.330  -5.379  -7.498
  585    HB2  LEU  78           HB2      LEU  78  80.695  -6.600  -5.552
  586    HB3  LEU  78           HB1      LEU  78  82.371  -6.948  -5.134
  587   HD11  LEU  78          HD11      LEU  78  81.737  -4.190  -5.352
  588   HD12  LEU  78          HD12      LEU  78  82.846  -3.663  -6.618
  589   HD13  LEU  78          HD13      LEU  78  83.401  -4.773  -5.365
  590   HD21  LEU  78          HD21      LEU  78  84.027  -6.677  -7.063
  591   HD22  LEU  78          HD22      LEU  78  83.821  -5.283  -8.123
  592   HD23  LEU  78          HD23      LEU  78  82.981  -6.793  -8.478
  593    H    HIS  79           HN       HIS  79  82.571 -10.067  -5.454
  594    HA   HIS  79           HA       HIS  79  80.552 -10.754  -3.655
  595    HD1  HIS  79           HD1      HIS  79  77.428 -13.294  -5.179
  596    HD2  HIS  79           HD2      HIS  79  78.624  -9.528  -3.840
  597    HE1  HIS  79           HE1      HIS  79  75.440 -12.302  -3.963
  598    HE2  HIS  79           HE2      HIS  79  76.155 -10.010  -3.143
  599    HB2  HIS  79           HB2      HIS  79  79.826 -11.444  -6.386
  600    HB3  HIS  79           HB1      HIS  79  79.960 -12.899  -5.405
  601    H    GLU  80           HN       GLU  80  81.930 -11.773  -2.283
  602    HA   GLU  80           HA       GLU  80  83.309 -14.212  -3.222
  603    HB2  GLU  80           HB2      GLU  80  85.397 -13.230  -1.881
  604    HB3  GLU  80           HB1      GLU  80  85.173 -12.883  -3.595
  605    HG2  GLU  80           HG2      GLU  80  83.980 -11.094  -1.479
  606    HG3  GLU  80           HG1      GLU  80  85.645 -10.881  -2.019
  607    H    LEU  81           HN       LEU  81  82.893 -11.972  -0.461
  608    HA   LEU  81           HA       LEU  81  82.902 -14.319   1.368
  609    HG   LEU  81           HG       LEU  81  82.361 -10.862   0.906
  610    HB2  LEU  81           HB2      LEU  81  83.035 -12.627   3.171
  611    HB3  LEU  81           HB1      LEU  81  84.338 -12.434   2.000
  612   HD11  LEU  81          HD11      LEU  81  81.329  -9.573   2.639
  613   HD12  LEU  81          HD12      LEU  81  82.320 -10.333   3.885
  614   HD13  LEU  81          HD13      LEU  81  81.065 -11.264   3.066
  615   HD21  LEU  81          HD21      LEU  81  83.706  -8.962   1.835
  616   HD22  LEU  81          HD22      LEU  81  84.706 -10.226   1.119
  617   HD23  LEU  81          HD23      LEU  81  84.549 -10.113   2.872
  618    H    ALA  82           HN       ALA  82  80.853 -11.645   0.268
  619    HA   ALA  82           HA       ALA  82  78.687 -12.145   2.089
  620    HB1  ALA  82           HB1      ALA  82  79.033 -10.066   0.652
  621    HB2  ALA  82           HB2      ALA  82  77.388 -10.701   0.687
  622    HB3  ALA  82           HB3      ALA  82  78.424 -11.013  -0.706
  623    H    GLN  83           HN       GLN  83  78.476 -12.674  -1.433
  624    HA   GLN  83           HA       GLN  83  77.263 -14.315  -2.607
  625    HB2  GLN  83           HB2      GLN  83  78.635 -15.980  -0.476
  626    HB3  GLN  83           HB1      GLN  83  77.848 -16.647  -1.907
  627    HG2  GLN  83           HG2      GLN  83  79.360 -15.106  -3.281
  628    HG3  GLN  83           HG1      GLN  83  80.271 -14.842  -1.793
  629   HE21  GLN  83          HE21      GLN  83  79.443 -17.257  -4.248
  630   HE22  GLN  83          HE22      GLN  83  80.585 -18.411  -3.751
  631    H    TYR  84           HN       TYR  84  75.520 -12.992  -1.041
  632    HA   TYR  84           HA       TYR  84  73.484 -13.179   0.117
  633    HD1  TYR  84           HD1      TYR  84  72.098 -12.774  -2.049
  634    HD2  TYR  84           HD2      TYR  84  74.363 -16.307  -2.963
  635    HE1  TYR  84           HE1      TYR  84  72.271 -12.051  -4.415
  636    HE2  TYR  84           HE2      TYR  84  74.537 -15.584  -5.329
  637    HH   TYR  84           HH       TYR  84  73.550 -14.155  -6.890
  638    HB2  TYR  84           HB2      TYR  84  73.453 -16.050  -0.823
  639    HB3  TYR  84           HB1      TYR  84  72.086 -14.959  -0.591
  640    H    GLY  85           HN       GLY  85  75.006 -13.148   2.095
  641    HA2  GLY  85           HA2      GLY  85  74.266 -15.435   3.807
  642    HA3  GLY  85           HA1      GLY  85  75.997 -15.159   3.603
  643    H    ILE  86           HN       ILE  86  73.271 -12.874   3.976
  644    HA   ILE  86           HA       ILE  86  72.977 -11.118   5.504
  645    HB   ILE  86           HB       ILE  86  74.778 -12.656   7.378
  646   HG12  ILE  86          HG12      ILE  86  73.260 -14.306   6.445
  647   HG13  ILE  86          HG11      ILE  86  72.690 -13.885   8.060
  648   HG21  ILE  86          HG21      ILE  86  73.311 -11.698   9.075
  649   HG22  ILE  86          HG22      ILE  86  72.265 -11.018   7.829
  650   HG23  ILE  86          HG23      ILE  86  73.906 -10.406   8.033
  651   HD11  ILE  86          HD11      ILE  86  70.750 -13.843   6.675
  652   HD12  ILE  86          HD12      ILE  86  71.589 -12.956   5.403
  653   HD13  ILE  86          HD13      ILE  86  71.189 -12.153   6.921
  654    H1U  RCY  87           H1U      RCY  87  73.339  -4.890   0.137
  655    H1S  RCY  87           H1S      RCY  87  73.164  -5.072   4.375
  656    HB1  RCY  87           HB1      RCY  87  76.258  -6.479   5.482
  657    HB2  RCY  87           HB2      RCY  87  75.543  -6.921   7.033
  658    HA   RCY  87           HA       RCY  87  76.570  -8.691   4.840
  659    HN1  RCY  87           HN1      RCY  87  74.046  -9.202   6.126
  Start of MODEL   44
    1    HA   MET   1           HA       MET   1  52.720   1.732  12.666
    2    HB2  MET   1           HB2      MET   1  55.089   3.316  13.680
    3    HB3  MET   1           HB1      MET   1  54.213   3.527  12.164
    4    HG2  MET   1           HG2      MET   1  53.390   5.256  13.559
    5    HG3  MET   1           HG1      MET   1  52.149   4.005  13.635
    6    HE1  MET   1           HE1      MET   1  55.146   5.454  16.647
    7    HE2  MET   1           HE2      MET   1  55.221   5.461  14.886
    8    HE3  MET   1           HE3      MET   1  55.773   4.047  15.780
    9    H    ASN   2           HN       ASN   2  55.744   1.322  14.545
   10    HA   ASN   2           HA       ASN   2  56.906  -0.284  12.370
   11    HB2  ASN   2           HB2      ASN   2  57.906   0.564  15.098
   12    HB3  ASN   2           HB1      ASN   2  58.826  -0.498  14.032
   13   HD21  ASN   2          HD21      ASN   2  60.429   1.394  14.055
   14   HD22  ASN   2          HD22      ASN   2  60.173   2.663  12.957
   15    H    LEU   3           HN       LEU   3  55.384  -0.787  15.498
   16    HA   LEU   3           HA       LEU   3  54.835  -2.767  16.641
   17    HG   LEU   3           HG       LEU   3  52.651  -3.346  15.996
   18    HB2  LEU   3           HB2      LEU   3  54.658  -3.494  13.724
   19    HB3  LEU   3           HB1      LEU   3  54.409  -4.735  14.952
   20   HD11  LEU   3          HD11      LEU   3  53.390  -1.471  13.742
   21   HD12  LEU   3          HD12      LEU   3  53.333  -1.124  15.470
   22   HD13  LEU   3          HD13      LEU   3  51.837  -1.374  14.571
   23   HD21  LEU   3          HD21      LEU   3  52.037  -4.983  14.246
   24   HD22  LEU   3          HD22      LEU   3  52.271  -3.747  13.010
   25   HD23  LEU   3          HD23      LEU   3  50.976  -3.575  14.195
   26    H    GLU   4           HN       GLU   4  55.551  -5.249  16.733
   27    HA   GLU   4           HA       GLU   4  58.292  -5.325  17.404
   28    HB2  GLU   4           HB2      GLU   4  56.261  -7.457  16.753
   29    HB3  GLU   4           HB1      GLU   4  57.936  -7.899  17.082
   30    HG2  GLU   4           HG2      GLU   4  56.312  -6.150  18.943
   31    HG3  GLU   4           HG1      GLU   4  56.388  -7.905  19.105
   32    HA   PRO   5           HA       PRO   5  60.426  -5.596  13.555
   33    HB2  PRO   5           HB2      PRO   5  62.404  -7.446  14.186
   34    HB3  PRO   5           HB1      PRO   5  62.459  -5.724  14.607
   35    HG2  PRO   5           HG2      PRO   5  61.707  -8.055  16.286
   36    HG3  PRO   5           HG1      PRO   5  62.594  -6.585  16.722
   37    HD2  PRO   5           HD2      PRO   5  59.977  -6.946  17.380
   38    HD3  PRO   5           HD1      PRO   5  60.654  -5.340  17.026
   39    HA   PRO   6           HA       PRO   6  58.758  -9.160  11.472
   40    HB2  PRO   6           HB2      PRO   6  60.144  -9.044   9.127
   41    HB3  PRO   6           HB1      PRO   6  58.869  -7.882   9.545
   42    HG2  PRO   6           HG2      PRO   6  61.826  -7.576   9.721
   43    HG3  PRO   6           HG1      PRO   6  60.600  -6.415   9.183
   44    HD2  PRO   6           HD2      PRO   6  61.728  -6.346  11.684
   45    HD3  PRO   6           HD1      PRO   6  60.088  -5.752  11.340
   46    H    LYS   7           HN       LYS   7  59.264 -11.350  11.022
   47    HA   LYS   7           HA       LYS   7  61.966 -12.210  11.920
   48    HB2  LYS   7           HB2      LYS   7  59.590 -13.153  12.706
   49    HB3  LYS   7           HB1      LYS   7  59.786 -14.163  11.276
   50    HG2  LYS   7           HG2      LYS   7  60.843 -15.468  12.893
   51    HG3  LYS   7           HG1      LYS   7  62.208 -14.556  12.247
   52    HD2  LYS   7           HD2      LYS   7  62.516 -14.199  14.517
   53    HD3  LYS   7           HD1      LYS   7  61.501 -12.813  14.117
   54    HE2  LYS   7           HE2      LYS   7  60.641 -13.940  16.122
   55    HE3  LYS   7           HE1      LYS   7  59.495 -14.103  14.791
   56    HZ1  LYS   7           HZ1      LYS   7  59.619 -16.282  15.070
   57    HZ2  LYS   7           HZ2      LYS   7  60.853 -16.126  16.228
   58    HZ3  LYS   7           HZ3      LYS   7  61.241 -16.233  14.578
   59    H    ALA   8           HN       ALA   8  61.834 -14.760  10.533
   60    HA   ALA   8           HA       ALA   8  62.766 -15.595   8.534
   61    HB1  ALA   8           HB1      ALA   8  61.361 -15.099   6.544
   62    HB2  ALA   8           HB2      ALA   8  60.537 -13.838   7.462
   63    HB3  ALA   8           HB3      ALA   8  60.386 -15.526   7.950
   64    H    GLU   9           HN       GLU   9  62.026 -13.277   6.281
   65    HA   GLU   9           HA       GLU   9  64.032 -11.285   6.711
   66    HB2  GLU   9           HB2      GLU   9  65.624 -12.175   4.889
   67    HB3  GLU   9           HB1      GLU   9  65.715 -12.945   6.473
   68    HG2  GLU   9           HG2      GLU   9  64.424 -14.823   5.736
   69    HG3  GLU   9           HG1      GLU   9  63.976 -14.009   4.237
   70    H1U  RCY  10           H1U      RCY  10  56.873 -10.166   3.896
   71    H1S  RCY  10           H1S      RCY  10  58.583 -13.831   3.947
   72    HB1  RCY  10           HB1      RCY  10  62.109 -13.248   1.492
   73    HB2  RCY  10           HB2      RCY  10  60.471 -12.623   1.303
   74    HA   RCY  10           HA       RCY  10  62.203 -11.067   2.414
   75    HN1  RCY  10           HN1      RCY  10  62.084 -13.175   4.476
   76    H    ARG  11           HN       ARG  11  61.254  -9.768   4.510
   77    HA   ARG  11           HA       ARG  11  58.298  -9.971   4.576
   78    HE   ARG  11           HE       ARG  11  56.619  -5.810   7.866
   79    HB2  ARG  11           HB2      ARG  11  59.620  -9.632   6.683
   80    HB3  ARG  11           HB1      ARG  11  60.125  -8.060   6.065
   81    HG2  ARG  11           HG2      ARG  11  57.244  -8.385   5.849
   82    HG3  ARG  11           HG1      ARG  11  57.783  -8.606   7.513
   83    HD2  ARG  11           HD2      ARG  11  58.875  -6.462   7.530
   84    HD3  ARG  11           HD1      ARG  11  58.639  -6.266   5.793
   85   HH11  ARG  11          HH21      ARG  11  57.337  -6.505   4.567
   86   HH12  ARG  11          HH22      ARG  11  55.834  -5.885   3.970
   87   HH21  ARG  11          HH11      ARG  11  54.652  -4.995   7.106
   88   HH22  ARG  11          HH12      ARG  11  54.314  -5.030   5.408
   89    H    SER  12           HN       SER  12  57.551  -9.117   2.634
   90    HA   SER  12           HA       SER  12  57.311  -6.321   2.329
   91    HG   SER  12           HG       SER  12  59.816  -8.392   1.689
   92    HB2  SER  12           HB2      SER  12  58.847  -6.223   0.184
   93    HB3  SER  12           HB1      SER  12  59.551  -5.975   1.778
   94    H    ALA  13           HN       ALA  13  58.234  -7.834  -0.624
   95    HA   ALA  13           HA       ALA  13  55.746  -9.187  -1.189
   96    HB1  ALA  13           HB1      ALA  13  54.733  -7.028  -1.289
   97    HB2  ALA  13           HB2      ALA  13  55.028  -7.486  -2.967
   98    HB3  ALA  13           HB3      ALA  13  56.105  -6.346  -2.161
   99    H    THR  14           HN       THR  14  56.691  -7.368  -3.876
  100    HA   THR  14           HA       THR  14  58.916  -9.138  -4.656
  101    HB   THR  14           HB       THR  14  57.693  -9.780  -6.789
  102    HG1  THR  14           HG1      THR  14  55.461  -8.947  -5.252
  103   HG21  THR  14          HG21      THR  14  56.624 -11.672  -5.781
  104   HG22  THR  14          HG22      THR  14  56.355 -10.797  -4.274
  105   HG23  THR  14          HG23      THR  14  57.990 -11.260  -4.745
  106    H    ARG  15           HN       ARG  15  56.708  -6.493  -5.416
  107    HA   ARG  15           HA       ARG  15  57.018  -4.552  -6.692
  108    HE   ARG  15           HE       ARG  15  62.066  -1.612  -7.350
  109    HB2  ARG  15           HB2      ARG  15  58.839  -4.162  -5.103
  110    HB3  ARG  15           HB1      ARG  15  59.920  -5.175  -6.059
  111    HG2  ARG  15           HG2      ARG  15  59.915  -3.636  -7.881
  112    HG3  ARG  15           HG1      ARG  15  58.550  -2.740  -7.214
  113    HD2  ARG  15           HD2      ARG  15  59.858  -1.790  -5.495
  114    HD3  ARG  15           HD1      ARG  15  61.137  -2.990  -5.685
  115   HH11  ARG  15          HH21      ARG  15  58.712  -0.966  -6.879
  116   HH12  ARG  15          HH22      ARG  15  58.678   0.369  -7.982
  117   HH21  ARG  15          HH11      ARG  15  62.041   0.128  -8.793
  118   HH22  ARG  15          HH12      ARG  15  60.562   0.988  -9.066
  119    H    VAL  16           HN       VAL  16  57.801  -3.782  -8.814
  120    HA   VAL  16           HA       VAL  16  58.213  -6.070 -10.663
  121    HB   VAL  16           HB       VAL  16  57.675  -3.175 -11.371
  122   HG11  VAL  16          HG11      VAL  16  58.535  -4.719 -13.148
  123   HG12  VAL  16          HG12      VAL  16  56.910  -4.120 -13.480
  124   HG13  VAL  16          HG13      VAL  16  57.138  -5.758 -12.868
  125   HG21  VAL  16          HG21      VAL  16  55.721  -5.441 -10.856
  126   HG22  VAL  16          HG22      VAL  16  55.291  -3.881 -11.557
  127   HG23  VAL  16          HG23      VAL  16  55.883  -3.969  -9.898
  128    H    MET  17           HN       MET  17  60.513  -6.237  -9.896
  129    HA   MET  17           HA       MET  17  62.336  -4.054 -10.566
  130    HB2  MET  17           HB2      MET  17  62.880  -5.555  -8.712
  131    HB3  MET  17           HB1      MET  17  62.860  -6.942  -9.802
  132    HG2  MET  17           HG2      MET  17  64.788  -6.171 -10.979
  133    HG3  MET  17           HG1      MET  17  64.692  -4.575 -10.234
  134    HE1  MET  17           HE1      MET  17  67.966  -5.922  -8.875
  135    HE2  MET  17           HE2      MET  17  67.131  -4.370  -8.877
  136    HE3  MET  17           HE3      MET  17  67.147  -5.358 -10.336
  137    H    GLY  18           HN       GLY  18  62.582  -3.623 -12.718
  138    HA2  GLY  18           HA2      GLY  18  63.982  -4.493 -14.657
  139    HA3  GLY  18           HA1      GLY  18  62.988  -5.947 -14.562
  140    H    GLY  19           HN       GLY  19  62.348  -5.524 -16.801
  141    HA2  GLY  19           HA2      GLY  19  60.811  -4.742 -18.391
  142    HA3  GLY  19           HA1      GLY  19  59.833  -4.195 -17.028
  143    HA   PRO  20           HA       PRO  20  60.399  -0.063 -18.670
  144    HB2  PRO  20           HB2      PRO  20  60.177   0.575 -15.747
  145    HB3  PRO  20           HB1      PRO  20  59.357   1.328 -17.129
  146    HG2  PRO  20           HG2      PRO  20  58.115  -0.424 -15.540
  147    HG3  PRO  20           HG1      PRO  20  57.788  -0.342 -17.278
  148    HD2  PRO  20           HD2      PRO  20  59.241  -2.428 -15.746
  149    HD3  PRO  20           HD1      PRO  20  58.416  -2.550 -17.315
  150    H1U  RCY  21           H1U      RCY  21  67.850   3.563  -9.601
  151    H1S  RCY  21           H1S      RCY  21  65.168   0.167 -11.695
  152    HB1  RCY  21           HB1      RCY  21  65.407  -0.791 -14.399
  153    HB2  RCY  21           HB2      RCY  21  63.780  -1.455 -14.273
  154    HA   RCY  21           HA       RCY  21  64.245   0.864 -16.115
  155    HN1  RCY  21           HN1      RCY  21  62.186  -1.194 -15.802
  156    H    THR  22           HN       THR  22  66.555   0.237 -16.449
  157    HA   THR  22           HA       THR  22  66.950  -2.267 -17.997
  158    HB   THR  22           HB       THR  22  68.298  -0.828 -19.675
  159    HG1  THR  22           HG1      THR  22  67.568   1.028 -18.022
  160   HG21  THR  22          HG21      THR  22  66.228  -1.935 -20.307
  161   HG22  THR  22          HG22      THR  22  66.223  -0.300 -20.968
  162   HG23  THR  22          HG23      THR  22  65.275  -0.672 -19.528
  163    HA   PRO  23           HA       PRO  23  70.712  -2.192 -15.630
  164    HB2  PRO  23           HB2      PRO  23  72.251  -3.895 -17.120
  165    HB3  PRO  23           HB1      PRO  23  70.906  -4.446 -16.102
  166    HG2  PRO  23           HG2      PRO  23  70.984  -4.009 -19.046
  167    HG3  PRO  23           HG1      PRO  23  70.209  -5.303 -18.115
  168    HD2  PRO  23           HD2      PRO  23  68.824  -3.167 -19.134
  169    HD3  PRO  23           HD1      PRO  23  68.324  -4.035 -17.666
  170    H    ARG  24           HN       ARG  24  70.999   0.149 -16.382
  171    HA   ARG  24           HA       ARG  24  73.631   0.637 -17.281
  172    HE   ARG  24           HE       ARG  24  75.742  -0.817 -21.169
  173    HB2  ARG  24           HB2      ARG  24  71.745   0.101 -19.424
  174    HB3  ARG  24           HB1      ARG  24  72.347   1.750 -19.550
  175    HG2  ARG  24           HG2      ARG  24  74.597   1.045 -19.716
  176    HG3  ARG  24           HG1      ARG  24  74.232  -0.558 -19.077
  177    HD2  ARG  24           HD2      ARG  24  72.804  -0.938 -21.141
  178    HD3  ARG  24           HD1      ARG  24  73.480   0.556 -21.790
  179   HH11  ARG  24          HH21      ARG  24  72.797  -1.706 -22.725
  180   HH12  ARG  24          HH22      ARG  24  73.535  -2.908 -23.730
  181   HH21  ARG  24          HH11      ARG  24  76.723  -2.382 -22.472
  182   HH22  ARG  24          HH12      ARG  24  75.758  -3.291 -23.587
  183    H    LYS  25           HN       LYS  25  73.831   3.074 -17.969
  184    HA   LYS  25           HA       LYS  25  71.829   4.627 -16.368
  185    HB2  LYS  25           HB2      LYS  25  74.708   5.352 -16.988
  186    HB3  LYS  25           HB1      LYS  25  73.614   6.219 -15.911
  187    HG2  LYS  25           HG2      LYS  25  74.423   3.326 -15.505
  188    HG3  LYS  25           HG1      LYS  25  75.227   4.686 -14.720
  189    HD2  LYS  25           HD2      LYS  25  72.836   5.363 -13.950
  190    HD3  LYS  25           HD1      LYS  25  72.404   3.700 -14.350
  191    HE2  LYS  25           HE2      LYS  25  73.013   3.780 -12.004
  192    HE3  LYS  25           HE1      LYS  25  74.287   2.926 -12.876
  193    HZ1  LYS  25           HZ1      LYS  25  75.103   4.626 -11.287
  194    HZ2  LYS  25           HZ2      LYS  25  74.370   5.824 -12.243
  195    HZ3  LYS  25           HZ3      LYS  25  75.627   4.875 -12.881
  196    H    GLY  26           HN       GLY  26  70.889   6.428 -17.319
  197    HA2  GLY  26           HA2      GLY  26  71.285   6.699 -20.242
  198    HA3  GLY  26           HA1      GLY  26  69.961   7.403 -19.311
  199    HA   PRO  27           HA       PRO  27  72.099  11.239 -19.060
  200    HB2  PRO  27           HB2      PRO  27  71.628  12.067 -16.490
  201    HB3  PRO  27           HB1      PRO  27  70.379  12.047 -17.750
  202    HG2  PRO  27           HG2      PRO  27  70.875  10.106 -15.552
  203    HG3  PRO  27           HG1      PRO  27  69.342  10.707 -16.206
  204    HD2  PRO  27           HD2      PRO  27  70.385   8.252 -16.850
  205    HD3  PRO  27           HD1      PRO  27  69.325   9.176 -17.937
  206    HA   PRO  28           HA       PRO  28  76.292  11.102 -17.673
  207    HB2  PRO  28           HB2      PRO  28  75.653  13.476 -15.951
  208    HB3  PRO  28           HB1      PRO  28  77.011  13.228 -17.067
  209    HG2  PRO  28           HG2      PRO  28  74.891  14.729 -17.716
  210    HG3  PRO  28           HG1      PRO  28  75.770  13.765 -18.913
  211    HD2  PRO  28           HD2      PRO  28  73.061  13.339 -17.806
  212    HD3  PRO  28           HD1      PRO  28  73.776  12.712 -19.307
  213    H    LYS  29           HN       LYS  29  77.624  10.731 -15.698
  214    HA   LYS  29           HA       LYS  29  76.162   9.194 -13.710
  215    HB2  LYS  29           HB2      LYS  29  78.539   8.741 -14.566
  216    HB3  LYS  29           HB1      LYS  29  79.053  10.065 -13.520
  217    HG2  LYS  29           HG2      LYS  29  77.858   8.853 -11.619
  218    HG3  LYS  29           HG1      LYS  29  77.729   7.469 -12.705
  219    HD2  LYS  29           HD2      LYS  29  80.254   7.662 -13.033
  220    HD3  LYS  29           HD1      LYS  29  80.249   8.785 -11.673
  221    HE2  LYS  29           HE2      LYS  29  79.074   7.004 -10.319
  222    HE3  LYS  29           HE1      LYS  29  79.357   5.890 -11.657
  223    HZ1  LYS  29           HZ1      LYS  29  81.792   6.932 -11.314
  224    HZ2  LYS  29           HZ2      LYS  29  81.263   5.497 -10.573
  225    HZ3  LYS  29           HZ3      LYS  29  81.219   6.964  -9.717
  226    H1U  RCY  30           H1U      RCY  30  75.797   9.320  -6.751
  227    H1S  RCY  30           H1S      RCY  30  76.007  11.497 -10.189
  228    HB1  RCY  30           HB1      RCY  30  75.241  14.108 -13.062
  229    HB2  RCY  30           HB2      RCY  30  75.463  14.743 -11.434
  230    HA   RCY  30           HA       RCY  30  77.638  14.154 -12.330
  231    HN1  RCY  30           HN1      RCY  30  77.486  12.420 -13.925
  232    H    LYS  31           HN       LYS  31  79.068  13.853 -10.675
  233    HA   LYS  31           HA       LYS  31  78.022  12.653  -8.188
  234    HB2  LYS  31           HB2      LYS  31  80.233  11.363  -7.942
  235    HB3  LYS  31           HB1      LYS  31  79.047  10.700  -9.061
  236    HG2  LYS  31           HG2      LYS  31  81.081  10.641 -10.276
  237    HG3  LYS  31           HG1      LYS  31  80.262  12.083 -10.877
  238    HD2  LYS  31           HD2      LYS  31  81.792  13.494  -9.950
  239    HD3  LYS  31           HD1      LYS  31  81.958  12.514  -8.493
  240    HE2  LYS  31           HE2      LYS  31  83.464  11.003  -9.560
  241    HE3  LYS  31           HE1      LYS  31  83.084  11.641 -11.159
  242    HZ1  LYS  31           HZ1      LYS  31  83.941  13.763  -9.559
  243    HZ2  LYS  31           HZ2      LYS  31  84.709  13.099 -10.921
  244    HZ3  LYS  31           HZ3      LYS  31  85.060  12.502  -9.369
  245    H    GLN  32           HN       GLN  32  80.009  14.845  -9.871
  246    HA   GLN  32           HA       GLN  32  81.648  16.401  -9.127
  247    HB2  GLN  32           HB2      GLN  32  79.394  16.620  -7.113
  248    HB3  GLN  32           HB1      GLN  32  80.687  17.808  -7.275
  249    HG2  GLN  32           HG2      GLN  32  80.038  18.327  -9.533
  250    HG3  GLN  32           HG1      GLN  32  78.910  16.972  -9.580
  251   HE21  GLN  32          HE21      GLN  32  78.772  18.338  -6.499
  252   HE22  GLN  32          HE22      GLN  32  77.440  19.363  -6.731
  253    H    ARG  33           HN       ARG  33  80.719  16.226  -5.839
  254    HA   ARG  33           HA       ARG  33  82.879  14.339  -5.116
  255    HE   ARG  33           HE       ARG  33  81.423  19.857  -5.152
  256    HB2  ARG  33           HB2      ARG  33  83.512  16.292  -3.359
  257    HB3  ARG  33           HB1      ARG  33  84.305  16.137  -4.925
  258    HG2  ARG  33           HG2      ARG  33  83.579  18.450  -4.611
  259    HG3  ARG  33           HG1      ARG  33  82.625  17.706  -5.895
  260    HD2  ARG  33           HD2      ARG  33  80.772  17.325  -4.378
  261    HD3  ARG  33           HD1      ARG  33  81.730  17.879  -3.004
  262   HH11  ARG  33          HH21      ARG  33  80.258  18.492  -2.208
  263   HH12  ARG  33          HH22      ARG  33  79.390  19.915  -1.737
  264   HH21  ARG  33          HH11      ARG  33  80.296  21.723  -4.553
  265   HH22  ARG  33          HH12      ARG  33  79.412  21.744  -3.064
  266    H    GLN  34           HN       GLN  34  82.911  14.285  -2.535
  267    HA   GLN  34           HA       GLN  34  80.110  14.570  -1.526
  268    HB2  GLN  34           HB2      GLN  34  81.907  12.143  -1.233
  269    HB3  GLN  34           HB1      GLN  34  80.369  12.361  -0.397
  270    HG2  GLN  34           HG2      GLN  34  79.224  12.558  -2.590
  271    HG3  GLN  34           HG1      GLN  34  80.763  12.274  -3.403
  272   HE21  GLN  34          HE21      GLN  34  78.032  10.708  -2.040
  273   HE22  GLN  34          HE22      GLN  34  78.650   9.128  -2.042
  274    H    THR  35           HN       THR  35  81.639  16.531  -0.786
  275    HA   THR  35           HA       THR  35  82.660  17.605   1.031
  276    HB   THR  35           HB       THR  35  81.838  15.294   2.775
  277    HG1  THR  35           HG1      THR  35  79.936  15.474   1.901
  278   HG21  THR  35          HG21      THR  35  81.450  17.020   4.388
  279   HG22  THR  35          HG22      THR  35  81.533  18.279   3.156
  280   HG23  THR  35          HG23      THR  35  82.990  17.400   3.618
  281    H    ARG  36           HN       ARG  36  83.771  14.809  -0.251
  282    HA   ARG  36           HA       ARG  36  85.746  13.556  -0.002
  283    HE   ARG  36           HE       ARG  36  87.098  19.000  -1.894
  284    HB2  ARG  36           HB2      ARG  36  86.834  16.066   1.288
  285    HB3  ARG  36           HB1      ARG  36  87.705  14.877   0.317
  286    HG2  ARG  36           HG2      ARG  36  86.209  15.507  -1.624
  287    HG3  ARG  36           HG1      ARG  36  85.602  16.836  -0.636
  288    HD2  ARG  36           HD2      ARG  36  88.064  17.512  -0.329
  289    HD3  ARG  36           HD1      ARG  36  88.412  16.403  -1.655
  290   HH11  ARG  36          HH21      ARG  36  87.545  15.834  -3.183
  291   HH12  ARG  36          HH22      ARG  36  87.135  16.291  -4.803
  292   HH21  ARG  36          HH11      ARG  36  86.560  19.615  -4.001
  293   HH22  ARG  36          HH12      ARG  36  86.577  18.432  -5.266
  294    H    GLN  37           HN       GLN  37  83.834  13.384   2.191
  295    HA   GLN  37           HA       GLN  37  85.401  13.432   4.670
  296    HB2  GLN  37           HB2      GLN  37  82.952  13.908   4.638
  297    HB3  GLN  37           HB1      GLN  37  82.661  12.246   4.129
  298    HG2  GLN  37           HG2      GLN  37  84.405  12.381   6.469
  299    HG3  GLN  37           HG1      GLN  37  82.839  13.137   6.766
  300   HE21  GLN  37          HE21      GLN  37  84.306  10.239   7.162
  301   HE22  GLN  37          HE22      GLN  37  82.993   9.192   6.914
  302    H1U  RCY  38           H1U      RCY  38  85.019   5.335  -2.097
  303    H1S  RCY  38           H1S      RCY  38  84.430   8.106   1.647
  304    HB1  RCY  38           HB1      RCY  38  86.495   8.161   2.060
  305    HB2  RCY  38           HB2      RCY  38  87.651   9.345   1.451
  306    HA   RCY  38           HA       RCY  38  86.384   9.139   4.129
  307    HN1  RCY  38           HN1      RCY  38  86.891  11.898   3.115
  308    H    LYS  39           HN       LYS  39  88.748   8.162   2.702
  309    HA   LYS  39           HA       LYS  39  90.951   7.752   3.498
  310    HB2  LYS  39           HB2      LYS  39  92.396   9.784   2.907
  311    HB3  LYS  39           HB1      LYS  39  91.416   9.107   1.608
  312    HG2  LYS  39           HG2      LYS  39  89.762  10.829   1.837
  313    HG3  LYS  39           HG1      LYS  39  90.474  11.400   3.347
  314    HD2  LYS  39           HD2      LYS  39  92.301  12.383   2.268
  315    HD3  LYS  39           HD1      LYS  39  92.128  11.367   0.836
  316    HE2  LYS  39           HE2      LYS  39  91.349  13.885   0.760
  317    HE3  LYS  39           HE1      LYS  39  90.377  12.640  -0.023
  318    HZ1  LYS  39           HZ1      LYS  39  89.411  14.372   1.754
  319    HZ2  LYS  39           HZ2      LYS  39  89.820  13.087   2.787
  320    HZ3  LYS  39           HZ3      LYS  39  88.750  12.832   1.493
  321    H    SER  40           HN       SER  40  89.098   8.810   5.622
  322    HA   SER  40           HA       SER  40  90.709  10.619   7.245
  323    HG   SER  40           HG       SER  40  88.460  11.101   9.411
  324    HB2  SER  40           HB2      SER  40  88.229  10.540   7.417
  325    HB3  SER  40           HB1      SER  40  88.338   8.892   8.028
  326    H    LYS  41           HN       LYS  41  89.543   7.326   8.021
  327    HA   LYS  41           HA       LYS  41  92.288   6.593   8.863
  328    HB2  LYS  41           HB2      LYS  41  90.786   5.514  10.925
  329    HB3  LYS  41           HB1      LYS  41  91.766   6.973  11.046
  330    HG2  LYS  41           HG2      LYS  41  89.558   7.540  11.829
  331    HG3  LYS  41           HG1      LYS  41  89.750   8.281  10.240
  332    HD2  LYS  41           HD2      LYS  41  88.535   6.428   9.197
  333    HD3  LYS  41           HD1      LYS  41  88.394   5.618  10.757
  334    HE2  LYS  41           HE2      LYS  41  87.213   7.732  11.585
  335    HE3  LYS  41           HE1      LYS  41  87.112   8.216   9.892
  336    HZ1  LYS  41           HZ1      LYS  41  85.405   6.861   9.605
  337    HZ2  LYS  41           HZ2      LYS  41  85.426   6.494  11.264
  338    HZ3  LYS  41           HZ3      LYS  41  86.296   5.531  10.168
  339    HA   PRO  42           HA       PRO  42  91.138   2.728   7.102
  340    HB2  PRO  42           HB2      PRO  42  92.593   0.952   8.591
  341    HB3  PRO  42           HB1      PRO  42  93.324   2.053   7.405
  342    HG2  PRO  42           HG2      PRO  42  93.176   2.304  10.368
  343    HG3  PRO  42           HG1      PRO  42  94.513   2.681   9.267
  344    HD2  PRO  42           HD2      PRO  42  92.861   4.602  10.308
  345    HD3  PRO  42           HD1      PRO  42  93.660   4.766   8.728
  346    HA   PRO  43           HA       PRO  43  87.900   0.879   9.523
  347    HB2  PRO  43           HB2      PRO  43  87.589  -1.511   8.267
  348    HB3  PRO  43           HB1      PRO  43  87.139   0.027   7.504
  349    HG2  PRO  43           HG2      PRO  43  89.577  -1.633   7.098
  350    HG3  PRO  43           HG1      PRO  43  88.595  -0.757   5.910
  351    HD2  PRO  43           HD2      PRO  43  90.977   0.200   6.910
  352    HD3  PRO  43           HD1      PRO  43  89.678   1.245   6.295
  353    H    LYS  44           HN       LYS  44  87.538  -0.657  11.212
  354    HA   LYS  44           HA       LYS  44  89.888  -2.388  11.895
  355    HB2  LYS  44           HB2      LYS  44  89.386  -0.248  13.336
  356    HB3  LYS  44           HB1      LYS  44  88.079  -1.227  14.002
  357    HG2  LYS  44           HG2      LYS  44  89.855  -3.049  14.375
  358    HG3  LYS  44           HG1      LYS  44  91.048  -1.785  14.072
  359    HD2  LYS  44           HD2      LYS  44  89.760  -0.419  15.855
  360    HD3  LYS  44           HD1      LYS  44  89.028  -1.960  16.306
  361    HE2  LYS  44           HE2      LYS  44  91.443  -2.864  16.415
  362    HE3  LYS  44           HE1      LYS  44  91.940  -1.172  16.405
  363    HZ1  LYS  44           HZ1      LYS  44  91.366  -0.958  18.521
  364    HZ2  LYS  44           HZ2      LYS  44  91.135  -2.640  18.583
  365    HZ3  LYS  44           HZ3      LYS  44  89.825  -1.612  18.249
  366    H    LYS  45           HN       LYS  45  86.767  -2.435  10.883
  367    HA   LYS  45           HA       LYS  45  85.119  -4.102  10.884
  368    HB2  LYS  45           HB2      LYS  45  87.347  -5.461  10.597
  369    HB3  LYS  45           HB1      LYS  45  87.054  -5.949  12.266
  370    HG2  LYS  45           HG2      LYS  45  84.758  -6.689  11.597
  371    HG3  LYS  45           HG1      LYS  45  85.168  -6.321   9.921
  372    HD2  LYS  45           HD2      LYS  45  87.197  -7.873  10.265
  373    HD3  LYS  45           HD1      LYS  45  86.367  -8.430  11.718
  374    HE2  LYS  45           HE2      LYS  45  85.542  -8.720   8.843
  375    HE3  LYS  45           HE1      LYS  45  85.586  -9.941  10.114
  376    HZ1  LYS  45           HZ1      LYS  45  83.370  -9.517  10.061
  377    HZ2  LYS  45           HZ2      LYS  45  83.561  -7.907   9.552
  378    HZ3  LYS  45           HZ3      LYS  45  83.827  -8.324  11.178
  379    H    GLY  46           HN       GLY  46  83.546  -4.977  12.326
  380    HA2  GLY  46           HA2      GLY  46  82.776  -5.634  14.536
  381    HA3  GLY  46           HA1      GLY  46  84.115  -4.725  15.237
  382    H    VAL  47           HN       VAL  47  83.909  -2.449  15.467
  383    HA   VAL  47           HA       VAL  47  81.120  -1.518  15.584
  384    HB   VAL  47           HB       VAL  47  82.302   0.596  16.495
  385   HG11  VAL  47          HG11      VAL  47  82.816  -0.614  18.675
  386   HG12  VAL  47          HG12      VAL  47  82.469  -2.119  17.824
  387   HG13  VAL  47          HG13      VAL  47  81.207  -0.902  18.014
  388   HG21  VAL  47          HG21      VAL  47  84.597   0.372  17.142
  389   HG22  VAL  47          HG22      VAL  47  84.520  -0.135  15.454
  390   HG23  VAL  47          HG23      VAL  47  84.614  -1.344  16.734
  391    H    GLN  48           HN       GLN  48  80.185  -0.194  14.096
  392    HA   GLN  48           HA       GLN  48  81.878   0.764  11.838
  393    HB2  GLN  48           HB2      GLN  48  79.759  -0.636  11.473
  394    HB3  GLN  48           HB1      GLN  48  78.856   0.791  11.982
  395    HG2  GLN  48           HG2      GLN  48  78.974   0.951   9.611
  396    HG3  GLN  48           HG1      GLN  48  80.195   2.076  10.207
  397   HE21  GLN  48          HE21      GLN  48  80.073  -1.475   9.512
  398   HE22  GLN  48          HE22      GLN  48  81.549  -1.504   8.675
  399    H    GLY  49           HN       GLY  49  79.102   2.524  11.775
  400    HA2  GLY  49           HA2      GLY  49  79.694   4.552  13.765
  401    HA3  GLY  49           HA1      GLY  49  80.228   5.036  12.154
  402    H1U  RCY  50           H1U      RCY  50  79.178   1.327   7.961
  403    H1S  RCY  50           H1S      RCY  50  74.618   2.780   7.829
  404    HB1  RCY  50           HB1      RCY  50  74.581   2.429  11.920
  405    HB2  RCY  50           HB2      RCY  50  75.932   2.364  10.789
  406    HA   RCY  50           HA       RCY  50  75.786   5.051  11.235
  407    HN1  RCY  50           HN1      RCY  50  77.481   2.939  12.396
  408    H    GLY  51           HN       GLY  51  75.123   2.654  13.815
  409    HA2  GLY  51           HA2      GLY  51  73.760   2.879  15.723
  410    HA3  GLY  51           HA1      GLY  51  74.683   4.362  15.966
  411    H    ASP  52           HN       ASP  52  72.691   3.930  13.124
  412    HA   ASP  52           HA       ASP  52  70.889   5.233  12.358
  413    HB2  ASP  52           HB2      ASP  52  69.742   3.726  13.974
  414    HB3  ASP  52           HB1      ASP  52  70.022   4.914  15.248
  415    H    ASP  53           HN       ASP  53  72.631   7.022  12.336
  416    HA   ASP  53           HA       ASP  53  71.554   9.328  13.865
  417    HB2  ASP  53           HB2      ASP  53  73.545   8.307  15.099
  418    HB3  ASP  53           HB1      ASP  53  74.531   8.801  13.721
  419    H    ILE  54           HN       ILE  54  73.362   8.018  11.171
  420    HA   ILE  54           HA       ILE  54  74.328  10.277   9.878
  421    HB   ILE  54           HB       ILE  54  74.470   7.908   9.038
  422   HG12  ILE  54          HG12      ILE  54  73.455  10.035   7.126
  423   HG13  ILE  54          HG11      ILE  54  75.136   9.729   7.566
  424   HG21  ILE  54          HG21      ILE  54  72.640   6.922   7.871
  425   HG22  ILE  54          HG22      ILE  54  71.738   8.437   7.855
  426   HG23  ILE  54          HG23      ILE  54  71.952   7.554   9.366
  427   HD11  ILE  54          HD11      ILE  54  74.847   8.645   5.469
  428   HD12  ILE  54          HD12      ILE  54  73.285   7.976   5.943
  429   HD13  ILE  54          HD13      ILE  54  74.768   7.351   6.664
  430    HA   PRO  55           HA       PRO  55  70.632  12.739   9.381
  431    HB2  PRO  55           HB2      PRO  55  71.565  14.472   7.444
  432    HB3  PRO  55           HB1      PRO  55  71.929  14.622   9.173
  433    HG2  PRO  55           HG2      PRO  55  73.599  13.511   6.982
  434    HG3  PRO  55           HG1      PRO  55  74.076  14.467   8.394
  435    HD2  PRO  55           HD2      PRO  55  74.438  11.759   8.251
  436    HD3  PRO  55           HD1      PRO  55  74.171  12.617   9.785
  437    H    GLY  56           HN       GLY  56  71.434  10.341   7.451
  438    HA2  GLY  56           HA2      GLY  56  70.278  11.045   4.901
  439    HA3  GLY  56           HA1      GLY  56  70.555   9.401   5.482
  440    H    MET  57           HN       MET  57  68.989   8.747   7.318
  441    HA   MET  57           HA       MET  57  66.693   8.013   7.385
  442    HB2  MET  57           HB2      MET  57  65.499  10.145   8.532
  443    HB3  MET  57           HB1      MET  57  66.650   9.125   9.390
  444    HG2  MET  57           HG2      MET  57  67.371  11.386   9.740
  445    HG3  MET  57           HG1      MET  57  68.479  10.692   8.555
  446    HE1  MET  57           HE1      MET  57  65.239  13.785   8.184
  447    HE2  MET  57           HE2      MET  57  65.405  12.456   9.329
  448    HE3  MET  57           HE3      MET  57  64.625  12.178   7.774
  449    H    GLU  58           HN       GLU  58  66.125   7.874   5.117
  450    HA   GLU  58           HA       GLU  58  64.158   9.962   4.340
  451    HB2  GLU  58           HB2      GLU  58  66.397  10.460   3.253
  452    HB3  GLU  58           HB1      GLU  58  66.243   8.922   2.402
  453    HG2  GLU  58           HG2      GLU  58  63.956   9.763   1.608
  454    HG3  GLU  58           HG1      GLU  58  64.457  11.351   2.188
  455    H    GLY  59           HN       GLY  59  65.669   7.072   2.863
  456    HA2  GLY  59           HA2      GLY  59  63.178   5.554   3.124
  457    HA3  GLY  59           HA1      GLY  59  63.564   6.019   1.466
  458    H1U  RCY  60           H1U      RCY  60  66.412   2.566  -3.391
  459    H1S  RCY  60           H1S      RCY  60  66.464   5.228  -0.264
  460    HB1  RCY  60           HB1      RCY  60  67.558   3.008   1.282
  461    HB2  RCY  60           HB2      RCY  60  68.812   3.414   2.451
  462    HA   RCY  60           HA       RCY  60  66.304   2.465   3.101
  463    HN1  RCY  60           HN1      RCY  60  65.828   5.142   4.054
  464    H    GLY  61           HN       GLY  61  66.917   5.142   5.125
  465    HA2  GLY  61           HA2      GLY  61  69.179   4.025   6.571
  466    HA3  GLY  61           HA1      GLY  61  68.175   5.374   7.109
  467    H    THR  62           HN       THR  62  65.848   3.355   6.462
  468    HA   THR  62           HA       THR  62  65.968   1.975   9.120
  469    HB   THR  62           HB       THR  62  64.140   3.365   9.393
  470    HG1  THR  62           HG1      THR  62  62.430   2.080   9.262
  471   HG21  THR  62          HG21      THR  62  64.264   4.578   7.340
  472   HG22  THR  62          HG22      THR  62  62.621   3.942   7.425
  473   HG23  THR  62          HG23      THR  62  63.818   3.158   6.394
  474    H    ASP  63           HN       ASP  63  64.663   1.701   5.801
  475    HA   ASP  63           HA       ASP  63  63.925  -1.059   6.044
  476    HB2  ASP  63           HB2      ASP  63  63.103  -0.692   3.966
  477    HB3  ASP  63           HB1      ASP  63  63.747   0.944   4.073
  478    H    ILE  64           HN       ILE  64  66.903   0.225   6.387
  479    HA   ILE  64           HA       ILE  64  68.341  -1.886   4.883
  480    HB   ILE  64           HB       ILE  64  69.325   0.311   4.685
  481   HG12  ILE  64          HG12      ILE  64  70.964  -1.206   6.735
  482   HG13  ILE  64          HG11      ILE  64  70.842  -1.690   5.043
  483   HG21  ILE  64          HG21      ILE  64  69.643   0.397   7.689
  484   HG22  ILE  64          HG22      ILE  64  68.232   1.085   6.885
  485   HG23  ILE  64          HG23      ILE  64  69.841   1.713   6.532
  486   HD11  ILE  64          HD11      ILE  64  72.854  -0.301   5.442
  487   HD12  ILE  64          HD12      ILE  64  71.824   1.008   6.022
  488   HD13  ILE  64          HD13      ILE  64  71.730   0.493   4.338
  489    H    THR  65           HN       THR  65  68.160  -0.635   8.213
  490    HA   THR  65           HA       THR  65  68.349  -1.767  10.256
  491    HB   THR  65           HB       THR  65  67.225  -3.662   8.561
  492    HG1  THR  65           HG1      THR  65  66.361  -3.807  10.459
  493   HG21  THR  65          HG21      THR  65  68.436  -5.653   8.630
  494   HG22  THR  65          HG22      THR  65  69.401  -5.135  10.012
  495   HG23  THR  65          HG23      THR  65  69.723  -4.467   8.412
  496    H    VAL  66           HN       VAL  66  70.567  -0.868   8.520
  497    HA   VAL  66           HA       VAL  66  72.899  -0.770   8.742
  498    HB   VAL  66           HB       VAL  66  72.767  -3.072  10.697
  499   HG11  VAL  66          HG11      VAL  66  74.569  -0.638  10.543
  500   HG12  VAL  66          HG12      VAL  66  74.972  -2.209   9.849
  501   HG13  VAL  66          HG13      VAL  66  74.772  -2.041  11.593
  502   HG21  VAL  66          HG21      VAL  66  71.909  -0.216  11.031
  503   HG22  VAL  66          HG22      VAL  66  72.714  -1.024  12.376
  504   HG23  VAL  66          HG23      VAL  66  71.211  -1.679  11.727
  505    H    ILE  67           HN       ILE  67  71.265  -3.847   8.415
  506    HA   ILE  67           HA       ILE  67  73.276  -4.626   6.360
  507    HB   ILE  67           HB       ILE  67  72.130  -6.549   8.404
  508   HG12  ILE  67          HG12      ILE  67  74.904  -5.334   8.187
  509   HG13  ILE  67          HG11      ILE  67  73.725  -4.989   9.453
  510   HG21  ILE  67          HG21      ILE  67  73.714  -8.128   7.431
  511   HG22  ILE  67          HG22      ILE  67  74.340  -6.880   6.353
  512   HG23  ILE  67          HG23      ILE  67  72.693  -7.475   6.150
  513   HD11  ILE  67          HD11      ILE  67  75.102  -7.626   8.893
  514   HD12  ILE  67          HD12      ILE  67  73.727  -7.469   9.986
  515   HD13  ILE  67          HD13      ILE  67  75.238  -6.632  10.343
  516    H1U  RCY  68           H1U      RCY  68  70.577  -0.302  -2.869
  517    H1S  RCY  68           H1S      RCY  68  69.665  -2.160   1.534
  518    HB1  RCY  68           HB1      RCY  68  69.659  -3.066   3.733
  519    HB2  RCY  68           HB2      RCY  68  68.734  -4.157   2.706
  520    HA   RCY  68           HA       RCY  68  69.095  -5.299   4.798
  521    HN1  RCY  68           HN1      RCY  68  71.808  -4.169   4.685
  522    HA   PRO  69           HA       PRO  69  69.753  -9.264   2.953
  523    HB2  PRO  69           HB2      PRO  69  67.945  -8.295   0.760
  524    HB3  PRO  69           HB1      PRO  69  67.892  -9.818   1.670
  525    HG2  PRO  69           HG2      PRO  69  66.231  -7.779   2.194
  526    HG3  PRO  69           HG1      PRO  69  66.823  -8.870   3.456
  527    HD2  PRO  69           HD2      PRO  69  67.502  -6.032   2.983
  528    HD3  PRO  69           HD1      PRO  69  67.692  -7.005   4.458
  529    H    TRP  70           HN       TRP  70  69.923  -6.382   0.941
  530    HA   TRP  70           HA       TRP  70  71.435  -7.575  -1.218
  531    HD1  TRP  70           HD1      TRP  70  72.993  -7.058  -2.542
  532    HE1  TRP  70           HE1      TRP  70  73.295  -6.346  -5.000
  533    HE3  TRP  70           HE3      TRP  70  69.802  -3.075  -2.704
  534    HZ2  TRP  70           HZ2      TRP  70  72.312  -4.347  -6.801
  535    HZ3  TRP  70           HZ3      TRP  70  69.504  -1.788  -4.797
  536    HH2  TRP  70           HH2      TRP  70  70.752  -2.415  -6.844
  537    HB2  TRP  70           HB2      TRP  70  70.077  -5.296  -1.038
  538    HB3  TRP  70           HB1      TRP  70  71.628  -4.660  -0.504
  539    H    GLU  71           HN       GLU  71  72.186  -5.998   1.827
  540    HA   GLU  71           HA       GLU  71  75.017  -5.692   1.388
  541    HB2  GLU  71           HB2      GLU  71  73.154  -4.986   3.378
  542    HB3  GLU  71           HB1      GLU  71  74.291  -6.060   4.186
  543    HG2  GLU  71           HG2      GLU  71  76.146  -4.658   3.088
  544    HG3  GLU  71           HG1      GLU  71  74.882  -3.482   2.724
  545    H    ALA  72           HN       ALA  72  73.822  -8.416   0.856
  546    HA   ALA  72           HA       ALA  72  74.565 -10.289   2.837
  547    HB1  ALA  72           HB1      ALA  72  73.307 -10.978   0.866
  548    HB2  ALA  72           HB2      ALA  72  74.811 -11.898   0.931
  549    HB3  ALA  72           HB3      ALA  72  74.655 -10.542  -0.185
  550    H1U  RCY  73           H1U      RCY  73  75.050  -3.853  -1.055
  551    H1S  RCY  73           H1S      RCY  73  78.347  -6.962  -2.830
  552    HB1  RCY  73           HB1      RCY  73  80.041  -7.870   0.096
  553    HB2  RCY  73           HB2      RCY  73  78.464  -7.082   0.120
  554    HA   RCY  73           HA       RCY  73  78.931  -9.933   1.035
  555    HN1  RCY  73           HN1      RCY  73  76.516  -8.295   0.804
  556    H    ASN  74           HN       ASN  74  77.793  -9.492   3.563
  557    HA   ASN  74           HA       ASN  74  78.577  -7.316   5.086
  558    HB2  ASN  74           HB2      ASN  74  77.351  -9.239   6.015
  559    HB3  ASN  74           HB1      ASN  74  78.804 -10.232   5.890
  560   HD21  ASN  74          HD21      ASN  74  80.408 -10.004   7.528
  561   HD22  ASN  74          HD22      ASN  74  80.251  -8.944   8.843
  562    H    HIS  75           HN       HIS  75  80.633 -10.191   4.457
  563    HA   HIS  75           HA       HIS  75  82.950  -9.443   5.773
  564    HD1  HIS  75           HD1      HIS  75  85.447 -11.235   2.530
  565    HD2  HIS  75           HD2      HIS  75  84.645 -10.853   6.606
  566    HE1  HIS  75           HE1      HIS  75  87.638 -11.648   3.732
  567    HE2  HIS  75           HE2      HIS  75  87.163 -11.418   6.214
  568    HB2  HIS  75           HB2      HIS  75  82.504 -11.501   4.259
  569    HB3  HIS  75           HB1      HIS  75  83.096 -10.486   2.944
  570    H1U  RCY  76           H1U      RCY  76  78.484  -4.773   6.688
  571    H1S  RCY  76           H1S      RCY  76  81.421  -3.007   4.303
  572    HB1  RCY  76           HB1      RCY  76  84.363  -5.340   3.553
  573    HB2  RCY  76           HB2      RCY  76  82.762  -5.604   4.239
  574    HA   RCY  76           HA       RCY  76  82.288  -6.166   1.607
  575    HN1  RCY  76           HN1      RCY  76  81.775  -8.198   2.671
  576    H    GLU  77           HN       GLU  77  83.509  -8.378   0.639
  577    HA   GLU  77           HA       GLU  77  86.337  -8.471   0.640
  578    HB2  GLU  77           HB2      GLU  77  84.310  -9.163  -1.502
  579    HB3  GLU  77           HB1      GLU  77  86.037  -9.440  -1.713
  580    HG2  GLU  77           HG2      GLU  77  85.302 -11.494  -0.847
  581    HG3  GLU  77           HG1      GLU  77  85.875 -10.657   0.596
  582    H    LEU  78           HN       LEU  78  87.322  -8.034  -1.869
  583    HA   LEU  78           HA       LEU  78  86.525  -5.500  -2.990
  584    HG   LEU  78           HG       LEU  78  89.864  -5.070  -0.384
  585    HB2  LEU  78           HB2      LEU  78  88.346  -4.098  -2.258
  586    HB3  LEU  78           HB1      LEU  78  87.559  -4.750  -0.830
  587   HD11  LEU  78          HD11      LEU  78  90.141  -7.452  -0.342
  588   HD12  LEU  78          HD12      LEU  78  89.091  -7.662  -1.744
  589   HD13  LEU  78          HD13      LEU  78  88.409  -7.152  -0.200
  590   HD21  LEU  78          HD21      LEU  78  91.488  -5.364  -1.977
  591   HD22  LEU  78          HD22      LEU  78  90.237  -4.726  -3.044
  592   HD23  LEU  78          HD23      LEU  78  90.496  -6.467  -2.931
  593    H    HIS  79           HN       HIS  79  87.795  -8.396  -3.342
  594    HA   HIS  79           HA       HIS  79  89.636  -7.561  -5.559
  595    HD1  HIS  79           HD1      HIS  79  91.743  -9.038  -2.078
  596    HD2  HIS  79           HD2      HIS  79  92.043  -7.419  -5.911
  597    HE1  HIS  79           HE1      HIS  79  93.794  -7.551  -2.069
  598    HE2  HIS  79           HE2      HIS  79  93.988  -6.560  -4.396
  599    HB2  HIS  79           HB2      HIS  79  89.832  -9.738  -3.514
  600    HB3  HIS  79           HB1      HIS  79  90.452 -10.073  -5.130
  601    H    GLU  80           HN       GLU  80  86.988  -9.641  -4.538
  602    HA   GLU  80           HA       GLU  80  86.893 -10.979  -7.166
  603    HB2  GLU  80           HB2      GLU  80  86.317 -12.035  -4.856
  604    HB3  GLU  80           HB1      GLU  80  84.774 -11.199  -5.032
  605    HG2  GLU  80           HG2      GLU  80  84.453 -12.297  -7.237
  606    HG3  GLU  80           HG1      GLU  80  85.964 -13.176  -7.000
  607    H    LEU  81           HN       LEU  81  84.563  -9.040  -5.235
  608    HA   LEU  81           HA       LEU  81  82.883  -8.552  -7.546
  609    HG   LEU  81           HG       LEU  81  80.780  -8.507  -4.609
  610    HB2  LEU  81           HB2      LEU  81  82.991  -7.507  -4.726
  611    HB3  LEU  81           HB1      LEU  81  81.958  -6.709  -5.910
  612   HD11  LEU  81          HD11      LEU  81  80.896  -9.539  -7.398
  613   HD12  LEU  81          HD12      LEU  81  80.497  -7.832  -7.204
  614   HD13  LEU  81          HD13      LEU  81  79.499  -9.064  -6.431
  615   HD21  LEU  81          HD21      LEU  81  82.518 -10.405  -6.205
  616   HD22  LEU  81          HD22      LEU  81  81.365 -10.810  -4.934
  617   HD23  LEU  81          HD23      LEU  81  82.866  -9.975  -4.530
  618    H    ALA  82           HN       ALA  82  85.795  -7.736  -7.656
  619    HA   ALA  82           HA       ALA  82  86.125  -4.938  -7.555
  620    HB1  ALA  82           HB1      ALA  82  87.988  -6.487  -7.981
  621    HB2  ALA  82           HB2      ALA  82  87.904  -5.260  -9.246
  622    HB3  ALA  82           HB3      ALA  82  87.303  -6.889  -9.555
  623    H    GLN  83           HN       GLN  83  83.797  -6.508  -9.289
  624    HA   GLN  83           HA       GLN  83  83.680  -4.301 -11.310
  625    HB2  GLN  83           HB2      GLN  83  83.846  -7.133 -11.751
  626    HB3  GLN  83           HB1      GLN  83  82.246  -6.594 -12.260
  627    HG2  GLN  83           HG2      GLN  83  83.767  -6.378 -14.144
  628    HG3  GLN  83           HG1      GLN  83  83.345  -4.762 -13.577
  629   HE21  GLN  83          HE21      GLN  83  85.152  -3.432 -13.489
  630   HE22  GLN  83          HE22      GLN  83  86.722  -3.937 -13.086
  631    H    TYR  84           HN       TYR  84  81.450  -3.743 -11.958
  632    HA   TYR  84           HA       TYR  84  79.251  -3.156 -11.381
  633    HD1  TYR  84           HD2      TYR  84  79.400  -4.477 -13.356
  634    HD2  TYR  84           HD1      TYR  84  79.499  -7.833 -10.677
  635    HE1  TYR  84           HE2      TYR  84  80.259  -5.913 -15.187
  636    HE2  TYR  84           HE1      TYR  84  80.358  -9.269 -12.507
  637    HH   TYR  84           HH       TYR  84  81.110  -9.322 -14.601
  638    HB2  TYR  84           HB2      TYR  84  78.955  -5.714  -9.843
  639    HB3  TYR  84           HB1      TYR  84  77.834  -4.951 -10.970
  640    H    GLY  85           HN       GLY  85  81.686  -3.344  -9.238
  641    HA2  GLY  85           HA2      GLY  85  80.040  -2.124  -7.083
  642    HA3  GLY  85           HA1      GLY  85  81.115  -3.457  -6.657
  643    H    ILE  86           HN       ILE  86  82.932  -2.349  -8.911
  644    HA   ILE  86           HA       ILE  86  84.690  -0.830  -9.132
  645    HB   ILE  86           HB       ILE  86  82.663   0.706  -7.928
  646   HG12  ILE  86          HG12      ILE  86  84.093   1.202  -9.945
  647   HG13  ILE  86          HG11      ILE  86  83.893   2.579  -8.860
  648   HG21  ILE  86          HG21      ILE  86  83.827   2.093  -6.295
  649   HG22  ILE  86          HG22      ILE  86  85.306   1.156  -6.510
  650   HG23  ILE  86          HG23      ILE  86  83.889   0.411  -5.770
  651   HD11  ILE  86          HD11      ILE  86  86.070   2.249  -7.903
  652   HD12  ILE  86          HD12      ILE  86  86.272   2.175  -9.653
  653   HD13  ILE  86          HD13      ILE  86  86.252   0.689  -8.704
  654    H1U  RCY  87           H1U      RCY  87  81.850   2.039  -1.763
  655    H1S  RCY  87           H1S      RCY  87  82.217  -1.688  -4.872
  656    HB1  RCY  87           HB1      RCY  87  84.739  -1.582  -3.189
  657    HB2  RCY  87           HB2      RCY  87  85.571  -3.124  -3.000
  658    HA   RCY  87           HA       RCY  87  86.464  -1.516  -4.808
  659    HN1  RCY  87           HN1      RCY  87  83.798  -1.958  -5.908
  Start of MODEL   45
    1    HA   MET   1           HA       MET   1  72.611 -21.368 -14.531
    2    HB2  MET   1           HB2      MET   1  71.457 -19.380 -16.495
    3    HB3  MET   1           HB1      MET   1  71.591 -19.015 -14.774
    4    HG2  MET   1           HG2      MET   1  73.950 -20.003 -16.382
    5    HG3  MET   1           HG1      MET   1  73.559 -18.288 -16.257
    6    HE1  MET   1           HE1      MET   1  76.163 -18.861 -15.613
    7    HE2  MET   1           HE2      MET   1  76.099 -20.510 -14.995
    8    HE3  MET   1           HE3      MET   1  76.676 -19.209 -13.957
    9    H    ASN   2           HN       ASN   2  70.698 -19.992 -13.272
   10    HA   ASN   2           HA       ASN   2  68.018 -21.000 -13.840
   11    HB2  ASN   2           HB2      ASN   2  67.850 -22.231 -11.643
   12    HB3  ASN   2           HB1      ASN   2  68.897 -23.015 -12.828
   13   HD21  ASN   2          HD21      ASN   2  71.248 -22.873 -12.482
   14   HD22  ASN   2          HD22      ASN   2  71.880 -22.462 -10.962
   15    H    LEU   3           HN       LEU   3  68.417 -20.774 -10.526
   16    HA   LEU   3           HA       LEU   3  68.052 -19.055  -8.969
   17    HG   LEU   3           HG       LEU   3  69.488 -17.375  -8.280
   18    HB2  LEU   3           HB2      LEU   3  69.748 -17.893 -10.695
   19    HB3  LEU   3           HB1      LEU   3  68.325 -16.914 -11.044
   20   HD11  LEU   3          HD11      LEU   3  70.041 -14.926  -8.461
   21   HD12  LEU   3          HD12      LEU   3  69.594 -15.004 -10.165
   22   HD13  LEU   3          HD13      LEU   3  70.960 -15.946  -9.569
   23   HD21  LEU   3          HD21      LEU   3  67.161 -15.741  -9.324
   24   HD22  LEU   3          HD22      LEU   3  67.886 -15.465  -7.740
   25   HD23  LEU   3          HD23      LEU   3  67.122 -17.013  -8.103
   26    H    GLU   4           HN       GLU   4  65.835 -19.664  -8.818
   27    HA   GLU   4           HA       GLU   4  63.879 -18.504 -10.669
   28    HB2  GLU   4           HB2      GLU   4  62.391 -19.492  -8.588
   29    HB3  GLU   4           HB1      GLU   4  62.940 -20.464  -9.952
   30    HG2  GLU   4           HG2      GLU   4  63.483 -21.476  -7.718
   31    HG3  GLU   4           HG1      GLU   4  64.903 -21.186  -8.725
   32    HA   PRO   5           HA       PRO   5  62.740 -14.658  -8.876
   33    HB2  PRO   5           HB2      PRO   5  60.210 -16.013  -7.990
   34    HB3  PRO   5           HB1      PRO   5  60.421 -14.439  -8.785
   35    HG2  PRO   5           HG2      PRO   5  59.660 -16.634 -10.128
   36    HG3  PRO   5           HG1      PRO   5  60.657 -15.368 -10.861
   37    HD2  PRO   5           HD2      PRO   5  61.411 -18.119 -10.126
   38    HD3  PRO   5           HD1      PRO   5  62.247 -16.974 -11.197
   39    HA   PRO   6           HA       PRO   6  63.848 -15.547  -4.583
   40    HB2  PRO   6           HB2      PRO   6  64.504 -13.024  -3.833
   41    HB3  PRO   6           HB1      PRO   6  65.543 -13.996  -4.894
   42    HG2  PRO   6           HG2      PRO   6  63.651 -11.811  -5.602
   43    HG3  PRO   6           HG1      PRO   6  65.258 -12.170  -6.256
   44    HD2  PRO   6           HD2      PRO   6  62.893 -12.862  -7.514
   45    HD3  PRO   6           HD1      PRO   6  64.439 -13.700  -7.773
   46    H    LYS   7           HN       LYS   7  62.917 -15.200  -2.487
   47    HA   LYS   7           HA       LYS   7  60.142 -14.218  -2.559
   48    HB2  LYS   7           HB2      LYS   7  61.732 -15.353  -0.236
   49    HB3  LYS   7           HB1      LYS   7  59.982 -15.144  -0.306
   50    HG2  LYS   7           HG2      LYS   7  59.744 -16.815  -1.986
   51    HG3  LYS   7           HG1      LYS   7  61.476 -16.831  -2.319
   52    HD2  LYS   7           HD2      LYS   7  61.858 -17.666   0.016
   53    HD3  LYS   7           HD1      LYS   7  60.110 -17.789   0.212
   54    HE2  LYS   7           HE2      LYS   7  59.937 -19.450  -1.493
   55    HE3  LYS   7           HE1      LYS   7  61.582 -19.149  -2.053
   56    HZ1  LYS   7           HZ1      LYS   7  61.112 -20.001   0.724
   57    HZ2  LYS   7           HZ2      LYS   7  62.491 -20.211  -0.247
   58    HZ3  LYS   7           HZ3      LYS   7  61.104 -21.155  -0.519
   59    H    ALA   8           HN       ALA   8  59.445 -12.793  -0.620
   60    HA   ALA   8           HA       ALA   8  61.434 -11.077   0.595
   61    HB1  ALA   8           HB1      ALA   8  59.886 -10.058  -1.796
   62    HB2  ALA   8           HB2      ALA   8  61.633 -10.048  -1.554
   63    HB3  ALA   8           HB3      ALA   8  60.605  -8.979  -0.600
   64    H    GLU   9           HN       GLU   9  59.024 -12.630   1.319
   65    HA   GLU   9           HA       GLU   9  56.750 -11.024   1.794
   66    HB2  GLU   9           HB2      GLU   9  57.967 -13.321   3.335
   67    HB3  GLU   9           HB1      GLU   9  56.476 -12.542   3.866
   68    HG2  GLU   9           HG2      GLU   9  56.825 -13.570   1.046
   69    HG3  GLU   9           HG1      GLU   9  56.214 -14.594   2.345
   70    H1U  RCY  10           H1U      RCY  10  58.787 -15.042  11.054
   71    H1S  RCY  10           H1S      RCY  10  58.997 -11.360   8.132
   72    HB1  RCY  10           HB1      RCY  10  56.999  -9.123   5.854
   73    HB2  RCY  10           HB2      RCY  10  58.035  -8.959   7.272
   74    HA   RCY  10           HA       RCY  10  59.394  -9.171   5.231
   75    HN1  RCY  10           HN1      RCY  10  58.588 -11.925   4.653
   76    H    ARG  11           HN       ARG  11  59.511  -9.621   8.102
   77    HA   ARG  11           HA       ARG  11  60.839 -12.113   8.675
   78    HE   ARG  11           HE       ARG  11  63.790 -11.268   6.070
   79    HB2  ARG  11           HB2      ARG  11  62.447 -10.524   7.181
   80    HB3  ARG  11           HB1      ARG  11  62.832  -9.897   8.781
   81    HG2  ARG  11           HG2      ARG  11  64.361 -11.643   8.627
   82    HG3  ARG  11           HG1      ARG  11  63.006 -12.463   9.403
   83    HD2  ARG  11           HD2      ARG  11  63.881 -13.786   7.506
   84    HD3  ARG  11           HD1      ARG  11  62.223 -13.265   7.210
   85   HH11  ARG  11          HH21      ARG  11  63.490 -14.696   5.846
   86   HH12  ARG  11          HH22      ARG  11  63.971 -14.762   4.183
   87   HH21  ARG  11          HH11      ARG  11  64.420 -11.335   3.900
   88   HH22  ARG  11          HH12      ARG  11  64.497 -12.860   3.082
   89    H    SER  12           HN       SER  12  60.689  -8.647   9.481
   90    HA   SER  12           HA       SER  12  59.645  -9.172  12.115
   91    HG   SER  12           HG       SER  12  60.579  -8.889  14.006
   92    HB2  SER  12           HB2      SER  12  62.110  -9.807  12.351
   93    HB3  SER  12           HB1      SER  12  62.478  -8.106  12.076
   94    H    ALA  13           HN       ALA  13  60.470  -6.825  13.405
   95    HA   ALA  13           HA       ALA  13  60.028  -4.520  13.442
   96    HB1  ALA  13           HB1      ALA  13  60.838  -3.253  11.654
   97    HB2  ALA  13           HB2      ALA  13  60.309  -4.427  10.449
   98    HB3  ALA  13           HB3      ALA  13  61.727  -4.761  11.443
   99    H    THR  14           HN       THR  14  58.025  -3.648  13.658
  100    HA   THR  14           HA       THR  14  56.006  -4.143  11.514
  101    HB   THR  14           HB       THR  14  54.385  -4.931  13.000
  102    HG1  THR  14           HG1      THR  14  55.251  -4.687  15.410
  103   HG21  THR  14          HG21      THR  14  55.360  -6.762  14.176
  104   HG22  THR  14          HG22      THR  14  56.881  -5.899  14.402
  105   HG23  THR  14          HG23      THR  14  56.419  -6.465  12.797
  106    H    ARG  15           HN       ARG  15  57.621  -1.978  13.497
  107    HA   ARG  15           HA       ARG  15  55.972   0.234  12.599
  108    HE   ARG  15           HE       ARG  15  54.202   0.987  12.161
  109    HB2  ARG  15           HB2      ARG  15  54.549  -0.445  14.445
  110    HB3  ARG  15           HB1      ARG  15  55.934  -0.541  15.531
  111    HG2  ARG  15           HG2      ARG  15  54.617   1.572  15.811
  112    HG3  ARG  15           HG1      ARG  15  56.298   1.861  15.360
  113    HD2  ARG  15           HD2      ARG  15  54.405   3.144  14.084
  114    HD3  ARG  15           HD1      ARG  15  55.744   2.456  13.164
  115   HH11  ARG  15          HH21      ARG  15  53.006   2.280  15.125
  116   HH12  ARG  15          HH22      ARG  15  51.439   1.561  14.960
  117   HH21  ARG  15          HH11      ARG  15  52.162   0.042  11.928
  118   HH22  ARG  15          HH12      ARG  15  50.961   0.294  13.150
  119    H    VAL  16           HN       VAL  16  57.907   1.108  11.832
  120    HA   VAL  16           HA       VAL  16  59.595   2.397  13.866
  121    HB   VAL  16           HB       VAL  16  61.675   1.487  12.579
  122   HG11  VAL  16          HG11      VAL  16  60.888   0.930  14.952
  123   HG12  VAL  16          HG12      VAL  16  61.902  -0.281  14.166
  124   HG13  VAL  16          HG13      VAL  16  60.157  -0.518  14.259
  125   HG21  VAL  16          HG21      VAL  16  60.153   0.424  10.818
  126   HG22  VAL  16          HG22      VAL  16  59.747  -0.783  12.039
  127   HG23  VAL  16          HG23      VAL  16  61.412  -0.621  11.478
  128    H    MET  17           HN       MET  17  58.090   2.313  10.876
  129    HA   MET  17           HA       MET  17  59.896   4.319   9.636
  130    HB2  MET  17           HB2      MET  17  57.405   2.927   8.603
  131    HB3  MET  17           HB1      MET  17  58.361   4.086   7.678
  132    HG2  MET  17           HG2      MET  17  59.518   1.562   8.886
  133    HG3  MET  17           HG1      MET  17  58.933   1.665   7.226
  134    HE1  MET  17           HE1      MET  17  61.476   0.648   7.950
  135    HE2  MET  17           HE2      MET  17  62.234   1.714   9.131
  136    HE3  MET  17           HE3      MET  17  62.908   1.587   7.508
  137    H    GLY  18           HN       GLY  18  57.860   5.727   8.200
  138    HA2  GLY  18           HA2      GLY  18  56.100   6.914  10.258
  139    HA3  GLY  18           HA1      GLY  18  57.320   7.981   9.560
  140    H    GLY  19           HN       GLY  19  54.751   8.733   9.150
  141    HA2  GLY  19           HA2      GLY  19  53.909   7.686   6.503
  142    HA3  GLY  19           HA1      GLY  19  52.952   8.747   7.538
  143    HA   PRO  20           HA       PRO  20  54.121  12.591   5.758
  144    HB2  PRO  20           HB2      PRO  20  56.147  13.010   7.935
  145    HB3  PRO  20           HB1      PRO  20  54.911  14.125   7.318
  146    HG2  PRO  20           HG2      PRO  20  54.587  12.797   9.609
  147    HG3  PRO  20           HG1      PRO  20  53.228  13.140   8.526
  148    HD2  PRO  20           HD2      PRO  20  54.560  10.551   9.089
  149    HD3  PRO  20           HD1      PRO  20  52.922  10.868   8.477
  150    H1U  RCY  21           H1U      RCY  21  56.844   3.955   1.314
  151    H1S  RCY  21           H1S      RCY  21  59.913   7.710   1.604
  152    HB1  RCY  21           HB1      RCY  21  56.687   9.353   3.203
  153    HB2  RCY  21           HB2      RCY  21  58.023   9.561   4.334
  154    HA   RCY  21           HA       RCY  21  58.124  11.911   3.938
  155    HN1  RCY  21           HN1      RCY  21  55.182  11.424   3.964
  156    H    THR  22           HN       THR  22  58.387  13.382   2.326
  157    HA   THR  22           HA       THR  22  57.083  12.847  -0.295
  158    HB   THR  22           HB       THR  22  57.021  15.533   1.110
  159    HG1  THR  22           HG1      THR  22  54.640  14.607   0.427
  160   HG21  THR  22          HG21      THR  22  55.990  14.600  -1.582
  161   HG22  THR  22          HG22      THR  22  57.255  15.795  -1.292
  162   HG23  THR  22          HG23      THR  22  55.586  16.152  -0.848
  163    HA   PRO  23           HA       PRO  23  61.582  13.628  -0.897
  164    HB2  PRO  23           HB2      PRO  23  60.769  12.758  -3.633
  165    HB3  PRO  23           HB1      PRO  23  62.124  12.205  -2.630
  166    HG2  PRO  23           HG2      PRO  23  59.944  10.712  -2.988
  167    HG3  PRO  23           HG1      PRO  23  60.818  10.731  -1.447
  168    HD2  PRO  23           HD2      PRO  23  58.206  12.011  -2.146
  169    HD3  PRO  23           HD1      PRO  23  58.753  11.333  -0.595
  170    H    ARG  24           HN       ARG  24  62.716  15.210  -2.229
  171    HA   ARG  24           HA       ARG  24  61.497  16.770  -4.271
  172    HE   ARG  24           HE       ARG  24  56.919  19.234  -2.762
  173    HB2  ARG  24           HB2      ARG  24  60.605  17.432  -1.625
  174    HB3  ARG  24           HB1      ARG  24  61.604  18.761  -2.209
  175    HG2  ARG  24           HG2      ARG  24  60.268  18.778  -4.324
  176    HG3  ARG  24           HG1      ARG  24  59.217  17.543  -3.630
  177    HD2  ARG  24           HD2      ARG  24  58.984  19.218  -1.636
  178    HD3  ARG  24           HD1      ARG  24  59.558  20.414  -2.798
  179   HH11  ARG  24          HH21      ARG  24  59.479  20.381  -4.766
  180   HH12  ARG  24          HH22      ARG  24  58.437  20.804  -6.083
  181   HH21  ARG  24          HH11      ARG  24  55.543  19.780  -4.471
  182   HH22  ARG  24          HH12      ARG  24  56.209  20.464  -5.916
  183    H    LYS  25           HN       LYS  25  63.484  16.888  -5.261
  184    HA   LYS  25           HA       LYS  25  65.599  18.440  -3.831
  185    HB2  LYS  25           HB2      LYS  25  67.176  16.839  -5.276
  186    HB3  LYS  25           HB1      LYS  25  66.626  16.371  -3.669
  187    HG2  LYS  25           HG2      LYS  25  64.832  15.701  -5.955
  188    HG3  LYS  25           HG1      LYS  25  66.319  14.764  -5.802
  189    HD2  LYS  25           HD2      LYS  25  64.641  15.211  -3.359
  190    HD3  LYS  25           HD1      LYS  25  64.127  13.999  -4.533
  191    HE2  LYS  25           HE2      LYS  25  66.230  12.821  -4.337
  192    HE3  LYS  25           HE1      LYS  25  66.908  14.103  -3.334
  193    HZ1  LYS  25           HZ1      LYS  25  64.896  12.076  -2.653
  194    HZ2  LYS  25           HZ2      LYS  25  64.851  13.577  -1.858
  195    HZ3  LYS  25           HZ3      LYS  25  66.240  12.603  -1.761
  196    H    GLY  26           HN       GLY  26  65.356  16.918  -7.060
  197    HA2  GLY  26           HA2      GLY  26  64.600  19.013  -8.661
  198    HA3  GLY  26           HA1      GLY  26  66.287  19.394  -8.308
  199    HA   PRO  27           HA       PRO  27  65.828  16.680 -12.196
  200    HB2  PRO  27           HB2      PRO  27  68.186  18.453 -12.730
  201    HB3  PRO  27           HB1      PRO  27  66.918  17.901 -13.843
  202    HG2  PRO  27           HG2      PRO  27  66.913  20.366 -12.834
  203    HG3  PRO  27           HG1      PRO  27  65.410  19.472 -13.117
  204    HD2  PRO  27           HD2      PRO  27  66.744  20.128 -10.541
  205    HD3  PRO  27           HD1      PRO  27  65.028  19.811 -10.875
  206    HA   PRO  28           HA       PRO  28  68.677  13.743 -10.311
  207    HB2  PRO  28           HB2      PRO  28  68.961  12.933 -13.187
  208    HB3  PRO  28           HB1      PRO  28  68.707  11.919 -11.753
  209    HG2  PRO  28           HG2      PRO  28  66.713  12.511 -13.430
  210    HG3  PRO  28           HG1      PRO  28  66.452  12.345 -11.687
  211    HD2  PRO  28           HD2      PRO  28  66.420  14.797 -13.354
  212    HD3  PRO  28           HD1      PRO  28  65.664  14.498 -11.774
  213    H    LYS  29           HN       LYS  29  70.798  14.100  -9.812
  214    HA   LYS  29           HA       LYS  29  72.669  14.994 -11.942
  215    HB2  LYS  29           HB2      LYS  29  71.984  16.482  -9.412
  216    HB3  LYS  29           HB1      LYS  29  73.603  16.618 -10.093
  217    HG2  LYS  29           HG2      LYS  29  71.197  17.004 -11.857
  218    HG3  LYS  29           HG1      LYS  29  71.768  18.329 -10.841
  219    HD2  LYS  29           HD2      LYS  29  73.833  16.881 -12.419
  220    HD3  LYS  29           HD1      LYS  29  72.717  17.901 -13.328
  221    HE2  LYS  29           HE2      LYS  29  74.663  19.222 -12.666
  222    HE3  LYS  29           HE1      LYS  29  73.242  19.790 -11.789
  223    HZ1  LYS  29           HZ1      LYS  29  75.370  19.391 -10.473
  224    HZ2  LYS  29           HZ2      LYS  29  75.031  17.736 -10.648
  225    HZ3  LYS  29           HZ3      LYS  29  73.930  18.751  -9.844
  226    H1U  RCY  30           H1U      RCY  30  80.539  14.161 -10.476
  227    H1S  RCY  30           H1S      RCY  30  77.214  15.701  -8.028
  228    HB1  RCY  30           HB1      RCY  30  75.452  12.381  -7.469
  229    HB2  RCY  30           HB2      RCY  30  74.044  13.404  -7.746
  230    HA   RCY  30           HA       RCY  30  76.560  14.158  -9.159
  231    HN1  RCY  30           HN1      RCY  30  74.859  15.421 -10.166
  232    H    LYS  31           HN       LYS  31  76.472  13.255 -11.574
  233    HA   LYS  31           HA       LYS  31  75.705  10.401 -11.652
  234    HB2  LYS  31           HB2      LYS  31  76.745  10.661 -14.037
  235    HB3  LYS  31           HB1      LYS  31  75.189  11.416 -13.698
  236    HG2  LYS  31           HG2      LYS  31  77.526  13.090 -13.022
  237    HG3  LYS  31           HG1      LYS  31  77.348  12.746 -14.743
  238    HD2  LYS  31           HD2      LYS  31  74.972  13.496 -14.608
  239    HD3  LYS  31           HD1      LYS  31  75.237  13.939 -12.922
  240    HE2  LYS  31           HE2      LYS  31  76.685  15.692 -13.472
  241    HE3  LYS  31           HE1      LYS  31  77.064  15.013 -15.055
  242    HZ1  LYS  31           HZ1      LYS  31  74.836  15.522 -15.790
  243    HZ2  LYS  31           HZ2      LYS  31  75.583  16.931 -15.205
  244    HZ3  LYS  31           HZ3      LYS  31  74.427  16.124 -14.257
  245    H    GLN  32           HN       GLN  32  78.551  11.616 -13.248
  246    HA   GLN  32           HA       GLN  32  80.250   9.499 -12.702
  247    HB2  GLN  32           HB2      GLN  32  81.293  12.331 -12.615
  248    HB3  GLN  32           HB1      GLN  32  82.061  10.897 -13.298
  249    HG2  GLN  32           HG2      GLN  32  80.157  10.805 -14.973
  250    HG3  GLN  32           HG1      GLN  32  79.662  12.392 -14.384
  251   HE21  GLN  32          HE21      GLN  32  81.861  10.748 -16.492
  252   HE22  GLN  32          HE22      GLN  32  82.778  12.103 -16.944
  253    H    ARG  33           HN       ARG  33  81.968   9.201 -11.103
  254    HA   ARG  33           HA       ARG  33  81.582  10.693  -8.547
  255    HE   ARG  33           HE       ARG  33  78.506   6.747  -8.866
  256    HB2  ARG  33           HB2      ARG  33  81.905   8.391  -7.406
  257    HB3  ARG  33           HB1      ARG  33  80.320   8.741  -8.094
  258    HG2  ARG  33           HG2      ARG  33  82.341   7.460  -9.880
  259    HG3  ARG  33           HG1      ARG  33  81.602   6.455  -8.633
  260    HD2  ARG  33           HD2      ARG  33  79.787   8.190 -10.245
  261    HD3  ARG  33           HD1      ARG  33  80.470   6.772 -11.041
  262   HH11  ARG  33          HH21      ARG  33  80.970   5.091 -10.617
  263   HH12  ARG  33          HH22      ARG  33  80.391   3.512 -10.201
  264   HH21  ARG  33          HH11      ARG  33  77.735   4.696  -8.312
  265   HH22  ARG  33          HH12      ARG  33  78.559   3.289  -8.896
  266    H    GLN  34           HN       GLN  34  83.635  11.549  -9.785
  267    HA   GLN  34           HA       GLN  34  85.992   9.796  -9.333
  268    HB2  GLN  34           HB2      GLN  34  86.018  12.577 -10.518
  269    HB3  GLN  34           HB1      GLN  34  87.205  11.290 -10.726
  270    HG2  GLN  34           HG2      GLN  34  86.065  11.003 -12.702
  271    HG3  GLN  34           HG1      GLN  34  85.036  10.008 -11.671
  272   HE21  GLN  34          HE21      GLN  34  84.628  12.102 -14.070
  273   HE22  GLN  34          HE22      GLN  34  83.262  12.961 -13.543
  274    H    THR  35           HN       THR  35  86.748   9.903  -7.266
  275    HA   THR  35           HA       THR  35  87.452  12.548  -6.168
  276    HB   THR  35           HB       THR  35  86.354  11.891  -3.945
  277    HG1  THR  35           HG1      THR  35  84.614  10.438  -4.186
  278   HG21  THR  35          HG21      THR  35  85.495  13.623  -5.571
  279   HG22  THR  35          HG22      THR  35  84.248  12.877  -4.572
  280   HG23  THR  35          HG23      THR  35  84.452  12.374  -6.250
  281    H    ARG  36           HN       ARG  36  87.023   9.571  -4.321
  282    HA   ARG  36           HA       ARG  36  89.986   9.467  -3.959
  283    HE   ARG  36           HE       ARG  36  90.906   6.087  -0.225
  284    HB2  ARG  36           HB2      ARG  36  88.764   9.660  -1.875
  285    HB3  ARG  36           HB1      ARG  36  87.701   8.326  -2.324
  286    HG2  ARG  36           HG2      ARG  36  89.393   6.718  -2.058
  287    HG3  ARG  36           HG1      ARG  36  90.682   7.915  -2.194
  288    HD2  ARG  36           HD2      ARG  36  90.075   8.865  -0.024
  289    HD3  ARG  36           HD1      ARG  36  88.714   7.751   0.107
  290   HH11  ARG  36          HH21      ARG  36  90.016   8.676   1.870
  291   HH12  ARG  36          HH22      ARG  36  90.925   8.075   3.217
  292   HH21  ARG  36          HH11      ARG  36  92.097   5.287   1.522
  293   HH22  ARG  36          HH12      ARG  36  92.102   6.156   3.019
  294    H    GLN  37           HN       GLN  37  87.628   8.049  -5.811
  295    HA   GLN  37           HA       GLN  37  87.567   6.066  -7.062
  296    HB2  GLN  37           HB2      GLN  37  90.430   5.596  -6.221
  297    HB3  GLN  37           HB1      GLN  37  89.641   5.143  -7.732
  298    HG2  GLN  37           HG2      GLN  37  89.314   7.657  -8.131
  299    HG3  GLN  37           HG1      GLN  37  90.464   7.903  -6.816
  300   HE21  GLN  37          HE21      GLN  37  91.423   5.036  -8.136
  301   HE22  GLN  37          HE22      GLN  37  92.541   5.599  -9.283
  302    H1U  RCY  38           H1U      RCY  38  81.269   4.319  -8.271
  303    H1S  RCY  38           H1S      RCY  38  84.936   4.724  -6.598
  304    HB1  RCY  38           HB1      RCY  38  86.852   3.438  -2.895
  305    HB2  RCY  38           HB2      RCY  38  85.640   2.321  -3.523
  306    HA   RCY  38           HA       RCY  38  88.206   2.371  -4.409
  307    HN1  RCY  38           HN1      RCY  38  87.320   3.766  -6.733
  308    H    LYS  39           HN       LYS  39  87.255   2.311  -7.390
  309    HA   LYS  39           HA       LYS  39  85.145   0.512  -7.750
  310    HB2  LYS  39           HB2      LYS  39  86.554   1.643  -9.550
  311    HB3  LYS  39           HB1      LYS  39  87.743   0.367  -9.298
  312    HG2  LYS  39           HG2      LYS  39  86.334  -0.329 -11.127
  313    HG3  LYS  39           HG1      LYS  39  85.896  -1.312  -9.729
  314    HD2  LYS  39           HD2      LYS  39  84.367   1.147  -9.752
  315    HD3  LYS  39           HD1      LYS  39  84.170   0.284 -11.278
  316    HE2  LYS  39           HE2      LYS  39  83.972  -1.172  -8.646
  317    HE3  LYS  39           HE1      LYS  39  82.577  -0.328  -9.320
  318    HZ1  LYS  39           HZ1      LYS  39  83.370  -2.854  -9.947
  319    HZ2  LYS  39           HZ2      LYS  39  83.942  -1.935 -11.256
  320    HZ3  LYS  39           HZ3      LYS  39  82.293  -1.901 -10.847
  321    H    SER  40           HN       SER  40  88.192  -0.052  -6.242
  322    HA   SER  40           HA       SER  40  87.482  -2.939  -5.969
  323    HG   SER  40           HG       SER  40  88.582  -3.806  -7.917
  324    HB2  SER  40           HB2      SER  40  90.187  -1.806  -6.724
  325    HB3  SER  40           HB1      SER  40  89.949  -3.456  -6.157
  326    H    LYS  41           HN       LYS  41  87.424  -3.467  -3.849
  327    HA   LYS  41           HA       LYS  41  89.193  -1.973  -1.956
  328    HB2  LYS  41           HB2      LYS  41  87.120  -2.457  -0.343
  329    HB3  LYS  41           HB1      LYS  41  87.162  -1.019  -1.364
  330    HG2  LYS  41           HG2      LYS  41  85.726  -1.990  -2.984
  331    HG3  LYS  41           HG1      LYS  41  85.955  -3.613  -2.331
  332    HD2  LYS  41           HD2      LYS  41  84.834  -2.865  -0.219
  333    HD3  LYS  41           HD1      LYS  41  84.497  -1.316  -0.993
  334    HE2  LYS  41           HE2      LYS  41  83.372  -4.030  -1.625
  335    HE3  LYS  41           HE1      LYS  41  82.525  -2.496  -1.417
  336    HZ1  LYS  41           HZ1      LYS  41  83.950  -1.837  -3.484
  337    HZ2  LYS  41           HZ2      LYS  41  82.499  -2.701  -3.675
  338    HZ3  LYS  41           HZ3      LYS  41  83.990  -3.513  -3.746
  339    HA   PRO  42           HA       PRO  42  90.262  -6.046  -0.586
  340    HB2  PRO  42           HB2      PRO  42  91.100  -5.566   1.955
  341    HB3  PRO  42           HB1      PRO  42  92.006  -5.009   0.534
  342    HG2  PRO  42           HG2      PRO  42  90.171  -3.482   2.313
  343    HG3  PRO  42           HG1      PRO  42  91.714  -2.992   1.593
  344    HD2  PRO  42           HD2      PRO  42  89.262  -2.255   0.576
  345    HD3  PRO  42           HD1      PRO  42  90.738  -2.379  -0.407
  346    HA   PRO  43           HA       PRO  43  86.765  -7.680   1.658
  347    HB2  PRO  43           HB2      PRO  43  87.694 -10.148   2.298
  348    HB3  PRO  43           HB1      PRO  43  87.310  -9.687   0.627
  349    HG2  PRO  43           HG2      PRO  43  89.961  -9.838   1.975
  350    HG3  PRO  43           HG1      PRO  43  89.497 -10.332   0.339
  351    HD2  PRO  43           HD2      PRO  43  90.779  -7.959   0.901
  352    HD3  PRO  43           HD1      PRO  43  89.730  -8.199  -0.514
  353    H    LYS  44           HN       LYS  44  86.077  -7.389   3.750
  354    HA   LYS  44           HA       LYS  44  86.164  -7.045   6.067
  355    HB2  LYS  44           HB2      LYS  44  87.960  -9.370   5.538
  356    HB3  LYS  44           HB1      LYS  44  88.088  -8.619   7.126
  357    HG2  LYS  44           HG2      LYS  44  85.370  -9.247   6.013
  358    HG3  LYS  44           HG1      LYS  44  86.330 -10.540   6.734
  359    HD2  LYS  44           HD2      LYS  44  85.894  -7.920   8.168
  360    HD3  LYS  44           HD1      LYS  44  84.736  -9.244   8.298
  361    HE2  LYS  44           HE2      LYS  44  86.090  -9.827  10.059
  362    HE3  LYS  44           HE1      LYS  44  86.999 -10.620   8.772
  363    HZ1  LYS  44           HZ1      LYS  44  87.833  -8.548  10.455
  364    HZ2  LYS  44           HZ2      LYS  44  87.773  -7.935   8.872
  365    HZ3  LYS  44           HZ3      LYS  44  88.707  -9.311   9.217
  366    H    LYS  45           HN       LYS  45  86.932  -5.147   6.839
  367    HA   LYS  45           HA       LYS  45  89.732  -4.751   7.409
  368    HB2  LYS  45           HB2      LYS  45  89.551  -4.377   4.865
  369    HB3  LYS  45           HB1      LYS  45  88.641  -2.921   5.264
  370    HG2  LYS  45           HG2      LYS  45  90.782  -2.039   5.195
  371    HG3  LYS  45           HG1      LYS  45  90.701  -2.499   6.896
  372    HD2  LYS  45           HD2      LYS  45  91.684  -4.748   6.201
  373    HD3  LYS  45           HD1      LYS  45  92.011  -4.015   4.630
  374    HE2  LYS  45           HE2      LYS  45  93.181  -2.136   5.962
  375    HE3  LYS  45           HE1      LYS  45  93.150  -3.260   7.320
  376    HZ1  LYS  45           HZ1      LYS  45  94.574  -4.697   6.290
  377    HZ2  LYS  45           HZ2      LYS  45  95.152  -3.223   5.674
  378    HZ3  LYS  45           HZ3      LYS  45  94.140  -4.204   4.726
  379    H    GLY  46           HN       GLY  46  86.648  -3.085   6.728
  380    HA2  GLY  46           HA2      GLY  46  87.244  -1.109   8.847
  381    HA3  GLY  46           HA1      GLY  46  85.859  -1.065   7.756
  382    H    VAL  47           HN       VAL  47  86.022  -0.939  10.760
  383    HA   VAL  47           HA       VAL  47  83.868  -2.900  11.266
  384    HB   VAL  47           HB       VAL  47  84.954  -3.715  13.338
  385   HG11  VAL  47          HG11      VAL  47  85.249  -4.838  11.059
  386   HG12  VAL  47          HG12      VAL  47  86.459  -5.237  12.278
  387   HG13  VAL  47          HG13      VAL  47  86.841  -4.081  11.002
  388   HG21  VAL  47          HG21      VAL  47  87.472  -3.247  13.493
  389   HG22  VAL  47          HG22      VAL  47  86.404  -1.912  13.926
  390   HG23  VAL  47          HG23      VAL  47  87.192  -1.936  12.348
  391    H    GLN  48           HN       GLN  48  82.314  -1.943  12.520
  392    HA   GLN  48           HA       GLN  48  81.251  -0.267  13.776
  393    HB2  GLN  48           HB2      GLN  48  82.907  -1.271  15.461
  394    HB3  GLN  48           HB1      GLN  48  83.937   0.117  15.112
  395    HG2  GLN  48           HG2      GLN  48  82.284   1.660  15.894
  396    HG3  GLN  48           HG1      GLN  48  81.044   0.407  15.948
  397   HE21  GLN  48          HE21      GLN  48  81.923   2.056  18.238
  398   HE22  GLN  48          HE22      GLN  48  82.552   0.982  19.392
  399    H    GLY  49           HN       GLY  49  82.002   0.636  11.322
  400    HA2  GLY  49           HA2      GLY  49  81.861   3.331  11.273
  401    HA3  GLY  49           HA1      GLY  49  83.575   3.112  11.635
  402    H1U  RCY  50           H1U      RCY  50  84.753   4.335   1.708
  403    H1S  RCY  50           H1S      RCY  50  81.458   3.927   5.144
  404    HB1  RCY  50           HB1      RCY  50  84.563   3.504   6.016
  405    HB2  RCY  50           HB2      RCY  50  84.852   4.472   7.461
  406    HA   RCY  50           HA       RCY  50  83.972   1.567   7.450
  407    HN1  RCY  50           HN1      RCY  50  84.912   2.881   9.910
  408    H    GLY  51           HN       GLY  51  86.360   3.490   6.420
  409    HA2  GLY  51           HA2      GLY  51  88.644   2.165   7.706
  410    HA3  GLY  51           HA1      GLY  51  88.368   1.694   6.027
  411    H    ASP  52           HN       ASP  52  87.578   4.909   7.148
  412    HA   ASP  52           HA       ASP  52  90.096   6.021   6.059
  413    HB2  ASP  52           HB2      ASP  52  88.658   5.878   4.084
  414    HB3  ASP  52           HB1      ASP  52  87.354   6.695   4.948
  415    H    ASP  53           HN       ASP  53  86.812   7.073   7.065
  416    HA   ASP  53           HA       ASP  53  87.633   8.271   9.501
  417    HB2  ASP  53           HB2      ASP  53  88.095   9.889   7.064
  418    HB3  ASP  53           HB1      ASP  53  87.225  10.729   8.346
  419    H    ILE  54           HN       ILE  54  85.587   7.391  10.079
  420    HA   ILE  54           HA       ILE  54  83.121   7.690   8.848
  421    HB   ILE  54           HB       ILE  54  83.350   8.123  11.819
  422   HG12  ILE  54          HG12      ILE  54  83.389   5.441  11.676
  423   HG13  ILE  54          HG11      ILE  54  84.287   5.797  10.200
  424   HG21  ILE  54          HG21      ILE  54  81.390   6.615  11.813
  425   HG22  ILE  54          HG22      ILE  54  81.518   6.462  10.060
  426   HG23  ILE  54          HG23      ILE  54  81.116   8.020  10.783
  427   HD11  ILE  54          HD11      ILE  54  85.566   7.492  11.803
  428   HD12  ILE  54          HD12      ILE  54  86.028   5.792  11.725
  429   HD13  ILE  54          HD13      ILE  54  85.012   6.370  13.046
  430    HA   PRO  55           HA       PRO  55  82.957  12.230   9.116
  431    HB2  PRO  55           HB2      PRO  55  81.269  12.642   7.048
  432    HB3  PRO  55           HB1      PRO  55  82.972  12.208   6.793
  433    HG2  PRO  55           HG2      PRO  55  80.545  10.506   6.595
  434    HG3  PRO  55           HG1      PRO  55  82.018  10.494   5.613
  435    HD2  PRO  55           HD2      PRO  55  81.470   8.719   7.702
  436    HD3  PRO  55           HD1      PRO  55  83.084   9.040   7.031
  437    H    GLY  56           HN       GLY  56  80.169  10.048   8.940
  438    HA2  GLY  56           HA2      GLY  56  78.228  12.003   9.818
  439    HA3  GLY  56           HA1      GLY  56  77.996  10.255   9.817
  440    H    MET  57           HN       MET  57  79.571   9.169  11.562
  441    HA   MET  57           HA       MET  57  80.150   8.944  13.827
  442    HB2  MET  57           HB2      MET  57  80.980  11.426  13.327
  443    HB3  MET  57           HB1      MET  57  79.616  11.848  14.361
  444    HG2  MET  57           HG2      MET  57  80.484  10.416  16.145
  445    HG3  MET  57           HG1      MET  57  81.812   9.894  15.109
  446    HE1  MET  57           HE1      MET  57  84.506  12.212  15.689
  447    HE2  MET  57           HE2      MET  57  83.798  11.136  14.486
  448    HE3  MET  57           HE3      MET  57  83.928  10.609  16.162
  449    H    GLU  58           HN       GLU  58  77.232   9.840  12.600
  450    HA   GLU  58           HA       GLU  58  75.869   9.258  15.187
  451    HB2  GLU  58           HB2      GLU  58  74.129  10.964  14.589
  452    HB3  GLU  58           HB1      GLU  58  75.706  11.673  14.934
  453    HG2  GLU  58           HG2      GLU  58  76.117  11.470  12.377
  454    HG3  GLU  58           HG1      GLU  58  74.367  11.281  12.261
  455    H    GLY  59           HN       GLY  59  74.517   7.557  14.887
  456    HA2  GLY  59           HA2      GLY  59  73.050   6.062  13.818
  457    HA3  GLY  59           HA1      GLY  59  72.767   7.316  12.608
  458    H1U  RCY  60           H1U      RCY  60  72.644   7.298   6.503
  459    H1S  RCY  60           H1S      RCY  60  75.596   6.574   9.528
  460    HB1  RCY  60           HB1      RCY  60  77.969   6.029   9.910
  461    HB2  RCY  60           HB2      RCY  60  78.498   6.403  11.549
  462    HA   RCY  60           HA       RCY  60  76.082   4.893  10.632
  463    HN1  RCY  60           HN1      RCY  60  76.049   6.527  13.142
  464    H    GLY  61           HN       GLY  61  76.017   4.230  13.662
  465    HA2  GLY  61           HA2      GLY  61  78.055   2.102  13.472
  466    HA3  GLY  61           HA1      GLY  61  78.233   3.226  14.820
  467    H    THR  62           HN       THR  62  75.285   3.563  15.062
  468    HA   THR  62           HA       THR  62  74.813   1.166  16.716
  469    HB   THR  62           HB       THR  62  73.192   2.420  17.820
  470    HG1  THR  62           HG1      THR  62  71.954   3.942  16.817
  471   HG21  THR  62          HG21      THR  62  74.104   4.602  18.199
  472   HG22  THR  62          HG22      THR  62  74.825   4.650  16.590
  473   HG23  THR  62          HG23      THR  62  75.469   3.554  17.813
  474    H    ASP  63           HN       ASP  63  72.803   2.969  14.351
  475    HA   ASP  63           HA       ASP  63  70.949   0.852  13.938
  476    HB2  ASP  63           HB2      ASP  63  70.283   2.065  11.915
  477    HB3  ASP  63           HB1      ASP  63  70.559   3.205  13.233
  478    H    ILE  64           HN       ILE  64  74.096   1.501  12.494
  479    HA   ILE  64           HA       ILE  64  73.739  -0.637  10.495
  480    HB   ILE  64           HB       ILE  64  75.013   1.276   9.771
  481   HG12  ILE  64          HG12      ILE  64  77.047  -0.876  10.396
  482   HG13  ILE  64          HG11      ILE  64  75.795  -1.089   9.171
  483   HG21  ILE  64          HG21      ILE  64  76.718   0.726  12.219
  484   HG22  ILE  64          HG22      ILE  64  75.696   2.137  11.946
  485   HG23  ILE  64          HG23      ILE  64  77.134   1.884  10.956
  486   HD11  ILE  64          HD11      ILE  64  77.877   1.116   9.224
  487   HD12  ILE  64          HD12      ILE  64  76.592   0.965   8.026
  488   HD13  ILE  64          HD13      ILE  64  77.854  -0.264   8.125
  489    H    THR  65           HN       THR  65  75.076  -0.200  13.659
  490    HA   THR  65           HA       THR  65  76.604  -1.569  14.886
  491    HB   THR  65           HB       THR  65  74.135  -2.348  15.159
  492    HG1  THR  65           HG1      THR  65  75.788  -4.485  15.723
  493   HG21  THR  65          HG21      THR  65  74.455  -3.629  12.865
  494   HG22  THR  65          HG22      THR  65  73.455  -4.319  14.143
  495   HG23  THR  65          HG23      THR  65  75.107  -4.891  13.911
  496    H    VAL  66           HN       VAL  66  77.336  -1.391  12.085
  497    HA   VAL  66           HA       VAL  66  78.867  -2.410  10.636
  498    HB   VAL  66           HB       VAL  66  79.158  -4.734  12.525
  499   HG11  VAL  66          HG11      VAL  66  81.205  -3.086  11.018
  500   HG12  VAL  66          HG12      VAL  66  80.424  -4.518  10.347
  501   HG13  VAL  66          HG13      VAL  66  81.450  -4.660  11.775
  502   HG21  VAL  66          HG21      VAL  66  79.338  -3.153  14.196
  503   HG22  VAL  66          HG22      VAL  66  79.764  -1.862  13.072
  504   HG23  VAL  66          HG23      VAL  66  80.977  -3.049  13.552
  505    H    ILE  67           HN       ILE  67  76.188  -4.124  11.984
  506    HA   ILE  67           HA       ILE  67  75.893  -5.621   9.426
  507    HB   ILE  67           HB       ILE  67  75.625  -6.783  12.213
  508   HG12  ILE  67          HG12      ILE  67  77.304  -7.698   9.863
  509   HG13  ILE  67          HG11      ILE  67  77.918  -6.632  11.127
  510   HG21  ILE  67          HG21      ILE  67  75.065  -8.893  10.853
  511   HG22  ILE  67          HG22      ILE  67  74.748  -7.800   9.506
  512   HG23  ILE  67          HG23      ILE  67  73.795  -7.676  10.985
  513   HD11  ILE  67          HD11      ILE  67  77.606  -8.293  12.815
  514   HD12  ILE  67          HD12      ILE  67  78.369  -9.125  11.460
  515   HD13  ILE  67          HD13      ILE  67  76.637  -9.301  11.741
  516    H1U  RCY  68           H1U      RCY  68  71.914   2.352   4.569
  517    H1S  RCY  68           H1S      RCY  68  73.430  -2.039   5.816
  518    HB1  RCY  68           HB1      RCY  68  72.121  -1.833   9.960
  519    HB2  RCY  68           HB2      RCY  68  71.230  -2.382   8.543
  520    HA   RCY  68           HA       RCY  68  71.864  -4.005  10.633
  521    HN1  RCY  68           HN1      RCY  68  74.225  -4.146   8.820
  522    HA   PRO  69           HA       PRO  69  69.283  -6.768   8.390
  523    HB2  PRO  69           HB2      PRO  69  67.247  -4.939   7.555
  524    HB3  PRO  69           HB1      PRO  69  67.226  -5.992   8.979
  525    HG2  PRO  69           HG2      PRO  69  67.849  -3.127   8.770
  526    HG3  PRO  69           HG1      PRO  69  67.235  -4.058  10.145
  527    HD2  PRO  69           HD2      PRO  69  69.793  -3.132  10.044
  528    HD3  PRO  69           HD1      PRO  69  69.364  -4.648  10.871
  529    H    TRP  70           HN       TRP  70  69.892  -3.645   6.816
  530    HA   TRP  70           HA       TRP  70  69.417  -4.718   4.133
  531    HD1  TRP  70           HD1      TRP  70  68.155  -2.715   2.252
  532    HE1  TRP  70           HE1      TRP  70  65.806  -1.854   2.873
  533    HE3  TRP  70           HE3      TRP  70  68.901  -1.591   7.177
  534    HZ2  TRP  70           HZ2      TRP  70  64.424  -0.823   5.160
  535    HZ3  TRP  70           HZ3      TRP  70  67.057  -0.674   8.550
  536    HH2  TRP  70           HH2      TRP  70  64.822  -0.288   7.552
  537    HB2  TRP  70           HB2      TRP  70  70.509  -2.106   5.197
  538    HB3  TRP  70           HB1      TRP  70  70.510  -2.478   3.474
  539    H    GLU  71           HN       GLU  71  71.799  -5.248   6.322
  540    HA   GLU  71           HA       GLU  71  74.106  -5.023   4.522
  541    HB2  GLU  71           HB2      GLU  71  73.986  -4.858   7.173
  542    HB3  GLU  71           HB1      GLU  71  74.171  -6.607   7.075
  543    HG2  GLU  71           HG2      GLU  71  76.061  -5.636   5.266
  544    HG3  GLU  71           HG1      GLU  71  76.157  -4.512   6.622
  545    H    ALA  72           HN       ALA  72  71.984  -7.564   5.782
  546    HA   ALA  72           HA       ALA  72  73.505  -9.715   4.533
  547    HB1  ALA  72           HB1      ALA  72  71.983  -9.946   6.571
  548    HB2  ALA  72           HB2      ALA  72  71.765 -11.163   5.314
  549    HB3  ALA  72           HB3      ALA  72  70.624  -9.825   5.454
  550    H1U  RCY  73           H1U      RCY  73  71.947   0.030   0.034
  551    H1S  RCY  73           H1S      RCY  73  72.368  -4.351  -1.743
  552    HB1  RCY  73           HB1      RCY  73  71.140  -5.971   1.682
  553    HB2  RCY  73           HB2      RCY  73  70.115  -6.457   0.333
  554    HA   RCY  73           HA       RCY  73  70.270  -8.541   1.235
  555    HN1  RCY  73           HN1      RCY  73  72.254  -7.338   2.966
  556    H    ASN  74           HN       ASN  74  73.777  -8.353   1.229
  557    HA   ASN  74           HA       ASN  74  75.361  -9.227  -0.275
  558    HB2  ASN  74           HB2      ASN  74  74.125 -11.279   0.655
  559    HB3  ASN  74           HB1      ASN  74  73.240 -11.298  -0.871
  560   HD21  ASN  74          HD21      ASN  74  75.103 -13.392  -0.028
  561   HD22  ASN  74          HD22      ASN  74  76.382 -13.401  -1.143
  562    H    HIS  75           HN       HIS  75  74.300 -10.880  -2.656
  563    HA   HIS  75           HA       HIS  75  74.073 -10.377  -4.949
  564    HD1  HIS  75           HD1      HIS  75  71.321  -7.168  -5.929
  565    HD2  HIS  75           HD2      HIS  75  72.257 -11.119  -6.882
  566    HE1  HIS  75           HE1      HIS  75  70.887  -7.427  -8.411
  567    HE2  HIS  75           HE2      HIS  75  71.453  -9.829  -9.004
  568    HB2  HIS  75           HB2      HIS  75  71.721 -10.206  -4.031
  569    HB3  HIS  75           HB1      HIS  75  71.967  -8.464  -3.904
  570    H1U  RCY  76           H1U      RCY  76  78.572  -6.798   3.154
  571    H1S  RCY  76           H1S      RCY  76  76.380  -5.200  -0.392
  572    HB1  RCY  76           HB1      RCY  76  75.086  -6.014  -2.651
  573    HB2  RCY  76           HB2      RCY  76  75.298  -4.894  -3.993
  574    HA   RCY  76           HA       RCY  76  76.231  -6.506  -5.274
  575    HN1  RCY  76           HN1      RCY  76  75.850  -8.600  -3.219
  576    H    GLU  77           HN       GLU  77  77.465  -8.868  -3.320
  577    HA   GLU  77           HA       GLU  77  79.890  -7.900  -2.293
  578    HB2  GLU  77           HB2      GLU  77  79.112 -10.222  -1.980
  579    HB3  GLU  77           HB1      GLU  77  79.408 -10.555  -3.685
  580    HG2  GLU  77           HG2      GLU  77  81.655  -9.428  -2.061
  581    HG3  GLU  77           HG1      GLU  77  81.244 -11.129  -1.844
  582    H    LEU  78           HN       LEU  78  78.847  -7.845  -5.504
  583    HA   LEU  78           HA       LEU  78  81.574  -7.081  -6.394
  584    HG   LEU  78           HG       LEU  78  82.923  -8.595  -7.534
  585    HB2  LEU  78           HB2      LEU  78  80.730  -9.588  -6.958
  586    HB3  LEU  78           HB1      LEU  78  79.994  -8.733  -8.313
  587   HD11  LEU  78          HD11      LEU  78  82.081 -10.766  -8.560
  588   HD12  LEU  78          HD12      LEU  78  83.348  -9.946  -9.472
  589   HD13  LEU  78          HD13      LEU  78  81.668  -9.831  -9.997
  590   HD21  LEU  78          HD21      LEU  78  81.254  -7.270  -9.672
  591   HD22  LEU  78          HD22      LEU  78  82.989  -7.504  -9.886
  592   HD23  LEU  78          HD23      LEU  78  82.389  -6.525  -8.548
  593    H    HIS  79           HN       HIS  79  81.453  -5.209  -7.549
  594    HA   HIS  79           HA       HIS  79  78.929  -3.914  -8.005
  595    HD1  HIS  79           HD1      HIS  79  79.941  -0.441  -7.849
  596    HD2  HIS  79           HD2      HIS  79  79.681  -2.556 -11.435
  597    HE1  HIS  79           HE1      HIS  79  78.771   1.086  -9.497
  598    HE2  HIS  79           HE2      HIS  79  78.606  -0.189 -11.684
  599    HB2  HIS  79           HB2      HIS  79  81.039  -2.665  -7.671
  600    HB3  HIS  79           HB1      HIS  79  81.644  -3.290  -9.205
  601    H    GLU  80           HN       GLU  80  77.595  -3.989  -9.756
  602    HA   GLU  80           HA       GLU  80  78.638  -5.099 -12.319
  603    HB2  GLU  80           HB2      GLU  80  76.086  -5.998 -10.939
  604    HB3  GLU  80           HB1      GLU  80  76.616  -6.504 -12.544
  605    HG2  GLU  80           HG2      GLU  80  78.640  -7.507 -11.585
  606    HG3  GLU  80           HG1      GLU  80  78.163  -6.964  -9.976
  607    H    LEU  81           HN       LEU  81  75.267  -4.898 -12.166
  608    HA   LEU  81           HA       LEU  81  75.284  -2.489 -13.850
  609    HG   LEU  81           HG       LEU  81  73.012  -4.891 -15.361
  610    HB2  LEU  81           HB2      LEU  81  73.171  -4.461 -12.983
  611    HB3  LEU  81           HB1      LEU  81  72.723  -2.952 -13.775
  612   HD11  LEU  81          HD11      LEU  81  75.176  -2.944 -16.022
  613   HD12  LEU  81          HD12      LEU  81  73.558  -2.299 -15.751
  614   HD13  LEU  81          HD13      LEU  81  73.828  -3.502 -17.012
  615   HD21  LEU  81          HD21      LEU  81  75.962  -4.556 -14.770
  616   HD22  LEU  81          HD22      LEU  81  75.192  -5.789 -15.769
  617   HD23  LEU  81          HD23      LEU  81  74.985  -5.816 -14.017
  618    H    ALA  82           HN       ALA  82  75.954  -2.400 -10.910
  619    HA   ALA  82           HA       ALA  82  73.801  -1.182  -9.473
  620    HB1  ALA  82           HB1      ALA  82  76.806  -1.009  -9.161
  621    HB2  ALA  82           HB2      ALA  82  75.683  -2.007  -8.237
  622    HB3  ALA  82           HB3      ALA  82  75.679  -0.255  -8.033
  623    H    GLN  83           HN       GLN  83  74.625  -0.063 -12.277
  624    HA   GLN  83           HA       GLN  83  75.640   2.531 -12.112
  625    HB2  GLN  83           HB2      GLN  83  73.685   1.161 -13.888
  626    HB3  GLN  83           HB1      GLN  83  73.648   2.923 -13.924
  627    HG2  GLN  83           HG2      GLN  83  75.233   1.889 -15.596
  628    HG3  GLN  83           HG1      GLN  83  75.995   3.029 -14.487
  629   HE21  GLN  83          HE21      GLN  83  75.090  -0.454 -14.149
  630   HE22  GLN  83          HE22      GLN  83  76.634  -0.955 -13.653
  631    H    TYR  84           HN       TYR  84  72.137   1.776 -11.999
  632    HA   TYR  84           HA       TYR  84  71.672   3.417  -9.681
  633    HD1  TYR  84           HD1      TYR  84  68.501   5.056 -11.185
  634    HD2  TYR  84           HD2      TYR  84  71.673   4.246 -13.966
  635    HE1  TYR  84           HE1      TYR  84  66.853   4.959 -13.036
  636    HE2  TYR  84           HE2      TYR  84  70.025   4.150 -15.817
  637    HH   TYR  84           HH       TYR  84  66.544   4.377 -15.191
  638    HB2  TYR  84           HB2      TYR  84  70.850   5.403 -10.571
  639    HB3  TYR  84           HB1      TYR  84  72.148   5.053 -11.710
  640    H    GLY  85           HN       GLY  85  69.873   2.550  -8.790
  641    HA2  GLY  85           HA2      GLY  85  67.344   2.230  -9.697
  642    HA3  GLY  85           HA1      GLY  85  68.134   0.839 -10.443
  643    H    ILE  86           HN       ILE  86  69.910   0.079  -8.450
  644    HA   ILE  86           HA       ILE  86  68.475  -0.138  -5.904
  645    HB   ILE  86           HB       ILE  86  67.435  -1.895  -7.409
  646   HG12  ILE  86          HG12      ILE  86  68.996  -3.157  -5.152
  647   HG13  ILE  86          HG11      ILE  86  67.705  -1.997  -4.836
  648   HG21  ILE  86          HG21      ILE  86  69.950  -2.320  -8.300
  649   HG22  ILE  86          HG22      ILE  86  68.692  -3.554  -8.375
  650   HG23  ILE  86          HG23      ILE  86  69.867  -3.571  -7.059
  651   HD11  ILE  86          HD11      ILE  86  66.747  -4.222  -4.767
  652   HD12  ILE  86          HD12      ILE  86  67.463  -4.624  -6.328
  653   HD13  ILE  86          HD13      ILE  86  66.174  -3.423  -6.231
  654    H1U  RCY  87           H1U      RCY  87  77.761  -1.675  -7.776
  655    H1S  RCY  87           H1S      RCY  87  76.367   1.133  -5.005
  656    HB1  RCY  87           HB1      RCY  87  72.519   2.124  -5.345
  657    HB2  RCY  87           HB2      RCY  87  73.866   1.556  -6.328
  658    HA   RCY  87           HA       RCY  87  73.202  -0.636  -6.207
  659    HN1  RCY  87           HN1      RCY  87  70.910   1.008  -6.322
  Start of MODEL   46
    1    HA   MET   1           HA       MET   1  46.900   4.273  -7.139
    2    HB2  MET   1           HB2      MET   1  48.122   3.705  -9.207
    3    HB3  MET   1           HB1      MET   1  48.207   2.019  -8.696
    4    HG2  MET   1           HG2      MET   1  45.843   1.745  -8.856
    5    HG3  MET   1           HG1      MET   1  45.578   3.484  -8.979
    6    HE1  MET   1           HE1      MET   1  43.986   2.816 -11.033
    7    HE2  MET   1           HE2      MET   1  44.696   3.471 -12.506
    8    HE3  MET   1           HE3      MET   1  44.807   4.382 -11.002
    9    H    ASN   2           HN       ASN   2  47.511   0.835  -7.554
   10    HA   ASN   2           HA       ASN   2  45.217   0.104  -5.994
   11    HB2  ASN   2           HB2      ASN   2  47.578  -1.467  -7.047
   12    HB3  ASN   2           HB1      ASN   2  46.277  -2.227  -6.129
   13   HD21  ASN   2          HD21      ASN   2  43.986  -1.790  -7.044
   14   HD22  ASN   2          HD22      ASN   2  43.829  -1.710  -8.732
   15    H    LEU   3           HN       LEU   3  48.713   0.030  -5.285
   16    HA   LEU   3           HA       LEU   3  48.193   0.451  -2.454
   17    HG   LEU   3           HG       LEU   3  49.764  -0.964  -0.876
   18    HB2  LEU   3           HB2      LEU   3  47.812  -2.069  -2.903
   19    HB3  LEU   3           HB1      LEU   3  49.554  -2.153  -3.152
   20   HD11  LEU   3          HD11      LEU   3  47.690  -1.653   0.572
   21   HD12  LEU   3          HD12      LEU   3  46.838  -1.655  -0.972
   22   HD13  LEU   3          HD13      LEU   3  47.611  -0.179  -0.393
   23   HD21  LEU   3          HD21      LEU   3  48.561  -3.750  -0.942
   24   HD22  LEU   3          HD22      LEU   3  49.586  -3.089   0.331
   25   HD23  LEU   3          HD23      LEU   3  50.252  -3.376  -1.276
   26    H    GLU   4           HN       GLU   4  50.923  -1.281  -2.360
   27    HA   GLU   4           HA       GLU   4  52.599   1.121  -2.680
   28    HB2  GLU   4           HB2      GLU   4  54.380  -0.324  -1.692
   29    HB3  GLU   4           HB1      GLU   4  52.938  -0.223  -0.683
   30    HG2  GLU   4           HG2      GLU   4  52.905  -2.483  -0.700
   31    HG3  GLU   4           HG1      GLU   4  52.421  -2.372  -2.392
   32    HA   PRO   5           HA       PRO   5  53.666   0.195  -6.946
   33    HB2  PRO   5           HB2      PRO   5  56.293   1.258  -5.952
   34    HB3  PRO   5           HB1      PRO   5  55.421   1.638  -7.451
   35    HG2  PRO   5           HG2      PRO   5  55.370   3.280  -5.348
   36    HG3  PRO   5           HG1      PRO   5  53.957   3.062  -6.394
   37    HD2  PRO   5           HD2      PRO   5  54.379   2.134  -3.610
   38    HD3  PRO   5           HD1      PRO   5  52.859   2.409  -4.488
   39    HA   PRO   6           HA       PRO   6  55.902  -3.623  -5.764
   40    HB2  PRO   6           HB2      PRO   6  54.621  -5.307  -7.447
   41    HB3  PRO   6           HB1      PRO   6  53.874  -4.742  -5.940
   42    HG2  PRO   6           HG2      PRO   6  53.374  -3.874  -8.732
   43    HG3  PRO   6           HG1      PRO   6  52.248  -4.025  -7.375
   44    HD2  PRO   6           HD2      PRO   6  53.406  -1.629  -8.267
   45    HD3  PRO   6           HD1      PRO   6  52.622  -1.873  -6.692
   46    H    LYS   7           HN       LYS   7  57.854  -4.189  -6.657
   47    HA   LYS   7           HA       LYS   7  58.472  -3.298  -9.399
   48    HB2  LYS   7           HB2      LYS   7  60.081  -2.971  -7.507
   49    HB3  LYS   7           HB1      LYS   7  60.246  -4.723  -7.394
   50    HG2  LYS   7           HG2      LYS   7  61.206  -4.874  -9.574
   51    HG3  LYS   7           HG1      LYS   7  60.745  -3.218  -9.969
   52    HD2  LYS   7           HD2      LYS   7  63.005  -2.964  -9.438
   53    HD3  LYS   7           HD1      LYS   7  62.232  -2.601  -7.894
   54    HE2  LYS   7           HE2      LYS   7  63.967  -4.138  -7.362
   55    HE3  LYS   7           HE1      LYS   7  62.489  -5.101  -7.362
   56    HZ1  LYS   7           HZ1      LYS   7  63.990  -6.330  -8.623
   57    HZ2  LYS   7           HZ2      LYS   7  64.595  -4.963  -9.430
   58    HZ3  LYS   7           HZ3      LYS   7  63.040  -5.546  -9.789
   59    H    ALA   8           HN       ALA   8  59.067  -4.723 -11.089
   60    HA   ALA   8           HA       ALA   8  57.718  -7.247 -11.155
   61    HB1  ALA   8           HB1      ALA   8  58.271  -5.939 -13.189
   62    HB2  ALA   8           HB2      ALA   8  58.882  -7.591 -13.292
   63    HB3  ALA   8           HB3      ALA   8  59.983  -6.265 -12.918
   64    H    GLU   9           HN       GLU   9  60.312  -8.406 -12.506
   65    HA   GLU   9           HA       GLU   9  61.944  -9.963 -11.868
   66    HB2  GLU   9           HB2      GLU   9  62.789  -7.792 -10.746
   67    HB3  GLU   9           HB1      GLU   9  62.143  -8.469  -9.251
   68    HG2  GLU   9           HG2      GLU   9  63.502 -10.544  -9.692
   69    HG3  GLU   9           HG1      GLU   9  64.255  -9.696 -11.043
   70    H1U  RCY  10           H1U      RCY  10  54.477 -13.227  -9.703
   71    H1S  RCY  10           H1S      RCY  10  59.045 -13.492  -9.621
   72    HB1  RCY  10           HB1      RCY  10  62.229 -14.235  -8.659
   73    HB2  RCY  10           HB2      RCY  10  61.950 -14.020 -10.385
   74    HA   RCY  10           HA       RCY  10  59.731 -12.801  -9.373
   75    HN1  RCY  10           HN1      RCY  10  62.236 -11.835 -10.467
   76    H    ARG  11           HN       ARG  11  59.848 -10.689  -7.901
   77    HA   ARG  11           HA       ARG  11  60.213 -11.611  -5.197
   78    HE   ARG  11           HE       ARG  11  62.362  -8.382  -1.801
   79    HB2  ARG  11           HB2      ARG  11  62.610 -11.042  -6.110
   80    HB3  ARG  11           HB1      ARG  11  62.102  -9.369  -5.886
   81    HG2  ARG  11           HG2      ARG  11  62.027 -11.510  -3.738
   82    HG3  ARG  11           HG1      ARG  11  63.260 -10.257  -3.875
   83    HD2  ARG  11           HD2      ARG  11  61.236  -8.607  -3.861
   84    HD3  ARG  11           HD1      ARG  11  60.348  -9.967  -3.173
   85   HH11  ARG  11          HH21      ARG  11  60.877 -11.475  -2.139
   86   HH12  ARG  11          HH22      ARG  11  61.231 -11.970  -0.517
   87   HH21  ARG  11          HH11      ARG  11  62.832  -9.010   0.319
   88   HH22  ARG  11          HH12      ARG  11  62.338 -10.574   0.874
   89    H    SER  12           HN       SER  12  58.267 -10.722  -4.596
   90    HA   SER  12           HA       SER  12  57.611  -7.952  -5.419
   91    HG   SER  12           HG       SER  12  55.421  -8.716  -6.349
   92    HB2  SER  12           HB2      SER  12  56.062 -10.128  -4.001
   93    HB3  SER  12           HB1      SER  12  55.446  -8.486  -4.164
   94    H    ALA  13           HN       ALA  13  57.164  -6.298  -3.849
   95    HA   ALA  13           HA       ALA  13  58.920  -6.353  -1.551
   96    HB1  ALA  13           HB1      ALA  13  58.593  -4.211  -2.490
   97    HB2  ALA  13           HB2      ALA  13  57.631  -4.165  -1.013
   98    HB3  ALA  13           HB3      ALA  13  56.843  -4.418  -2.572
   99    H    THR  14           HN       THR  14  57.957  -8.351  -0.569
  100    HA   THR  14           HA       THR  14  55.287  -8.411   0.455
  101    HB   THR  14           HB       THR  14  57.690  -9.764   1.708
  102    HG1  THR  14           HG1      THR  14  56.200 -10.365  -0.614
  103   HG21  THR  14          HG21      THR  14  55.534  -9.898   2.923
  104   HG22  THR  14          HG22      THR  14  56.034 -11.472   2.306
  105   HG23  THR  14          HG23      THR  14  54.774 -10.560   1.476
  106    H    ARG  15           HN       ARG  15  58.150  -8.257   2.576
  107    HA   ARG  15           HA       ARG  15  57.133  -5.817   3.866
  108    HE   ARG  15           HE       ARG  15  56.628 -10.746   4.335
  109    HB2  ARG  15           HB2      ARG  15  56.829  -6.792   6.054
  110    HB3  ARG  15           HB1      ARG  15  55.864  -7.731   4.915
  111    HG2  ARG  15           HG2      ARG  15  58.081  -9.175   4.729
  112    HG3  ARG  15           HG1      ARG  15  58.401  -8.487   6.322
  113    HD2  ARG  15           HD2      ARG  15  57.175 -10.305   7.003
  114    HD3  ARG  15           HD1      ARG  15  55.831  -9.208   6.681
  115   HH11  ARG  15          HH21      ARG  15  54.791 -10.648   7.251
  116   HH12  ARG  15          HH22      ARG  15  53.628 -11.815   6.715
  117   HH21  ARG  15          HH11      ARG  15  55.120 -12.270   3.618
  118   HH22  ARG  15          HH12      ARG  15  53.814 -12.733   4.658
  119    H    VAL  16           HN       VAL  16  59.010  -4.681   3.855
  120    HA   VAL  16           HA       VAL  16  61.323  -5.766   5.321
  121    HB   VAL  16           HB       VAL  16  62.894  -5.242   3.447
  122   HG11  VAL  16          HG11      VAL  16  62.536  -7.294   2.278
  123   HG12  VAL  16          HG12      VAL  16  60.797  -7.234   2.562
  124   HG13  VAL  16          HG13      VAL  16  61.899  -7.554   3.901
  125   HG21  VAL  16          HG21      VAL  16  61.668  -3.699   2.115
  126   HG22  VAL  16          HG22      VAL  16  60.270  -4.771   2.021
  127   HG23  VAL  16          HG23      VAL  16  61.746  -5.168   1.141
  128    H    MET  17           HN       MET  17  60.060  -3.099   3.316
  129    HA   MET  17           HA       MET  17  61.730  -1.152   4.771
  130    HB2  MET  17           HB2      MET  17  61.236  -0.936   2.310
  131    HB3  MET  17           HB1      MET  17  59.548  -0.637   2.728
  132    HG2  MET  17           HG2      MET  17  60.104   1.367   3.919
  133    HG3  MET  17           HG1      MET  17  61.828   1.001   3.857
  134    HE1  MET  17           HE1      MET  17  61.538   3.541   3.310
  135    HE2  MET  17           HE2      MET  17  61.856   4.046   1.652
  136    HE3  MET  17           HE3      MET  17  62.984   2.968   2.470
  137    H    GLY  18           HN       GLY  18  58.260  -1.905   4.394
  138    HA2  GLY  18           HA2      GLY  18  57.639  -0.057   6.634
  139    HA3  GLY  18           HA1      GLY  18  56.451  -0.827   5.579
  140    H    GLY  19           HN       GLY  19  58.208  -1.110   8.533
  141    HA2  GLY  19           HA2      GLY  19  56.602  -2.907   9.832
  142    HA3  GLY  19           HA1      GLY  19  57.656  -3.966   8.893
  143    HA   PRO  20           HA       PRO  20  59.795  -3.517  12.963
  144    HB2  PRO  20           HB2      PRO  20  61.389  -5.629  11.557
  145    HB3  PRO  20           HB1      PRO  20  60.809  -5.584  13.235
  146    HG2  PRO  20           HG2      PRO  20  59.620  -7.097  11.401
  147    HG3  PRO  20           HG1      PRO  20  58.685  -6.261  12.653
  148    HD2  PRO  20           HD2      PRO  20  58.933  -5.619   9.746
  149    HD3  PRO  20           HD1      PRO  20  57.567  -5.345  10.850
  150    H1U  RCY  21           H1U      RCY  21  63.809  -8.295  13.439
  151    H1S  RCY  21           H1S      RCY  21  63.371  -3.769  11.816
  152    HB1  RCY  21           HB1      RCY  21  63.899  -1.967   8.248
  153    HB2  RCY  21           HB2      RCY  21  62.740  -3.289   8.388
  154    HA   RCY  21           HA       RCY  21  63.114  -1.421  10.709
  155    HN1  RCY  21           HN1      RCY  21  60.599  -2.741   9.806
  156    H    THR  22           HN       THR  22  62.289   0.657  10.659
  157    HA   THR  22           HA       THR  22  61.198   1.600   8.034
  158    HB   THR  22           HB       THR  22  60.353   2.440  10.822
  159    HG1  THR  22           HG1      THR  22  58.546   1.335  10.391
  160   HG21  THR  22          HG21      THR  22  60.252   4.378   9.435
  161   HG22  THR  22          HG22      THR  22  58.610   3.735   9.476
  162   HG23  THR  22          HG23      THR  22  59.632   3.454   8.067
  163    HA   PRO  23           HA       PRO  23  65.067   4.006   8.502
  164    HB2  PRO  23           HB2      PRO  23  63.727   5.355   6.179
  165    HB3  PRO  23           HB1      PRO  23  65.420   4.853   6.365
  166    HG2  PRO  23           HG2      PRO  23  63.714   3.446   4.888
  167    HG3  PRO  23           HG1      PRO  23  64.954   2.651   5.871
  168    HD2  PRO  23           HD2      PRO  23  62.011   2.806   6.326
  169    HD3  PRO  23           HD1      PRO  23  63.166   1.552   6.827
  170    H    ARG  24           HN       ARG  24  65.399   6.537   8.572
  171    HA   ARG  24           HA       ARG  24  63.125   8.229   9.038
  172    HE   ARG  24           HE       ARG  24  64.787   4.385  13.752
  173    HB2  ARG  24           HB2      ARG  24  63.489   8.441  11.566
  174    HB3  ARG  24           HB1      ARG  24  62.666   6.982  11.016
  175    HG2  ARG  24           HG2      ARG  24  64.769   5.726  11.114
  176    HG3  ARG  24           HG1      ARG  24  65.635   7.184  11.599
  177    HD2  ARG  24           HD2      ARG  24  64.515   7.280  13.695
  178    HD3  ARG  24           HD1      ARG  24  63.292   6.118  13.181
  179   HH11  ARG  24          HH21      ARG  24  66.385   7.420  13.400
  180   HH12  ARG  24          HH22      ARG  24  67.912   6.832  13.967
  181   HH21  ARG  24          HH11      ARG  24  66.772   3.600  14.495
  182   HH22  ARG  24          HH12      ARG  24  68.131   4.669  14.587
  183    H    LYS  25           HN       LYS  25  65.191   8.954   7.586
  184    HA   LYS  25           HA       LYS  25  67.266  10.238   9.219
  185    HB2  LYS  25           HB2      LYS  25  67.617   9.208   6.889
  186    HB3  LYS  25           HB1      LYS  25  66.801  10.634   6.257
  187    HG2  LYS  25           HG2      LYS  25  69.217  11.009   6.237
  188    HG3  LYS  25           HG1      LYS  25  68.467  12.073   7.428
  189    HD2  LYS  25           HD2      LYS  25  69.400  10.969   9.206
  190    HD3  LYS  25           HD1      LYS  25  69.323   9.399   8.405
  191    HE2  LYS  25           HE2      LYS  25  71.318   9.738   7.249
  192    HE3  LYS  25           HE1      LYS  25  71.193  11.495   7.346
  193    HZ1  LYS  25           HZ1      LYS  25  72.264  11.516   9.278
  194    HZ2  LYS  25           HZ2      LYS  25  72.680   9.897   8.978
  195    HZ3  LYS  25           HZ3      LYS  25  71.318  10.266   9.924
  196    H    GLY  26           HN       GLY  26  65.658  11.849   6.507
  197    HA2  GLY  26           HA2      GLY  26  63.964  13.624   6.821
  198    HA3  GLY  26           HA1      GLY  26  64.675  13.943   8.404
  199    HA   PRO  27           HA       PRO  27  66.961  17.417   6.864
  200    HB2  PRO  27           HB2      PRO  27  69.260  15.986   8.171
  201    HB3  PRO  27           HB1      PRO  27  68.795  17.693   8.286
  202    HG2  PRO  27           HG2      PRO  27  68.234  15.921  10.217
  203    HG3  PRO  27           HG1      PRO  27  67.175  17.290   9.843
  204    HD2  PRO  27           HD2      PRO  27  66.712  14.416   9.389
  205    HD3  PRO  27           HD1      PRO  27  65.543  15.755   9.398
  206    HA   PRO  28           HA       PRO  28  68.951  16.608   2.993
  207    HB2  PRO  28           HB2      PRO  28  71.501  17.460   4.346
  208    HB3  PRO  28           HB1      PRO  28  70.883  17.900   2.740
  209    HG2  PRO  28           HG2      PRO  28  70.641  19.520   4.872
  210    HG3  PRO  28           HG1      PRO  28  69.434  19.459   3.579
  211    HD2  PRO  28           HD2      PRO  28  69.187  18.561   6.364
  212    HD3  PRO  28           HD1      PRO  28  67.912  18.806   5.151
  213    H    LYS  29           HN       LYS  29  69.883  14.774   2.064
  214    HA   LYS  29           HA       LYS  29  71.670  13.086   3.734
  215    HB2  LYS  29           HB2      LYS  29  70.280  11.069   3.091
  216    HB3  LYS  29           HB1      LYS  29  69.513  12.163   4.240
  217    HG2  LYS  29           HG2      LYS  29  68.620  13.287   1.975
  218    HG3  LYS  29           HG1      LYS  29  68.834  11.639   1.383
  219    HD2  LYS  29           HD2      LYS  29  67.354  12.245   3.947
  220    HD3  LYS  29           HD1      LYS  29  66.540  12.191   2.383
  221    HE2  LYS  29           HE2      LYS  29  68.293   9.888   2.819
  222    HE3  LYS  29           HE1      LYS  29  67.014  10.007   4.028
  223    HZ1  LYS  29           HZ1      LYS  29  66.544   8.799   1.818
  224    HZ2  LYS  29           HZ2      LYS  29  66.388  10.362   1.173
  225    HZ3  LYS  29           HZ3      LYS  29  65.373   9.858   2.438
  226    H1U  RCY  30           H1U      RCY  30  67.815  17.802  -3.219
  227    H1S  RCY  30           H1S      RCY  30  70.671  15.604  -1.256
  228    HB1  RCY  30           HB1      RCY  30  74.628  14.707  -1.044
  229    HB2  RCY  30           HB2      RCY  30  73.424  15.559  -0.081
  230    HA   RCY  30           HA       RCY  30  72.449  12.931  -0.857
  231    HN1  RCY  30           HN1      RCY  30  72.569  14.541   1.586
  232    H    LYS  31           HN       LYS  31  73.278  11.323   1.253
  233    HA   LYS  31           HA       LYS  31  75.008   9.884   1.923
  234    HB2  LYS  31           HB2      LYS  31  75.641  10.529  -0.951
  235    HB3  LYS  31           HB1      LYS  31  76.777   9.567  -0.009
  236    HG2  LYS  31           HG2      LYS  31  75.383   7.930  -0.955
  237    HG3  LYS  31           HG1      LYS  31  74.675   8.162   0.644
  238    HD2  LYS  31           HD2      LYS  31  72.781   8.320  -0.696
  239    HD3  LYS  31           HD1      LYS  31  73.257  10.016  -0.595
  240    HE2  LYS  31           HE2      LYS  31  74.692   9.459  -2.720
  241    HE3  LYS  31           HE1      LYS  31  73.588   8.094  -2.881
  242    HZ1  LYS  31           HZ1      LYS  31  72.917  10.200  -4.047
  243    HZ2  LYS  31           HZ2      LYS  31  72.645  10.876  -2.513
  244    HZ3  LYS  31           HZ3      LYS  31  71.747   9.526  -3.020
  245    H    GLN  32           HN       GLN  32  75.679  11.476   3.532
  246    HA   GLN  32           HA       GLN  32  77.372  13.633   3.278
  247    HB2  GLN  32           HB2      GLN  32  78.074  13.272   5.533
  248    HB3  GLN  32           HB1      GLN  32  76.435  12.634   5.427
  249    HG2  GLN  32           HG2      GLN  32  79.028  11.071   5.401
  250    HG3  GLN  32           HG1      GLN  32  77.725  10.975   6.586
  251   HE21  GLN  32          HE21      GLN  32  78.976   9.105   4.277
  252   HE22  GLN  32          HE22      GLN  32  77.576   8.405   3.621
  253    H    ARG  33           HN       ARG  33  79.426  13.971   2.595
  254    HA   ARG  33           HA       ARG  33  81.061  11.585   1.872
  255    HE   ARG  33           HE       ARG  33  81.587  17.896   0.181
  256    HB2  ARG  33           HB2      ARG  33  82.400  13.284   0.569
  257    HB3  ARG  33           HB1      ARG  33  80.727  13.119   0.035
  258    HG2  ARG  33           HG2      ARG  33  80.072  15.136   1.097
  259    HG3  ARG  33           HG1      ARG  33  81.540  15.194   2.073
  260    HD2  ARG  33           HD2      ARG  33  82.758  15.292  -0.247
  261    HD3  ARG  33           HD1      ARG  33  81.186  15.820  -0.846
  262   HH11  ARG  33          HH21      ARG  33  83.473  15.383   1.600
  263   HH12  ARG  33          HH22      ARG  33  84.338  16.447   2.658
  264   HH21  ARG  33          HH11      ARG  33  82.705  19.300   1.556
  265   HH22  ARG  33          HH12      ARG  33  83.903  18.665   2.633
  266    H    GLN  34           HN       GLN  34  80.716  13.065   4.599
  267    HA   GLN  34           HA       GLN  34  83.093  14.394   5.308
  268    HB2  GLN  34           HB2      GLN  34  81.265  12.585   6.897
  269    HB3  GLN  34           HB1      GLN  34  82.638  13.412   7.632
  270    HG2  GLN  34           HG2      GLN  34  81.732  15.583   6.832
  271    HG3  GLN  34           HG1      GLN  34  80.331  14.735   6.176
  272   HE21  GLN  34          HE21      GLN  34  79.752  16.631   8.086
  273   HE22  GLN  34          HE22      GLN  34  79.350  15.899   9.564
  274    H    THR  35           HN       THR  35  82.846  11.307   4.082
  275    HA   THR  35           HA       THR  35  84.373   9.545   3.906
  276    HB   THR  35           HB       THR  35  86.660  10.094   3.925
  277    HG1  THR  35           HG1      THR  35  86.273  12.336   5.559
  278   HG21  THR  35          HG21      THR  35  85.126  11.628   2.507
  279   HG22  THR  35          HG22      THR  35  86.795  12.139   2.762
  280   HG23  THR  35          HG23      THR  35  85.496  12.865   3.709
  281    H    ARG  36           HN       ARG  36  85.589  11.157   6.863
  282    HA   ARG  36           HA       ARG  36  85.881  10.301   9.028
  283    HE   ARG  36           HE       ARG  36  80.918  10.356  11.489
  284    HB2  ARG  36           HB2      ARG  36  83.295   9.019   8.144
  285    HB3  ARG  36           HB1      ARG  36  83.977   8.688   9.736
  286    HG2  ARG  36           HG2      ARG  36  83.781  10.937  10.421
  287    HG3  ARG  36           HG1      ARG  36  83.615  11.520   8.764
  288    HD2  ARG  36           HD2      ARG  36  81.379  11.281   8.844
  289    HD3  ARG  36           HD1      ARG  36  81.535   9.601   9.355
  290   HH11  ARG  36          HH21      ARG  36  82.648  12.775   9.745
  291   HH12  ARG  36          HH22      ARG  36  82.583  13.936  11.029
  292   HH21  ARG  36          HH11      ARG  36  80.823  11.859  13.175
  293   HH22  ARG  36          HH12      ARG  36  81.550  13.417  12.971
  294    H    GLN  37           HN       GLN  37  86.208   8.414   6.305
  295    HA   GLN  37           HA       GLN  37  88.048   6.597   7.537
  296    HB2  GLN  37           HB2      GLN  37  85.630   5.738   8.185
  297    HB3  GLN  37           HB1      GLN  37  85.615   5.136   6.530
  298    HG2  GLN  37           HG2      GLN  37  87.611   4.465   8.707
  299    HG3  GLN  37           HG1      GLN  37  86.479   3.367   7.916
  300   HE21  GLN  37          HE21      GLN  37  87.142   2.398   5.951
  301   HE22  GLN  37          HE22      GLN  37  88.607   2.753   5.172
  302    H1U  RCY  38           H1U      RCY  38  84.492   8.696  -2.868
  303    H1S  RCY  38           H1S      RCY  38  86.201   7.878   0.681
  304    HB1  RCY  38           HB1      RCY  38  88.864   8.807   2.935
  305    HB2  RCY  38           HB2      RCY  38  87.351   7.936   3.178
  306    HA   RCY  38           HA       RCY  38  88.862   5.812   3.280
  307    HN1  RCY  38           HN1      RCY  38  89.274   7.356   5.725
  308    H    LYS  39           HN       LYS  39  91.017   5.193   4.209
  309    HA   LYS  39           HA       LYS  39  93.143   7.241   3.825
  310    HB2  LYS  39           HB2      LYS  39  93.022   4.562   5.204
  311    HB3  LYS  39           HB1      LYS  39  94.574   5.294   4.798
  312    HG2  LYS  39           HG2      LYS  39  92.529   6.982   6.190
  313    HG3  LYS  39           HG1      LYS  39  93.415   5.787   7.138
  314    HD2  LYS  39           HD2      LYS  39  94.767   7.813   5.338
  315    HD3  LYS  39           HD1      LYS  39  94.494   8.076   7.061
  316    HE2  LYS  39           HE2      LYS  39  96.506   7.061   7.334
  317    HE3  LYS  39           HE1      LYS  39  95.617   5.566   7.043
  318    HZ1  LYS  39           HZ1      LYS  39  97.104   5.343   5.392
  319    HZ2  LYS  39           HZ2      LYS  39  97.444   7.006   5.310
  320    HZ3  LYS  39           HZ3      LYS  39  96.059   6.380   4.550
  321    H    SER  40           HN       SER  40  91.636   5.722   1.628
  322    HA   SER  40           HA       SER  40  92.156   4.556  -0.357
  323    HG   SER  40           HG       SER  40  95.672   6.544  -0.246
  324    HB2  SER  40           HB2      SER  40  94.289   5.345  -1.401
  325    HB3  SER  40           HB1      SER  40  93.291   6.667  -0.802
  326    H    LYS  41           HN       LYS  41  92.564   2.970   1.950
  327    HA   LYS  41           HA       LYS  41  95.109   1.778   2.187
  328    HB2  LYS  41           HB2      LYS  41  92.632   0.091   2.396
  329    HB3  LYS  41           HB1      LYS  41  94.062   0.103   3.427
  330    HG2  LYS  41           HG2      LYS  41  92.650   1.266   4.820
  331    HG3  LYS  41           HG1      LYS  41  93.224   2.625   3.854
  332    HD2  LYS  41           HD2      LYS  41  90.930   2.931   3.683
  333    HD3  LYS  41           HD1      LYS  41  91.224   1.923   2.265
  334    HE2  LYS  41           HE2      LYS  41  90.624  -0.086   3.553
  335    HE3  LYS  41           HE1      LYS  41  90.355   0.905   4.987
  336    HZ1  LYS  41           HZ1      LYS  41  88.885   2.077   2.972
  337    HZ2  LYS  41           HZ2      LYS  41  88.288   1.176   4.283
  338    HZ3  LYS  41           HZ3      LYS  41  88.615   0.410   2.802
  339    HA   PRO  42           HA       PRO  42  95.378  -0.279  -1.779
  340    HB2  PRO  42           HB2      PRO  42  97.569  -1.830  -1.288
  341    HB3  PRO  42           HB1      PRO  42  97.674  -0.076  -1.540
  342    HG2  PRO  42           HG2      PRO  42  97.727  -1.622   1.002
  343    HG3  PRO  42           HG1      PRO  42  98.672  -0.202   0.523
  344    HD2  PRO  42           HD2      PRO  42  96.465  -0.069   2.164
  345    HD3  PRO  42           HD1      PRO  42  97.008   1.277   1.137
  346    HA   PRO  43           HA       PRO  43  93.388  -4.214  -1.370
  347    HB2  PRO  43           HB2      PRO  43  94.492  -5.636  -3.461
  348    HB3  PRO  43           HB1      PRO  43  93.249  -4.386  -3.660
  349    HG2  PRO  43           HG2      PRO  43  96.189  -4.206  -4.065
  350    HG3  PRO  43           HG1      PRO  43  94.871  -3.476  -4.998
  351    HD2  PRO  43           HD2      PRO  43  96.351  -2.059  -3.194
  352    HD3  PRO  43           HD1      PRO  43  94.648  -1.685  -3.541
  353    H    LYS  44           HN       LYS  44  93.732  -5.961  -0.048
  354    HA   LYS  44           HA       LYS  44  96.053  -7.647  -0.170
  355    HB2  LYS  44           HB2      LYS  44  96.773  -6.951   2.270
  356    HB3  LYS  44           HB1      LYS  44  97.390  -6.050   0.886
  357    HG2  LYS  44           HG2      LYS  44  96.120  -4.194   1.352
  358    HG3  LYS  44           HG1      LYS  44  94.787  -5.143   2.009
  359    HD2  LYS  44           HD2      LYS  44  95.877  -3.884   3.807
  360    HD3  LYS  44           HD1      LYS  44  96.147  -5.612   4.035
  361    HE2  LYS  44           HE2      LYS  44  98.376  -5.447   3.092
  362    HE3  LYS  44           HE1      LYS  44  98.111  -3.759   2.659
  363    HZ1  LYS  44           HZ1      LYS  44  97.568  -3.646   5.235
  364    HZ2  LYS  44           HZ2      LYS  44  99.142  -3.448   4.627
  365    HZ3  LYS  44           HZ3      LYS  44  98.656  -4.947   5.263
  366    H    LYS  45           HN       LYS  45  94.685  -6.665   2.918
  367    HA   LYS  45           HA       LYS  45  92.700  -8.852   2.852
  368    HB2  LYS  45           HB2      LYS  45  94.875  -9.883   3.590
  369    HB3  LYS  45           HB1      LYS  45  94.885  -8.769   4.955
  370    HG2  LYS  45           HG2      LYS  45  93.883 -10.690   5.868
  371    HG3  LYS  45           HG1      LYS  45  92.492  -9.699   5.426
  372    HD2  LYS  45           HD2      LYS  45  92.110 -10.956   3.429
  373    HD3  LYS  45           HD1      LYS  45  93.669 -11.771   3.563
  374    HE2  LYS  45           HE2      LYS  45  92.958 -13.112   5.356
  375    HE3  LYS  45           HE1      LYS  45  91.623 -12.031   5.756
  376    HZ1  LYS  45           HZ1      LYS  45  90.386 -12.761   3.950
  377    HZ2  LYS  45           HZ2      LYS  45  91.090 -14.191   4.539
  378    HZ3  LYS  45           HZ3      LYS  45  91.729 -13.432   3.160
  379    H    GLY  46           HN       GLY  46  90.991  -7.512   3.358
  380    HA2  GLY  46           HA2      GLY  46  91.167  -5.289   5.173
  381    HA3  GLY  46           HA1      GLY  46  89.668  -6.025   4.605
  382    H    VAL  47           HN       VAL  47  92.084  -6.047   7.139
  383    HA   VAL  47           HA       VAL  47  90.799  -8.263   8.576
  384    HB   VAL  47           HB       VAL  47  93.170  -8.111   8.853
  385   HG11  VAL  47          HG11      VAL  47  93.563  -5.842   8.147
  386   HG12  VAL  47          HG12      VAL  47  94.188  -5.988   9.790
  387   HG13  VAL  47          HG13      VAL  47  92.636  -5.201   9.504
  388   HG21  VAL  47          HG21      VAL  47  93.375  -7.990  11.221
  389   HG22  VAL  47          HG22      VAL  47  91.697  -8.456  10.938
  390   HG23  VAL  47          HG23      VAL  47  92.092  -6.787  11.348
  391    H    GLN  48           HN       GLN  48  90.843  -4.741   8.655
  392    HA   GLN  48           HA       GLN  48  88.709  -4.843  10.755
  393    HB2  GLN  48           HB2      GLN  48  91.230  -3.764  11.117
  394    HB3  GLN  48           HB1      GLN  48  90.290  -2.353  10.636
  395    HG2  GLN  48           HG2      GLN  48  89.662  -4.258  12.910
  396    HG3  GLN  48           HG1      GLN  48  90.161  -2.572  13.052
  397   HE21  GLN  48          HE21      GLN  48  87.619  -3.691  14.051
  398   HE22  GLN  48          HE22      GLN  48  86.376  -2.886  13.221
  399    H    GLY  49           HN       GLY  49  90.162  -2.636   8.329
  400    HA2  GLY  49           HA2      GLY  49  89.107  -1.368   6.653
  401    HA3  GLY  49           HA1      GLY  49  87.657  -2.337   6.915
  402    H1U  RCY  50           H1U      RCY  50  80.231  -3.048   6.430
  403    H1S  RCY  50           H1S      RCY  50  82.665  -1.711   9.855
  404    HB1  RCY  50           HB1      RCY  50  84.319   0.208  10.764
  405    HB2  RCY  50           HB2      RCY  50  85.591  -0.383  11.831
  406    HA   RCY  50           HA       RCY  50  85.807   0.893   9.192
  407    HN1  RCY  50           HN1      RCY  50  86.719  -1.825   9.301
  408    H    GLY  51           HN       GLY  51  87.399   2.433   9.392
  409    HA2  GLY  51           HA2      GLY  51  89.717   2.298  10.999
  410    HA3  GLY  51           HA1      GLY  51  88.962   3.805  10.482
  411    H    ASP  52           HN       ASP  52  86.653   2.081  12.139
  412    HA   ASP  52           HA       ASP  52  85.864   2.120  14.354
  413    HB2  ASP  52           HB2      ASP  52  88.491   1.876  14.780
  414    HB3  ASP  52           HB1      ASP  52  88.308   3.533  15.354
  415    H    ASP  53           HN       ASP  53  86.068   4.497  12.323
  416    HA   ASP  53           HA       ASP  53  85.796   6.818  14.104
  417    HB2  ASP  53           HB2      ASP  53  86.748   6.839  11.709
  418    HB3  ASP  53           HB1      ASP  53  85.073   6.720  11.171
  419    H    ILE  54           HN       ILE  54  83.581   7.693  12.066
  420    HA   ILE  54           HA       ILE  54  81.309   6.214  13.331
  421    HB   ILE  54           HB       ILE  54  81.214   9.189  12.831
  422   HG12  ILE  54          HG12      ILE  54  82.100   7.763  15.361
  423   HG13  ILE  54          HG11      ILE  54  83.110   8.793  14.346
  424   HG21  ILE  54          HG21      ILE  54  79.743   7.440  14.820
  425   HG22  ILE  54          HG22      ILE  54  79.129   7.800  13.206
  426   HG23  ILE  54          HG23      ILE  54  79.363   9.103  14.371
  427   HD11  ILE  54          HD11      ILE  54  81.459  10.665  14.767
  428   HD12  ILE  54          HD12      ILE  54  82.356  10.142  16.193
  429   HD13  ILE  54          HD13      ILE  54  80.686   9.623  15.961
  430    HA   PRO  55           HA       PRO  55  80.777   6.565   8.751
  431    HB2  PRO  55           HB2      PRO  55  80.407   3.931   8.227
  432    HB3  PRO  55           HB1      PRO  55  82.024   4.640   8.411
  433    HG2  PRO  55           HG2      PRO  55  80.448   3.011  10.327
  434    HG3  PRO  55           HG1      PRO  55  82.193   3.036  10.031
  435    HD2  PRO  55           HD2      PRO  55  80.910   4.330  12.149
  436    HD3  PRO  55           HD1      PRO  55  82.540   4.712  11.555
  437    H    GLY  56           HN       GLY  56  78.724   7.616   9.149
  438    HA2  GLY  56           HA2      GLY  56  76.382   7.730   9.067
  439    HA3  GLY  56           HA1      GLY  56  76.415   6.071   8.468
  440    H    MET  57           HN       MET  57  75.750   8.060  11.179
  441    HA   MET  57           HA       MET  57  76.023   6.077  13.256
  442    HB2  MET  57           HB2      MET  57  75.816   8.602  13.566
  443    HB3  MET  57           HB1      MET  57  74.091   8.406  13.258
  444    HG2  MET  57           HG2      MET  57  74.218   8.262  15.600
  445    HG3  MET  57           HG1      MET  57  74.206   6.570  15.103
  446    HE1  MET  57           HE1      MET  57  76.675   7.488  18.241
  447    HE2  MET  57           HE2      MET  57  75.026   7.009  17.846
  448    HE3  MET  57           HE3      MET  57  75.534   8.679  17.605
  449    H    GLU  58           HN       GLU  58  74.893   4.556  11.410
  450    HA   GLU  58           HA       GLU  58  73.000   3.297  10.799
  451    HB2  GLU  58           HB2      GLU  58  73.475   2.669  13.220
  452    HB3  GLU  58           HB1      GLU  58  72.191   3.792  13.672
  453    HG2  GLU  58           HG2      GLU  58  71.171   1.627  13.510
  454    HG3  GLU  58           HG1      GLU  58  70.676   2.521  12.073
  455    H    GLY  59           HN       GLY  59  71.948   4.766   9.379
  456    HA2  GLY  59           HA2      GLY  59  69.318   5.598  10.190
  457    HA3  GLY  59           HA1      GLY  59  70.388   6.998  10.082
  458    H1U  RCY  60           H1U      RCY  60  69.920   8.598   1.125
  459    H1S  RCY  60           H1S      RCY  60  72.376   9.179   4.597
  460    HB1  RCY  60           HB1      RCY  60  71.041   6.330   4.391
  461    HB2  RCY  60           HB2      RCY  60  71.281   5.428   5.888
  462    HA   RCY  60           HA       RCY  60  70.185   8.251   5.802
  463    HN1  RCY  60           HN1      RCY  60  70.525   7.933   8.105
  464    H    GLY  61           HN       GLY  61  69.211   6.824   3.774
  465    HA2  GLY  61           HA2      GLY  61  67.136   4.962   4.248
  466    HA3  GLY  61           HA1      GLY  61  66.419   6.572   4.339
  467    H    THR  62           HN       THR  62  68.985   6.937   2.355
  468    HA   THR  62           HA       THR  62  67.289   6.950  -0.033
  469    HB   THR  62           HB       THR  62  69.825   7.530  -0.922
  470    HG1  THR  62           HG1      THR  62  70.069   9.019   1.256
  471   HG21  THR  62          HG21      THR  62  69.123   9.802  -0.908
  472   HG22  THR  62          HG22      THR  62  68.120   9.562   0.523
  473   HG23  THR  62          HG23      THR  62  67.636   8.860  -1.022
  474    H    ASP  63           HN       ASP  63  67.716   4.350   1.097
  475    HA   ASP  63           HA       ASP  63  69.762   2.805  -0.028
  476    HB2  ASP  63           HB2      ASP  63  66.875   1.905   0.127
  477    HB3  ASP  63           HB1      ASP  63  68.322   0.904   0.248
  478    H    ILE  64           HN       ILE  64  66.725   3.895  -1.524
  479    HA   ILE  64           HA       ILE  64  67.904   3.213  -4.190
  480    HB   ILE  64           HB       ILE  64  65.008   2.784  -3.392
  481   HG12  ILE  64          HG12      ILE  64  66.709   0.544  -4.338
  482   HG13  ILE  64          HG11      ILE  64  67.082   1.158  -2.727
  483   HG21  ILE  64          HG21      ILE  64  66.422   2.984  -5.948
  484   HG22  ILE  64          HG22      ILE  64  64.689   3.011  -5.621
  485   HG23  ILE  64          HG23      ILE  64  65.533   1.471  -5.780
  486   HD11  ILE  64          HD11      ILE  64  64.342   0.272  -3.680
  487   HD12  ILE  64          HD12      ILE  64  64.722   0.880  -2.068
  488   HD13  ILE  64          HD13      ILE  64  65.404  -0.651  -2.617
  489    H    THR  65           HN       THR  65  68.052   5.788  -3.155
  490    HA   THR  65           HA       THR  65  65.941   7.540  -3.444
  491    HB   THR  65           HB       THR  65  68.520   8.217  -4.847
  492    HG1  THR  65           HG1      THR  65  69.021   7.044  -2.926
  493   HG21  THR  65          HG21      THR  65  68.139  10.366  -3.622
  494   HG22  THR  65          HG22      THR  65  66.642   9.690  -2.980
  495   HG23  THR  65          HG23      THR  65  66.820   9.948  -4.716
  496    H    VAL  66           HN       VAL  66  67.606   5.769  -5.934
  497    HA   VAL  66           HA       VAL  66  65.417   6.066  -7.789
  498    HB   VAL  66           HB       VAL  66  67.299   7.077  -9.508
  499   HG11  VAL  66          HG11      VAL  66  65.988   9.038  -9.535
  500   HG12  VAL  66          HG12      VAL  66  65.650   8.943  -7.807
  501   HG13  VAL  66          HG13      VAL  66  64.880   7.811  -8.919
  502   HG21  VAL  66          HG21      VAL  66  67.676   8.728  -7.013
  503   HG22  VAL  66          HG22      VAL  66  68.647   8.717  -8.485
  504   HG23  VAL  66          HG23      VAL  66  68.744   7.367  -7.354
  505    H    ILE  67           HN       ILE  67  68.837   5.294  -7.284
  506    HA   ILE  67           HA       ILE  67  68.407   2.765  -8.799
  507    HB   ILE  67           HB       ILE  67  70.742   4.664  -9.185
  508   HG12  ILE  67          HG12      ILE  67  68.678   3.647 -11.162
  509   HG13  ILE  67          HG11      ILE  67  68.587   5.219 -10.368
  510   HG21  ILE  67          HG21      ILE  67  71.412   2.934 -10.913
  511   HG22  ILE  67          HG22      ILE  67  70.206   1.861 -10.202
  512   HG23  ILE  67          HG23      ILE  67  71.579   2.406  -9.238
  513   HD11  ILE  67          HD11      ILE  67  69.625   5.435 -12.590
  514   HD12  ILE  67          HD12      ILE  67  70.859   4.260 -12.134
  515   HD13  ILE  67          HD13      ILE  67  70.787   5.824 -11.322
  516    H1U  RCY  68           H1U      RCY  68  67.734  -4.194   0.479
  517    H1S  RCY  68           H1S      RCY  68  68.113  -1.466  -3.525
  518    HB1  RCY  68           HB1      RCY  68  68.597  -0.274  -5.506
  519    HB2  RCY  68           HB2      RCY  68  68.842   0.809  -4.137
  520    HA   RCY  68           HA       RCY  68  70.740   1.796  -5.090
  521    HN1  RCY  68           HN1      RCY  68  68.690   1.296  -7.149
  522    HA   PRO  69           HA       PRO  69  73.934  -0.056  -7.691
  523    HB2  PRO  69           HB2      PRO  69  74.942  -0.717  -4.936
  524    HB3  PRO  69           HB1      PRO  69  75.831  -0.076  -6.334
  525    HG2  PRO  69           HG2      PRO  69  75.058   1.495  -4.315
  526    HG3  PRO  69           HG1      PRO  69  75.085   2.070  -5.990
  527    HD2  PRO  69           HD2      PRO  69  72.753   1.463  -4.264
  528    HD3  PRO  69           HD1      PRO  69  72.848   2.494  -5.709
  529    H    TRP  70           HN       TRP  70  72.132  -1.591  -5.136
  530    HA   TRP  70           HA       TRP  70  73.027  -4.300  -5.783
  531    HD1  TRP  70           HD1      TRP  70  73.949  -5.456  -3.756
  532    HE1  TRP  70           HE1      TRP  70  73.517  -7.922  -3.147
  533    HE3  TRP  70           HE3      TRP  70  68.847  -5.530  -3.945
  534    HZ2  TRP  70           HZ2      TRP  70  71.297  -9.696  -2.787
  535    HZ3  TRP  70           HZ3      TRP  70  67.602  -7.615  -3.467
  536    HH2  TRP  70           HH2      TRP  70  68.816  -9.696  -2.889
  537    HB2  TRP  70           HB2      TRP  70  72.068  -3.303  -3.520
  538    HB3  TRP  70           HB1      TRP  70  70.515  -3.722  -4.240
  539    H    GLU  71           HN       GLU  71  71.662  -2.484  -7.841
  540    HA   GLU  71           HA       GLU  71  69.566  -4.462  -8.658
  541    HB2  GLU  71           HB2      GLU  71  69.448  -1.439  -8.736
  542    HB3  GLU  71           HB1      GLU  71  68.373  -2.458  -9.694
  543    HG2  GLU  71           HG2      GLU  71  67.621  -3.587  -7.611
  544    HG3  GLU  71           HG1      GLU  71  68.648  -2.501  -6.673
  545    H    ALA  72           HN       ALA  72  70.655  -1.519 -10.299
  546    HA   ALA  72           HA       ALA  72  70.948  -2.756 -12.826
  547    HB1  ALA  72           HB1      ALA  72  72.353  -0.744 -13.394
  548    HB2  ALA  72           HB2      ALA  72  72.275  -0.278 -11.695
  549    HB3  ALA  72           HB3      ALA  72  70.800  -0.346 -12.659
  550    H1U  RCY  73           H1U      RCY  73  78.874   3.513 -12.689
  551    H1S  RCY  73           H1S      RCY  73  76.966   1.231  -9.487
  552    HB1  RCY  73           HB1      RCY  73  76.537  -1.314 -12.455
  553    HB2  RCY  73           HB2      RCY  73  77.305  -2.210 -11.144
  554    HA   RCY  73           HA       RCY  73  75.496  -3.439 -12.526
  555    HN1  RCY  73           HN1      RCY  73  73.850  -1.310 -11.443
  556    H    ASN  74           HN       ASN  74  73.760  -4.783 -10.962
  557    HA   ASN  74           HA       ASN  74  74.803  -5.127  -8.247
  558    HB2  ASN  74           HB2      ASN  74  73.177  -7.135  -8.313
  559    HB3  ASN  74           HB1      ASN  74  72.473  -5.523  -8.445
  560   HD21  ASN  74          HD21      ASN  74  70.700  -7.000  -9.540
  561   HD22  ASN  74          HD22      ASN  74  70.850  -7.216 -11.217
  562    H    HIS  75           HN       HIS  75  74.169  -7.790 -10.499
  563    HA   HIS  75           HA       HIS  75  75.460  -9.694 -10.964
  564    HD1  HIS  75           HD1      HIS  75  75.218  -9.333 -13.298
  565    HD2  HIS  75           HD2      HIS  75  77.247  -5.721 -12.813
  566    HE1  HIS  75           HE1      HIS  75  74.441  -7.819 -15.174
  567    HE2  HIS  75           HE2      HIS  75  75.669  -5.617 -14.890
  568    HB2  HIS  75           HB2      HIS  75  77.722  -7.674 -10.927
  569    HB3  HIS  75           HB1      HIS  75  77.710  -9.228 -11.761
  570    H1U  RCY  76           H1U      RCY  76  78.140 -12.372  -1.627
  571    H1S  RCY  76           H1S      RCY  76  79.313  -9.289  -4.089
  572    HB1  RCY  76           HB1      RCY  76  77.489 -10.051  -5.773
  573    HB2  RCY  76           HB2      RCY  76  76.535  -8.897  -6.703
  574    HA   RCY  76           HA       RCY  76  79.364  -8.788  -7.421
  575    HN1  RCY  76           HN1      RCY  76  78.158  -8.132  -9.320
  576    H    GLU  77           HN       GLU  77  80.730 -10.500  -7.484
  577    HA   GLU  77           HA       GLU  77  80.170 -12.962  -8.765
  578    HB2  GLU  77           HB2      GLU  77  82.245 -12.136  -6.735
  579    HB3  GLU  77           HB1      GLU  77  82.171 -13.791  -7.338
  580    HG2  GLU  77           HG2      GLU  77  83.744 -12.408  -8.665
  581    HG3  GLU  77           HG1      GLU  77  82.395 -12.981  -9.647
  582    H    LEU  78           HN       LEU  78  81.329 -13.686  -5.647
  583    HA   LEU  78           HA       LEU  78  78.822 -14.208  -4.333
  584    HG   LEU  78           HG       LEU  78  81.442 -16.257  -5.474
  585    HB2  LEU  78           HB2      LEU  78  78.698 -16.601  -4.553
  586    HB3  LEU  78           HB1      LEU  78  78.745 -15.903  -6.166
  587   HD11  LEU  78          HD11      LEU  78  81.699 -18.373  -4.530
  588   HD12  LEU  78          HD12      LEU  78  80.080 -18.891  -5.002
  589   HD13  LEU  78          HD13      LEU  78  80.291 -17.777  -3.651
  590   HD21  LEU  78          HD21      LEU  78  80.394 -16.566  -7.700
  591   HD22  LEU  78          HD22      LEU  78  79.622 -18.043  -7.123
  592   HD23  LEU  78          HD23      LEU  78  81.379 -17.960  -7.255
  593    H    HIS  79           HN       HIS  79  80.320 -13.033  -2.845
  594    HA   HIS  79           HA       HIS  79  81.464 -14.858  -0.934
  595    HD1  HIS  79           HD1      HIS  79  82.704 -15.280   0.504
  596    HD2  HIS  79           HD2      HIS  79  85.548 -15.817  -2.501
  597    HE1  HIS  79           HE1      HIS  79  84.222 -17.154   1.281
  598    HE2  HIS  79           HE2      HIS  79  85.957 -17.490  -0.539
  599    HB2  HIS  79           HB2      HIS  79  83.187 -14.233  -3.038
  600    HB3  HIS  79           HB1      HIS  79  83.669 -13.107  -1.771
  601    H    GLU  80           HN       GLU  80  82.018 -13.753   1.032
  602    HA   GLU  80           HA       GLU  80  80.700 -11.162   1.312
  603    HB2  GLU  80           HB2      GLU  80  81.509 -13.303   3.048
  604    HB3  GLU  80           HB1      GLU  80  82.227 -11.811   3.650
  605    HG2  GLU  80           HG2      GLU  80  80.058 -10.721   3.700
  606    HG3  GLU  80           HG1      GLU  80  79.297 -12.112   2.926
  607    H    LEU  81           HN       LEU  81  84.035 -12.374   1.302
  608    HA   LEU  81           HA       LEU  81  85.250  -9.882   2.051
  609    HG   LEU  81           HG       LEU  81  85.287 -12.842   0.065
  610    HB2  LEU  81           HB2      LEU  81  87.192 -11.073   0.549
  611    HB3  LEU  81           HB1      LEU  81  86.868 -11.490   2.230
  612   HD11  LEU  81          HD11      LEU  81  88.106 -13.553   0.927
  613   HD12  LEU  81          HD12      LEU  81  87.583 -13.104  -0.696
  614   HD13  LEU  81          HD13      LEU  81  87.046 -14.626   0.015
  615   HD21  LEU  81          HD21      LEU  81  86.415 -14.049   2.582
  616   HD22  LEU  81          HD22      LEU  81  84.949 -14.487   1.704
  617   HD23  LEU  81          HD23      LEU  81  84.994 -13.008   2.664
  618    H    ALA  82           HN       ALA  82  83.320 -10.416  -0.495
  619    HA   ALA  82           HA       ALA  82  84.811  -9.288  -2.693
  620    HB1  ALA  82           HB1      ALA  82  82.568  -8.941  -3.716
  621    HB2  ALA  82           HB2      ALA  82  81.821  -9.393  -2.184
  622    HB3  ALA  82           HB3      ALA  82  82.764 -10.576  -3.087
  623    H    GLN  83           HN       GLN  83  85.033  -7.785  -0.171
  624    HA   GLN  83           HA       GLN  83  83.485  -5.460  -0.021
  625    HB2  GLN  83           HB2      GLN  83  86.476  -5.744   0.406
  626    HB3  GLN  83           HB1      GLN  83  85.516  -4.363   0.935
  627    HG2  GLN  83           HG2      GLN  83  84.778  -7.173   1.749
  628    HG3  GLN  83           HG1      GLN  83  85.965  -6.241   2.662
  629   HE21  GLN  83          HE21      GLN  83  82.590  -6.011   1.423
  630   HE22  GLN  83          HE22      GLN  83  82.038  -5.017   2.683
  631    H    TYR  84           HN       TYR  84  86.244  -6.143  -2.150
  632    HA   TYR  84           HA       TYR  84  85.347  -3.884  -3.869
  633    HD1  TYR  84           HD2      TYR  84  89.072  -5.809  -2.721
  634    HD2  TYR  84           HD1      TYR  84  87.025  -2.479  -0.940
  635    HE1  TYR  84           HE2      TYR  84  89.997  -6.426  -0.504
  636    HE2  TYR  84           HE1      TYR  84  87.950  -3.096   1.277
  637    HH   TYR  84           HH       TYR  84  89.972  -4.367   2.134
  638    HB2  TYR  84           HB2      TYR  84  88.161  -3.925  -4.088
  639    HB3  TYR  84           HB1      TYR  84  87.180  -2.676  -3.329
  640    H    GLY  85           HN       GLY  85  84.471  -5.575  -5.209
  641    HA2  GLY  85           HA2      GLY  85  86.565  -7.075  -6.735
  642    HA3  GLY  85           HA1      GLY  85  84.992  -7.784  -6.361
  643    H    ILE  86           HN       ILE  86  83.401  -5.474  -6.830
  644    HA   ILE  86           HA       ILE  86  83.878  -4.218  -9.339
  645    HB   ILE  86           HB       ILE  86  83.750  -6.370 -10.387
  646   HG12  ILE  86          HG12      ILE  86  82.075  -4.357 -11.063
  647   HG13  ILE  86          HG11      ILE  86  82.142  -5.878 -11.953
  648   HG21  ILE  86          HG21      ILE  86  81.341  -6.783  -8.600
  649   HG22  ILE  86          HG22      ILE  86  82.841  -7.709  -8.615
  650   HG23  ILE  86          HG23      ILE  86  81.713  -7.836  -9.965
  651   HD11  ILE  86          HD11      ILE  86  80.171  -6.669 -11.026
  652   HD12  ILE  86          HD12      ILE  86  79.829  -4.939 -11.049
  653   HD13  ILE  86          HD13      ILE  86  80.357  -5.714  -9.555
  654    H1U  RCY  87           H1U      RCY  87  80.939  -2.189   1.110
  655    H1S  RCY  87           H1S      RCY  87  82.085  -0.844  -3.223
  656    HB1  RCY  87           HB1      RCY  87  80.387  -4.458  -4.787
  657    HB2  RCY  87           HB2      RCY  87  79.585  -2.887  -4.791
  658    HA   RCY  87           HA       RCY  87  79.545  -3.953  -7.040
  659    HN1  RCY  87           HN1      RCY  87  82.240  -4.614  -6.545
  Start of MODEL   47
    1    HA   MET   1           HA       MET   1  66.268  -9.837  20.938
    2    HB2  MET   1           HB2      MET   1  66.752 -10.324  23.882
    3    HB3  MET   1           HB1      MET   1  67.561  -9.021  23.010
    4    HG2  MET   1           HG2      MET   1  65.428  -8.043  22.385
    5    HG3  MET   1           HG1      MET   1  64.555  -9.405  23.086
    6    HE1  MET   1           HE1      MET   1  65.772  -5.861  23.671
    7    HE2  MET   1           HE2      MET   1  64.673  -5.703  25.039
    8    HE3  MET   1           HE3      MET   1  64.099  -6.415  23.533
    9    H    ASN   2           HN       ASN   2  67.528 -12.822  22.116
   10    HA   ASN   2           HA       ASN   2  70.306 -12.104  21.342
   11    HB2  ASN   2           HB2      ASN   2  69.732 -13.421  23.467
   12    HB3  ASN   2           HB1      ASN   2  69.344 -14.769  22.397
   13   HD21  ASN   2          HD21      ASN   2  71.153 -16.118  22.915
   14   HD22  ASN   2          HD22      ASN   2  72.759 -15.669  22.593
   15    H    LEU   3           HN       LEU   3  67.508 -13.633  20.070
   16    HA   LEU   3           HA       LEU   3  68.749 -15.538  18.320
   17    HG   LEU   3           HG       LEU   3  66.053 -14.704  20.037
   18    HB2  LEU   3           HB2      LEU   3  66.204 -14.030  17.700
   19    HB3  LEU   3           HB1      LEU   3  66.641 -15.671  17.225
   20   HD11  LEU   3          HD11      LEU   3  64.635 -16.594  18.138
   21   HD12  LEU   3          HD12      LEU   3  64.033 -15.051  18.743
   22   HD13  LEU   3          HD13      LEU   3  64.220 -16.416  19.843
   23   HD21  LEU   3          HD21      LEU   3  67.769 -16.327  20.276
   24   HD22  LEU   3          HD22      LEU   3  67.136 -17.309  18.956
   25   HD23  LEU   3          HD23      LEU   3  66.274 -17.238  20.493
   26    H    GLU   4           HN       GLU   4  70.048 -15.125  16.606
   27    HA   GLU   4           HA       GLU   4  70.243 -12.375  15.565
   28    HB2  GLU   4           HB2      GLU   4  71.781 -14.919  14.975
   29    HB3  GLU   4           HB1      GLU   4  72.103 -13.381  14.175
   30    HG2  GLU   4           HG2      GLU   4  72.109 -13.707  17.185
   31    HG3  GLU   4           HG1      GLU   4  73.562 -13.858  16.196
   32    HA   PRO   5           HA       PRO   5  67.583 -12.523  12.043
   33    HB2  PRO   5           HB2      PRO   5  70.135 -12.215  10.486
   34    HB3  PRO   5           HB1      PRO   5  68.592 -11.359  10.293
   35    HG2  PRO   5           HG2      PRO   5  70.693 -10.280  11.578
   36    HG3  PRO   5           HG1      PRO   5  69.017  -9.927  12.021
   37    HD2  PRO   5           HD2      PRO   5  71.035 -11.440  13.525
   38    HD3  PRO   5           HD1      PRO   5  69.476 -10.795  14.081
   39    HA   PRO   6           HA       PRO   6  68.682 -16.853  10.988
   40    HB2  PRO   6           HB2      PRO   6  66.250 -17.947  11.399
   41    HB3  PRO   6           HB1      PRO   6  67.323 -17.529  12.749
   42    HG2  PRO   6           HG2      PRO   6  64.916 -16.117  11.748
   43    HG3  PRO   6           HG1      PRO   6  65.527 -16.281  13.401
   44    HD2  PRO   6           HD2      PRO   6  65.874 -14.036  11.733
   45    HD3  PRO   6           HD1      PRO   6  66.762 -14.366  13.235
   46    H    LYS   7           HN       LYS   7  68.624 -17.657   8.909
   47    HA   LYS   7           HA       LYS   7  67.010 -16.301   6.898
   48    HB2  LYS   7           HB2      LYS   7  68.022 -18.260   5.456
   49    HB3  LYS   7           HB1      LYS   7  69.079 -16.974   6.040
   50    HG2  LYS   7           HG2      LYS   7  69.904 -18.318   7.823
   51    HG3  LYS   7           HG1      LYS   7  68.622 -19.512   7.616
   52    HD2  LYS   7           HD2      LYS   7  69.561 -20.345   5.612
   53    HD3  LYS   7           HD1      LYS   7  70.582 -18.923   5.398
   54    HE2  LYS   7           HE2      LYS   7  71.824 -20.956   6.220
   55    HE3  LYS   7           HE1      LYS   7  71.967 -19.552   7.278
   56    HZ1  LYS   7           HZ1      LYS   7  70.927 -20.612   8.913
   57    HZ2  LYS   7           HZ2      LYS   7  71.132 -22.039   8.014
   58    HZ3  LYS   7           HZ3      LYS   7  69.684 -21.159   7.896
   59    H    ALA   8           HN       ALA   8  64.859 -16.760   6.807
   60    HA   ALA   8           HA       ALA   8  64.052 -19.640   6.814
   61    HB1  ALA   8           HB1      ALA   8  63.530 -18.417   9.001
   62    HB2  ALA   8           HB2      ALA   8  62.160 -19.185   8.198
   63    HB3  ALA   8           HB3      ALA   8  62.394 -17.442   8.068
   64    H    GLU   9           HN       GLU   9  64.222 -19.137   4.424
   65    HA   GLU   9           HA       GLU   9  63.171 -18.689   2.377
   66    HB2  GLU   9           HB2      GLU   9  60.590 -18.411   3.917
   67    HB3  GLU   9           HB1      GLU   9  60.838 -19.049   2.291
   68    HG2  GLU   9           HG2      GLU   9  62.231 -20.897   3.392
   69    HG3  GLU   9           HG1      GLU   9  61.558 -20.344   4.926
   70    H1U  RCY  10           H1U      RCY  10  59.834  -8.409  -1.799
   71    H1S  RCY  10           H1S      RCY  10  61.410 -12.126  -0.927
   72    HB1  RCY  10           HB1      RCY  10  61.578 -14.490  -0.338
   73    HB2  RCY  10           HB2      RCY  10  63.167 -15.172   0.010
   74    HA   RCY  10           HA       RCY  10  62.526 -14.326   2.484
   75    HN1  RCY  10           HN1      RCY  10  62.006 -16.939   1.180
   76    H    ARG  11           HN       ARG  11  60.267 -15.707   3.478
   77    HA   ARG  11           HA       ARG  11  57.856 -14.804   2.133
   78    HE   ARG  11           HE       ARG  11  55.743 -16.312   6.809
   79    HB2  ARG  11           HB2      ARG  11  58.179 -16.786   3.812
   80    HB3  ARG  11           HB1      ARG  11  57.961 -15.550   5.050
   81    HG2  ARG  11           HG2      ARG  11  55.811 -14.900   4.031
   82    HG3  ARG  11           HG1      ARG  11  56.026 -16.133   2.788
   83    HD2  ARG  11           HD2      ARG  11  54.778 -17.378   4.260
   84    HD3  ARG  11           HD1      ARG  11  56.365 -17.671   4.971
   85   HH11  ARG  11          HH21      ARG  11  53.598 -15.992   4.129
   86   HH12  ARG  11          HH22      ARG  11  52.430 -15.060   5.004
   87   HH21  ARG  11          HH11      ARG  11  54.230 -15.097   7.968
   88   HH22  ARG  11          HH12      ARG  11  52.787 -14.554   7.178
   89    H    SER  12           HN       SER  12  58.543 -12.500   1.944
   90    HA   SER  12           HA       SER  12  58.405 -10.957   4.484
   91    HG   SER  12           HG       SER  12  58.415  -8.584   3.688
   92    HB2  SER  12           HB2      SER  12  60.203 -10.526   2.731
   93    HB3  SER  12           HB1      SER  12  58.922  -9.903   1.696
   94    H    ALA  13           HN       ALA  13  56.070 -12.289   3.089
   95    HA   ALA  13           HA       ALA  13  53.787 -11.733   2.914
   96    HB1  ALA  13           HB1      ALA  13  54.655  -9.810   4.575
   97    HB2  ALA  13           HB2      ALA  13  53.032  -9.780   3.887
   98    HB3  ALA  13           HB3      ALA  13  54.313  -8.803   3.167
   99    H    THR  14           HN       THR  14  56.089  -9.526   1.342
  100    HA   THR  14           HA       THR  14  54.588  -9.913  -1.201
  101    HB   THR  14           HB       THR  14  54.776  -7.510  -1.721
  102    HG1  THR  14           HG1      THR  14  55.277  -6.660   0.785
  103   HG21  THR  14          HG21      THR  14  52.733  -8.342  -0.608
  104   HG22  THR  14          HG22      THR  14  53.100  -6.687  -0.118
  105   HG23  THR  14          HG23      THR  14  53.468  -8.030   0.965
  106    H    ARG  15           HN       ARG  15  56.562  -7.604  -2.060
  107    HA   ARG  15           HA       ARG  15  58.874  -9.457  -2.482
  108    HE   ARG  15           HE       ARG  15  59.281  -6.387  -6.529
  109    HB2  ARG  15           HB2      ARG  15  59.386  -7.855  -4.414
  110    HB3  ARG  15           HB1      ARG  15  57.966  -8.883  -4.601
  111    HG2  ARG  15           HG2      ARG  15  56.556  -7.001  -3.728
  112    HG3  ARG  15           HG1      ARG  15  57.994  -5.979  -3.728
  113    HD2  ARG  15           HD2      ARG  15  56.432  -7.057  -6.038
  114    HD3  ARG  15           HD1      ARG  15  57.164  -5.467  -5.824
  115   HH11  ARG  15          HH21      ARG  15  56.669  -8.633  -6.401
  116   HH12  ARG  15          HH22      ARG  15  57.478  -9.833  -7.352
  117   HH21  ARG  15          HH11      ARG  15  60.354  -7.942  -7.771
  118   HH22  ARG  15          HH12      ARG  15  59.565  -9.442  -8.128
  119    H    VAL  16           HN       VAL  16  59.282  -8.559  -0.163
  120    HA   VAL  16           HA       VAL  16  60.367  -7.043   1.281
  121    HB   VAL  16           HB       VAL  16  62.697  -6.661   0.576
  122   HG11  VAL  16          HG11      VAL  16  61.949  -8.911   1.369
  123   HG12  VAL  16          HG12      VAL  16  63.306  -9.000   0.246
  124   HG13  VAL  16          HG13      VAL  16  61.675  -9.377  -0.310
  125   HG21  VAL  16          HG21      VAL  16  63.438  -7.171  -1.657
  126   HG22  VAL  16          HG22      VAL  16  62.047  -6.099  -1.817
  127   HG23  VAL  16          HG23      VAL  16  61.862  -7.832  -2.092
  128    H    MET  17           HN       MET  17  58.536  -5.725  -0.790
  129    HA   MET  17           HA       MET  17  59.171  -3.017  -0.082
  130    HB2  MET  17           HB2      MET  17  60.905  -3.613  -1.931
  131    HB3  MET  17           HB1      MET  17  59.535  -3.508  -3.035
  132    HG2  MET  17           HG2      MET  17  59.082  -1.220  -1.852
  133    HG3  MET  17           HG1      MET  17  60.766  -1.346  -1.344
  134    HE1  MET  17           HE1      MET  17  59.952   0.917  -2.567
  135    HE2  MET  17           HE2      MET  17  60.477   1.255  -4.215
  136    HE3  MET  17           HE3      MET  17  61.674   0.906  -2.970
  137    H    GLY  18           HN       GLY  18  56.838  -3.894   0.392
  138    HA2  GLY  18           HA2      GLY  18  54.539  -3.924  -0.151
  139    HA3  GLY  18           HA1      GLY  18  54.934  -2.405  -0.955
  140    H    GLY  19           HN       GLY  19  55.251  -2.404  -3.224
  141    HA2  GLY  19           HA2      GLY  19  55.200  -4.918  -4.720
  142    HA3  GLY  19           HA1      GLY  19  53.711  -3.981  -4.857
  143    HA   PRO  20           HA       PRO  20  55.115  -1.485  -8.195
  144    HB2  PRO  20           HB2      PRO  20  54.831   0.843  -6.319
  145    HB3  PRO  20           HB1      PRO  20  54.240   0.659  -7.982
  146    HG2  PRO  20           HG2      PRO  20  52.629   0.380  -5.864
  147    HG3  PRO  20           HG1      PRO  20  52.417  -0.570  -7.343
  148    HD2  PRO  20           HD2      PRO  20  53.357  -1.455  -4.681
  149    HD3  PRO  20           HD1      PRO  20  52.677  -2.415  -6.012
  150    H1U  RCY  21           H1U      RCY  21  66.439  -4.264  -7.964
  151    H1S  RCY  21           H1S      RCY  21  62.650  -4.068  -5.981
  152    HB1  RCY  21           HB1      RCY  21  59.764  -3.319  -7.490
  153    HB2  RCY  21           HB2      RCY  21  59.312  -2.883  -5.841
  154    HA   RCY  21           HA       RCY  21  59.220  -0.483  -6.561
  155    HN1  RCY  21           HN1      RCY  21  57.350  -2.389  -7.906
  156    H    THR  22           HN       THR  22  59.532   1.045  -8.208
  157    HA   THR  22           HA       THR  22  61.036   0.042 -10.573
  158    HB   THR  22           HB       THR  22  59.709   1.234 -12.143
  159    HG1  THR  22           HG1      THR  22  58.948   2.595  -9.870
  160   HG21  THR  22          HG21      THR  22  57.502   0.258 -11.872
  161   HG22  THR  22          HG22      THR  22  57.755   0.078 -10.136
  162   HG23  THR  22          HG23      THR  22  58.700  -0.887 -11.270
  163    HA   PRO  23           HA       PRO  23  63.247   3.581  -8.626
  164    HB2  PRO  23           HB2      PRO  23  65.447   2.507 -10.304
  165    HB3  PRO  23           HB1      PRO  23  65.423   2.850  -8.564
  166    HG2  PRO  23           HG2      PRO  23  65.402   0.352  -9.528
  167    HG3  PRO  23           HG1      PRO  23  64.554   0.798  -8.038
  168    HD2  PRO  23           HD2      PRO  23  63.422   0.269 -10.763
  169    HD3  PRO  23           HD1      PRO  23  62.733  -0.095  -9.164
  170    H    ARG  24           HN       ARG  24  65.373   4.585 -10.353
  171    HA   ARG  24           HA       ARG  24  63.697   5.814 -12.509
  172    HE   ARG  24           HE       ARG  24  65.860  10.856 -13.728
  173    HB2  ARG  24           HB2      ARG  24  64.715   7.277 -10.651
  174    HB3  ARG  24           HB1      ARG  24  66.276   6.938 -11.401
  175    HG2  ARG  24           HG2      ARG  24  65.404   7.811 -13.559
  176    HG3  ARG  24           HG1      ARG  24  63.883   8.212 -12.761
  177    HD2  ARG  24           HD2      ARG  24  64.750  10.072 -11.802
  178    HD3  ARG  24           HD1      ARG  24  66.236   9.242 -11.342
  179   HH11  ARG  24          HH21      ARG  24  67.464   8.150 -12.317
  180   HH12  ARG  24          HH22      ARG  24  68.831   8.238 -13.378
  181   HH21  ARG  24          HH11      ARG  24  67.635  10.987 -15.121
  182   HH22  ARG  24          HH12      ARG  24  68.928   9.845 -14.965
  183    H    LYS  25           HN       LYS  25  64.671   3.371 -13.175
  184    HA   LYS  25           HA       LYS  25  67.335   3.467 -14.318
  185    HB2  LYS  25           HB2      LYS  25  66.762   1.314 -15.311
  186    HB3  LYS  25           HB1      LYS  25  66.196   1.351 -13.641
  187    HG2  LYS  25           HG2      LYS  25  64.033   2.387 -14.980
  188    HG3  LYS  25           HG1      LYS  25  64.644   1.211 -16.145
  189    HD2  LYS  25           HD2      LYS  25  64.677  -0.503 -14.319
  190    HD3  LYS  25           HD1      LYS  25  63.915   0.676 -13.251
  191    HE2  LYS  25           HE2      LYS  25  62.117   0.887 -15.106
  192    HE3  LYS  25           HE1      LYS  25  62.781  -0.625 -15.724
  193    HZ1  LYS  25           HZ1      LYS  25  60.886  -0.467 -13.840
  194    HZ2  LYS  25           HZ2      LYS  25  62.281  -0.585 -12.877
  195    HZ3  LYS  25           HZ3      LYS  25  61.935  -1.788 -14.026
  196    H    GLY  26           HN       GLY  26  65.993   5.733 -15.203
  197    HA2  GLY  26           HA2      GLY  26  65.040   5.168 -17.948
  198    HA3  GLY  26           HA1      GLY  26  65.007   6.741 -17.149
  199    HA   PRO  27           HA       PRO  27  68.324   7.904 -19.924
  200    HB2  PRO  27           HB2      PRO  27  69.047   9.572 -17.536
  201    HB3  PRO  27           HB1      PRO  27  68.940  10.042 -19.244
  202    HG2  PRO  27           HG2      PRO  27  67.013  10.644 -17.498
  203    HG3  PRO  27           HG1      PRO  27  66.654  10.241 -19.184
  204    HD2  PRO  27           HD2      PRO  27  66.150   8.646 -16.733
  205    HD3  PRO  27           HD1      PRO  27  65.348   8.565 -18.316
  206    HA   PRO  28           HA       PRO  28  71.922   5.489 -19.001
  207    HB2  PRO  28           HB2      PRO  28  73.450   8.067 -19.176
  208    HB3  PRO  28           HB1      PRO  28  73.795   6.501 -19.939
  209    HG2  PRO  28           HG2      PRO  28  72.694   8.530 -21.294
  210    HG3  PRO  28           HG1      PRO  28  72.285   6.840 -21.627
  211    HD2  PRO  28           HD2      PRO  28  70.630   8.942 -20.366
  212    HD3  PRO  28           HD1      PRO  28  70.125   7.428 -21.147
  213    H    LYS  29           HN       LYS  29  73.697   5.285 -17.339
  214    HA   LYS  29           HA       LYS  29  73.495   7.135 -15.040
  215    HB2  LYS  29           HB2      LYS  29  73.162   5.178 -13.477
  216    HB3  LYS  29           HB1      LYS  29  71.761   5.558 -14.477
  217    HG2  LYS  29           HG2      LYS  29  73.818   3.496 -15.293
  218    HG3  LYS  29           HG1      LYS  29  72.392   3.084 -14.341
  219    HD2  LYS  29           HD2      LYS  29  71.270   4.562 -16.348
  220    HD3  LYS  29           HD1      LYS  29  72.605   3.787 -17.202
  221    HE2  LYS  29           HE2      LYS  29  70.316   2.486 -15.729
  222    HE3  LYS  29           HE1      LYS  29  70.835   2.233 -17.396
  223    HZ1  LYS  29           HZ1      LYS  29  72.132   1.310 -14.907
  224    HZ2  LYS  29           HZ2      LYS  29  72.990   1.404 -16.371
  225    HZ3  LYS  29           HZ3      LYS  29  71.632   0.391 -16.242
  226    H1U  RCY  30           H1U      RCY  30  79.053   9.267  -8.757
  227    H1S  RCY  30           H1S      RCY  30  80.257   6.601 -11.875
  228    HB1  RCY  30           HB1      RCY  30  77.280   7.279 -14.155
  229    HB2  RCY  30           HB2      RCY  30  78.565   7.720 -15.275
  230    HA   RCY  30           HA       RCY  30  77.928   6.162 -16.807
  231    HN1  RCY  30           HN1      RCY  30  75.676   6.895 -16.676
  232    H    LYS  31           HN       LYS  31  78.162   4.012 -17.319
  233    HA   LYS  31           HA       LYS  31  77.746   1.990 -15.170
  234    HB2  LYS  31           HB2      LYS  31  78.495   0.936 -17.802
  235    HB3  LYS  31           HB1      LYS  31  77.104   0.548 -16.798
  236    HG2  LYS  31           HG2      LYS  31  75.869   1.650 -18.349
  237    HG3  LYS  31           HG1      LYS  31  76.544   3.127 -17.660
  238    HD2  LYS  31           HD2      LYS  31  77.871   1.545 -19.878
  239    HD3  LYS  31           HD1      LYS  31  76.832   2.944 -20.156
  240    HE2  LYS  31           HE2      LYS  31  79.247   3.056 -18.339
  241    HE3  LYS  31           HE1      LYS  31  79.342   3.420 -20.062
  242    HZ1  LYS  31           HZ1      LYS  31  77.647   5.119 -19.755
  243    HZ2  LYS  31           HZ2      LYS  31  78.996   5.422 -18.768
  244    HZ3  LYS  31           HZ3      LYS  31  77.577   4.776 -18.095
  245    H    GLN  32           HN       GLN  32  80.195   3.821 -16.544
  246    HA   GLN  32           HA       GLN  32  82.305   1.820 -16.557
  247    HB2  GLN  32           HB2      GLN  32  82.294   4.844 -16.619
  248    HB3  GLN  32           HB1      GLN  32  83.790   3.908 -16.593
  249    HG2  GLN  32           HG2      GLN  32  83.161   2.758 -18.647
  250    HG3  GLN  32           HG1      GLN  32  81.590   3.562 -18.651
  251   HE21  GLN  32          HE21      GLN  32  85.105   4.392 -18.633
  252   HE22  GLN  32          HE22      GLN  32  84.930   5.778 -19.597
  253    H    ARG  33           HN       ARG  33  83.471   4.477 -14.890
  254    HA   ARG  33           HA       ARG  33  83.077   3.168 -12.229
  255    HE   ARG  33           HE       ARG  33  86.593   0.567 -12.063
  256    HB2  ARG  33           HB2      ARG  33  85.351   2.699 -13.331
  257    HB3  ARG  33           HB1      ARG  33  85.690   4.414 -13.107
  258    HG2  ARG  33           HG2      ARG  33  86.554   3.543 -11.131
  259    HG3  ARG  33           HG1      ARG  33  84.908   3.929 -10.628
  260    HD2  ARG  33           HD2      ARG  33  85.002   1.744  -9.897
  261    HD3  ARG  33           HD1      ARG  33  84.454   1.460 -11.548
  262   HH11  ARG  33          HH21      ARG  33  86.500   2.179  -9.017
  263   HH12  ARG  33          HH22      ARG  33  88.062   1.618  -8.522
  264   HH21  ARG  33          HH11      ARG  33  88.634  -0.175 -11.434
  265   HH22  ARG  33          HH12      ARG  33  89.270   0.286  -9.891
  266    H    GLN  34           HN       GLN  34  85.268   5.558 -11.809
  267    HA   GLN  34           HA       GLN  34  83.302   7.786 -11.744
  268    HB2  GLN  34           HB2      GLN  34  84.844   6.775  -9.333
  269    HB3  GLN  34           HB1      GLN  34  83.952   8.296  -9.382
  270    HG2  GLN  34           HG2      GLN  34  81.916   6.897 -10.081
  271    HG3  GLN  34           HG1      GLN  34  82.855   5.488  -9.587
  272   HE21  GLN  34          HE21      GLN  34  80.390   6.926  -8.348
  273   HE22  GLN  34          HE22      GLN  34  80.833   7.138  -6.724
  274    H    THR  35           HN       THR  35  85.015   9.483 -10.172
  275    HA   THR  35           HA       THR  35  86.715  10.535 -12.188
  276    HB   THR  35           HB       THR  35  86.886  10.883  -9.179
  277    HG1  THR  35           HG1      THR  35  85.861  12.814 -10.883
  278   HG21  THR  35          HG21      THR  35  88.144  12.357 -11.498
  279   HG22  THR  35          HG22      THR  35  88.948  11.638 -10.103
  280   HG23  THR  35          HG23      THR  35  87.963  13.087  -9.903
  281    H    ARG  36           HN       ARG  36  87.974   9.268  -9.092
  282    HA   ARG  36           HA       ARG  36  89.825   7.480 -10.508
  283    HE   ARG  36           HE       ARG  36  91.139   5.613 -10.058
  284    HB2  ARG  36           HB2      ARG  36  90.670  10.062 -10.235
  285    HB3  ARG  36           HB1      ARG  36  91.260   9.379  -8.723
  286    HG2  ARG  36           HG2      ARG  36  91.787   8.225 -11.480
  287    HG3  ARG  36           HG1      ARG  36  92.941   9.169 -10.536
  288    HD2  ARG  36           HD2      ARG  36  93.616   7.146  -9.745
  289    HD3  ARG  36           HD1      ARG  36  92.188   7.264  -8.717
  290   HH11  ARG  36          HH21      ARG  36  94.010   6.876 -11.489
  291   HH12  ARG  36          HH22      ARG  36  94.060   5.693 -12.753
  292   HH21  ARG  36          HH11      ARG  36  91.188   4.060 -11.701
  293   HH22  ARG  36          HH12      ARG  36  92.463   4.099 -12.873
  294    H    GLN  37           HN       GLN  37  88.691   5.932  -9.155
  295    HA   GLN  37           HA       GLN  37  88.362   4.680  -7.191
  296    HB2  GLN  37           HB2      GLN  37  91.082   5.893  -6.614
  297    HB3  GLN  37           HB1      GLN  37  90.368   4.555  -5.713
  298    HG2  GLN  37           HG2      GLN  37  90.103   3.462  -8.089
  299    HG3  GLN  37           HG1      GLN  37  91.365   4.606  -8.547
  300   HE21  GLN  37          HE21      GLN  37  90.718   1.647  -6.806
  301   HE22  GLN  37          HE22      GLN  37  92.313   1.362  -6.299
  302    H1U  RCY  38           H1U      RCY  38  83.204   2.062  -1.178
  303    H1S  RCY  38           H1S      RCY  38  83.708   6.042  -3.931
  304    HB1  RCY  38           HB1      RCY  38  86.112   7.268  -2.800
  305    HB2  RCY  38           HB2      RCY  38  86.563   5.565  -2.732
  306    HA   RCY  38           HA       RCY  38  88.116   7.883  -3.868
  307    HN1  RCY  38           HN1      RCY  38  89.004   5.145  -4.539
  308    H    LYS  39           HN       LYS  39  89.405   4.767  -2.959
  309    HA   LYS  39           HA       LYS  39  89.678   4.914  -0.203
  310    HB2  LYS  39           HB2      LYS  39  91.836   4.109  -2.172
  311    HB3  LYS  39           HB1      LYS  39  91.797   3.675  -0.465
  312    HG2  LYS  39           HG2      LYS  39  89.772   2.394  -0.762
  313    HG3  LYS  39           HG1      LYS  39  89.589   2.975  -2.418
  314    HD2  LYS  39           HD2      LYS  39  92.159   1.629  -1.747
  315    HD3  LYS  39           HD1      LYS  39  90.726   0.604  -1.847
  316    HE2  LYS  39           HE2      LYS  39  91.820   0.750  -4.043
  317    HE3  LYS  39           HE1      LYS  39  90.238   1.527  -4.095
  318    HZ1  LYS  39           HZ1      LYS  39  91.153   3.603  -4.193
  319    HZ2  LYS  39           HZ2      LYS  39  92.333   2.722  -5.040
  320    HZ3  LYS  39           HZ3      LYS  39  92.589   3.144  -3.415
  321    H    SER  40           HN       SER  40  90.932   7.136  -2.492
  322    HA   SER  40           HA       SER  40  93.175   8.070  -0.898
  323    HG   SER  40           HG       SER  40  94.185   9.734  -1.784
  324    HB2  SER  40           HB2      SER  40  92.927   8.382  -3.399
  325    HB3  SER  40           HB1      SER  40  91.685   9.583  -3.058
  326    H    LYS  41           HN       LYS  41  91.067   7.935   0.859
  327    HA   LYS  41           HA       LYS  41  90.689  10.799   1.518
  328    HB2  LYS  41           HB2      LYS  41  88.284  10.502   1.928
  329    HB3  LYS  41           HB1      LYS  41  88.667  10.140   0.244
  330    HG2  LYS  41           HG2      LYS  41  88.844   7.702   0.914
  331    HG3  LYS  41           HG1      LYS  41  88.181   8.161   2.483
  332    HD2  LYS  41           HD2      LYS  41  86.830   8.684  -0.181
  333    HD3  LYS  41           HD1      LYS  41  86.419   7.363   0.913
  334    HE2  LYS  41           HE2      LYS  41  86.126   9.226   2.701
  335    HE3  LYS  41           HE1      LYS  41  86.054  10.326   1.324
  336    HZ1  LYS  41           HZ1      LYS  41  83.893   9.792   1.343
  337    HZ2  LYS  41           HZ2      LYS  41  84.133   8.357   2.221
  338    HZ3  LYS  41           HZ3      LYS  41  84.393   8.383   0.542
  339    HA   PRO  42           HA       PRO  42  91.556   9.075   5.537
  340    HB2  PRO  42           HB2      PRO  42  90.866  11.201   7.099
  341    HB3  PRO  42           HB1      PRO  42  92.324  11.193   6.086
  342    HG2  PRO  42           HG2      PRO  42  89.681  12.465   5.572
  343    HG3  PRO  42           HG1      PRO  42  91.312  13.081   5.255
  344    HD2  PRO  42           HD2      PRO  42  89.717  11.978   3.307
  345    HD3  PRO  42           HD1      PRO  42  91.493  11.951   3.246
  346    HA   PRO  43           HA       PRO  43  87.786   7.488   7.232
  347    HB2  PRO  43           HB2      PRO  43  88.384   7.369   9.924
  348    HB3  PRO  43           HB1      PRO  43  88.990   6.214   8.722
  349    HG2  PRO  43           HG2      PRO  43  90.355   8.555   9.947
  350    HG3  PRO  43           HG1      PRO  43  91.000   6.957   9.534
  351    HD2  PRO  43           HD2      PRO  43  91.445   9.161   7.986
  352    HD3  PRO  43           HD1      PRO  43  91.343   7.520   7.309
  353    H    LYS  44           HN       LYS  44  85.823   8.310   7.934
  354    HA   LYS  44           HA       LYS  44  85.851  11.074   9.060
  355    HB2  LYS  44           HB2      LYS  44  84.228   9.696   7.090
  356    HB3  LYS  44           HB1      LYS  44  83.203  10.314   8.382
  357    HG2  LYS  44           HG2      LYS  44  83.413  12.063   6.731
  358    HG3  LYS  44           HG1      LYS  44  84.378  12.540   8.129
  359    HD2  LYS  44           HD2      LYS  44  85.898  12.931   6.419
  360    HD3  LYS  44           HD1      LYS  44  86.301  11.264   6.831
  361    HE2  LYS  44           HE2      LYS  44  84.880  10.437   5.021
  362    HE3  LYS  44           HE1      LYS  44  84.373  12.082   4.639
  363    HZ1  LYS  44           HZ1      LYS  44  86.905  10.744   4.099
  364    HZ2  LYS  44           HZ2      LYS  44  86.984  12.390   4.512
  365    HZ3  LYS  44           HZ3      LYS  44  86.065  11.891   3.173
  366    H    LYS  45           HN       LYS  45  83.439  11.229  10.292
  367    HA   LYS  45           HA       LYS  45  83.854  10.109  12.840
  368    HB2  LYS  45           HB2      LYS  45  81.190  10.817  11.572
  369    HB3  LYS  45           HB1      LYS  45  81.508  10.672  13.301
  370    HG2  LYS  45           HG2      LYS  45  83.282  12.470  13.009
  371    HG3  LYS  45           HG1      LYS  45  82.645  12.719  11.383
  372    HD2  LYS  45           HD2      LYS  45  80.974  12.880  13.907
  373    HD3  LYS  45           HD1      LYS  45  81.658  14.280  13.080
  374    HE2  LYS  45           HE2      LYS  45  80.467  13.392  10.973
  375    HE3  LYS  45           HE1      LYS  45  79.557  12.359  12.076
  376    HZ1  LYS  45           HZ1      LYS  45  79.276  15.150  11.570
  377    HZ2  LYS  45           HZ2      LYS  45  79.493  14.840  13.227
  378    HZ3  LYS  45           HZ3      LYS  45  78.226  14.091  12.379
  379    H    GLY  46           HN       GLY  46  82.484   8.669   9.979
  380    HA2  GLY  46           HA2      GLY  46  82.017   6.386   9.589
  381    HA3  GLY  46           HA1      GLY  46  82.473   6.049  11.260
  382    H    VAL  47           HN       VAL  47  80.795   7.243  12.854
  383    HA   VAL  47           HA       VAL  47  78.371   5.863  12.764
  384    HB   VAL  47           HB       VAL  47  78.954   8.588  13.958
  385   HG11  VAL  47          HG11      VAL  47  76.573   6.743  14.203
  386   HG12  VAL  47          HG12      VAL  47  76.583   8.461  13.804
  387   HG13  VAL  47          HG13      VAL  47  76.963   7.934  15.444
  388   HG21  VAL  47          HG21      VAL  47  80.292   6.611  14.766
  389   HG22  VAL  47          HG22      VAL  47  78.776   5.848  15.247
  390   HG23  VAL  47          HG23      VAL  47  79.292   7.350  16.016
  391    H    GLN  48           HN       GLN  48  76.221   6.476  12.107
  392    HA   GLN  48           HA       GLN  48  75.959   7.586   9.546
  393    HB2  GLN  48           HB2      GLN  48  73.578   7.716   9.975
  394    HB3  GLN  48           HB1      GLN  48  74.199   6.276  10.779
  395    HG2  GLN  48           HG2      GLN  48  72.971   7.185  12.517
  396    HG3  GLN  48           HG1      GLN  48  74.521   7.976  12.805
  397   HE21  GLN  48          HE21      GLN  48  71.849   8.615  10.453
  398   HE22  GLN  48          HE22      GLN  48  71.689  10.254  10.863
  399    H    GLY  49           HN       GLY  49  76.046   9.651   8.787
  400    HA2  GLY  49           HA2      GLY  49  75.359  11.905  10.569
  401    HA3  GLY  49           HA1      GLY  49  77.018  11.867   9.970
  402    H1U  RCY  50           H1U      RCY  50  79.696   7.612   3.292
  403    H1S  RCY  50           H1S      RCY  50  77.062   9.660   4.533
  404    HB1  RCY  50           HB1      RCY  50  77.124  12.743   4.375
  405    HB2  RCY  50           HB2      RCY  50  76.134  11.288   4.297
  406    HA   RCY  50           HA       RCY  50  75.919  13.558   6.105
  407    HN1  RCY  50           HN1      RCY  50  76.975  11.286   7.424
  408    H    GLY  51           HN       GLY  51  74.841  10.403   4.938
  409    HA2  GLY  51           HA2      GLY  51  72.683  10.007   3.959
  410    HA3  GLY  51           HA1      GLY  51  72.328   9.948   5.683
  411    H    ASP  52           HN       ASP  52  73.106  12.758   3.613
  412    HA   ASP  52           HA       ASP  52  70.335  13.719   3.778
  413    HB2  ASP  52           HB2      ASP  52  71.325  14.365   5.980
  414    HB3  ASP  52           HB1      ASP  52  72.557  15.287   5.119
  415    H    ASP  53           HN       ASP  53  73.613  13.982   2.636
  416    HA   ASP  53           HA       ASP  53  73.485  16.355   1.114
  417    HB2  ASP  53           HB2      ASP  53  75.483  14.776   1.455
  418    HB3  ASP  53           HB1      ASP  53  74.813  13.824   0.130
  419    H    ILE  54           HN       ILE  54  73.719  15.813  -1.557
  420    HA   ILE  54           HA       ILE  54  71.141  14.469  -2.288
  421    HB   ILE  54           HB       ILE  54  72.259  17.029  -3.477
  422   HG12  ILE  54          HG12      ILE  54  69.748  16.663  -1.824
  423   HG13  ILE  54          HG11      ILE  54  71.287  17.160  -1.120
  424   HG21  ILE  54          HG21      ILE  54  71.040  15.820  -5.153
  425   HG22  ILE  54          HG22      ILE  54  69.948  17.063  -4.542
  426   HG23  ILE  54          HG23      ILE  54  69.769  15.391  -4.009
  427   HD11  ILE  54          HD11      ILE  54  70.050  18.614  -3.463
  428   HD12  ILE  54          HD12      ILE  54  71.340  19.170  -2.397
  429   HD13  ILE  54          HD13      ILE  54  69.687  19.047  -1.792
  430    HA   PRO  55           HA       PRO  55  74.554  12.844  -4.929
  431    HB2  PRO  55           HB2      PRO  55  74.373  10.239  -4.257
  432    HB3  PRO  55           HB1      PRO  55  75.210  11.412  -3.220
  433    HG2  PRO  55           HG2      PRO  55  72.536  10.179  -2.895
  434    HG3  PRO  55           HG1      PRO  55  73.717  10.663  -1.668
  435    HD2  PRO  55           HD2      PRO  55  71.441  12.140  -2.454
  436    HD3  PRO  55           HD1      PRO  55  72.796  12.743  -1.475
  437    H    GLY  56           HN       GLY  56  71.460  11.112  -4.368
  438    HA2  GLY  56           HA2      GLY  56  71.396  10.334  -7.224
  439    HA3  GLY  56           HA1      GLY  56  70.289   9.762  -5.976
  440    H    MET  57           HN       MET  57  69.689  12.426  -4.939
  441    HA   MET  57           HA       MET  57  68.282  14.258  -5.385
  442    HB2  MET  57           HB2      MET  57  69.881  14.233  -7.560
  443    HB3  MET  57           HB1      MET  57  68.354  13.826  -8.339
  444    HG2  MET  57           HG2      MET  57  68.813  16.215  -6.525
  445    HG3  MET  57           HG1      MET  57  68.707  16.274  -8.285
  446    HE1  MET  57           HE1      MET  57  66.781  16.547  -9.568
  447    HE2  MET  57           HE2      MET  57  65.172  15.911  -9.233
  448    HE3  MET  57           HE3      MET  57  66.526  14.802  -9.442
  449    H    GLU  58           HN       GLU  58  67.200  11.742  -4.832
  450    HA   GLU  58           HA       GLU  58  64.532  12.042  -5.903
  451    HB2  GLU  58           HB2      GLU  58  65.772  10.930  -7.820
  452    HB3  GLU  58           HB1      GLU  58  66.004   9.538  -6.762
  453    HG2  GLU  58           HG2      GLU  58  63.476   9.540  -6.420
  454    HG3  GLU  58           HG1      GLU  58  63.390  10.694  -7.752
  455    H    GLY  59           HN       GLY  59  66.877   9.869  -4.348
  456    HA2  GLY  59           HA2      GLY  59  66.685   8.744  -2.287
  457    HA3  GLY  59           HA1      GLY  59  65.137   9.554  -2.042
  458    H1U  RCY  60           H1U      RCY  60  71.135   6.365  -1.410
  459    H1S  RCY  60           H1S      RCY  60  68.699   3.291  -4.227
  460    HB1  RCY  60           HB1      RCY  60  65.299   3.290  -2.432
  461    HB2  RCY  60           HB2      RCY  60  66.602   4.453  -2.197
  462    HA   RCY  60           HA       RCY  60  64.458   5.333  -4.041
  463    HN1  RCY  60           HN1      RCY  60  66.282   6.584  -2.118
  464    H    GLY  61           HN       GLY  61  64.405   6.282  -0.704
  465    HA2  GLY  61           HA2      GLY  61  61.708   6.205  -0.247
  466    HA3  GLY  61           HA1      GLY  61  62.176   4.524   0.020
  467    H    THR  62           HN       THR  62  63.878   7.562   0.788
  468    HA   THR  62           HA       THR  62  64.871   8.262   2.792
  469    HB   THR  62           HB       THR  62  63.358   7.801   4.848
  470    HG1  THR  62           HG1      THR  62  61.461   7.174   2.876
  471   HG21  THR  62          HG21      THR  62  63.355   9.931   3.657
  472   HG22  THR  62          HG22      THR  62  61.696   9.474   4.044
  473   HG23  THR  62          HG23      THR  62  62.311   9.258   2.405
  474    H    ASP  63           HN       ASP  63  64.720   5.093   1.965
  475    HA   ASP  63           HA       ASP  63  65.516   3.807   4.430
  476    HB2  ASP  63           HB2      ASP  63  66.369   2.013   2.803
  477    HB3  ASP  63           HB1      ASP  63  64.645   2.381   2.731
  478    H    ILE  64           HN       ILE  64  67.004   6.186   4.098
  479    HA   ILE  64           HA       ILE  64  69.667   5.284   4.566
  480    HB   ILE  64           HB       ILE  64  69.801   4.812   2.193
  481   HG12  ILE  64          HG12      ILE  64  71.057   7.540   2.569
  482   HG13  ILE  64          HG11      ILE  64  71.690   6.092   3.353
  483   HG21  ILE  64          HG21      ILE  64  69.222   6.463   0.502
  484   HG22  ILE  64          HG22      ILE  64  68.873   7.665   1.745
  485   HG23  ILE  64          HG23      ILE  64  67.839   6.246   1.575
  486   HD11  ILE  64          HD11      ILE  64  72.897   6.424   1.272
  487   HD12  ILE  64          HD12      ILE  64  71.386   6.552   0.372
  488   HD13  ILE  64          HD13      ILE  64  71.855   5.013   1.093
  489    H    THR  65           HN       THR  65  67.547   7.854   3.512
  490    HA   THR  65           HA       THR  65  69.079  10.135   3.957
  491    HB   THR  65           HB       THR  65  66.214   9.732   4.877
  492    HG1  THR  65           HG1      THR  65  65.726  10.495   2.805
  493   HG21  THR  65          HG21      THR  65  66.982  11.780   5.788
  494   HG22  THR  65          HG22      THR  65  66.164  12.239   4.295
  495   HG23  THR  65          HG23      THR  65  67.925  12.161   4.347
  496    H    VAL  66           HN       VAL  66  68.292   7.692   6.204
  497    HA   VAL  66           HA       VAL  66  69.691   9.170   8.327
  498    HB   VAL  66           HB       VAL  66  67.820   8.597   9.972
  499   HG11  VAL  66          HG11      VAL  66  67.056  10.565   7.799
  500   HG12  VAL  66          HG12      VAL  66  68.304  10.889   9.003
  501   HG13  VAL  66          HG13      VAL  66  66.633  10.641   9.510
  502   HG21  VAL  66          HG21      VAL  66  66.379   8.193   7.335
  503   HG22  VAL  66          HG22      VAL  66  65.548   8.443   8.870
  504   HG23  VAL  66          HG23      VAL  66  66.563   7.020   8.639
  505    H    ILE  67           HN       ILE  67  67.813   6.198   7.600
  506    HA   ILE  67           HA       ILE  67  70.066   4.643   8.792
  507    HB   ILE  67           HB       ILE  67  67.151   4.012   9.314
  508   HG12  ILE  67          HG12      ILE  67  69.195   5.398  11.079
  509   HG13  ILE  67          HG11      ILE  67  67.731   6.125  10.416
  510   HG21  ILE  67          HG21      ILE  67  68.021   2.408  10.883
  511   HG22  ILE  67          HG22      ILE  67  69.661   3.028  10.694
  512   HG23  ILE  67          HG23      ILE  67  68.887   2.164   9.366
  513   HD11  ILE  67          HD11      ILE  67  66.420   4.317  11.627
  514   HD12  ILE  67          HD12      ILE  67  67.215   5.493  12.673
  515   HD13  ILE  67          HD13      ILE  67  67.921   3.892  12.450
  516    H1U  RCY  68           H1U      RCY  68  73.522   3.454  -0.568
  517    H1S  RCY  68           H1S      RCY  68  72.830   4.430   3.353
  518    HB1  RCY  68           HB1      RCY  68  70.414   3.630   3.877
  519    HB2  RCY  68           HB2      RCY  68  70.914   1.950   3.738
  520    HA   RCY  68           HA       RCY  68  68.776   2.455   5.104
  521    HN1  RCY  68           HN1      RCY  68  70.796   3.607   6.962
  522    HA   PRO  69           HA       PRO  69  68.852  -1.762   6.325
  523    HB2  PRO  69           HB2      PRO  69  70.360  -2.192   3.759
  524    HB3  PRO  69           HB1      PRO  69  69.011  -3.127   4.437
  525    HG2  PRO  69           HG2      PRO  69  68.676  -1.274   2.509
  526    HG3  PRO  69           HG1      PRO  69  67.442  -1.628   3.726
  527    HD2  PRO  69           HD2      PRO  69  69.040   0.804   3.400
  528    HD3  PRO  69           HD1      PRO  69  67.622   0.531   4.436
  529    H    TRP  70           HN       TRP  70  71.888  -0.355   5.148
  530    HA   TRP  70           HA       TRP  70  73.649  -2.364   6.158
  531    HD1  TRP  70           HD1      TRP  70  75.670  -2.370   7.321
  532    HE1  TRP  70           HE1      TRP  70  77.865  -1.569   8.407
  533    HE3  TRP  70           HE3      TRP  70  75.884   2.385   5.472
  534    HZ2  TRP  70           HZ2      TRP  70  79.500   0.782   8.483
  535    HZ3  TRP  70           HZ3      TRP  70  77.765   3.880   6.065
  536    HH2  TRP  70           HH2      TRP  70  79.571   3.089   7.566
  537    HB2  TRP  70           HB2      TRP  70  74.610  -0.772   4.682
  538    HB3  TRP  70           HB1      TRP  70  73.983   0.589   5.611
  539    H    GLU  71           HN       GLU  71  72.805   0.798   7.618
  540    HA   GLU  71           HA       GLU  71  74.031   0.430  10.108
  541    HB2  GLU  71           HB2      GLU  71  71.517   1.888   9.290
  542    HB3  GLU  71           HB1      GLU  71  72.064   1.888  10.968
  543    HG2  GLU  71           HG2      GLU  71  74.247   2.793  10.262
  544    HG3  GLU  71           HG1      GLU  71  73.707   2.791   8.582
  545    H    ALA  72           HN       ALA  72  70.945  -0.846   8.944
  546    HA   ALA  72           HA       ALA  72  70.179  -1.916  11.544
  547    HB1  ALA  72           HB1      ALA  72  68.436  -1.377   9.947
  548    HB2  ALA  72           HB2      ALA  72  68.428  -3.122  10.205
  549    HB3  ALA  72           HB3      ALA  72  69.151  -2.450   8.744
  550    H1U  RCY  73           H1U      RCY  73  75.911  -2.323   4.122
  551    H1S  RCY  73           H1S      RCY  73  73.214  -6.278   4.863
  552    HB1  RCY  73           HB1      RCY  73  73.799  -5.996   7.907
  553    HB2  RCY  73           HB2      RCY  73  73.325  -4.333   7.560
  554    HA   RCY  73           HA       RCY  73  71.533  -6.025   9.271
  555    HN1  RCY  73           HN1      RCY  73  71.493  -3.327   8.533
  556    H    ASN  74           HN       ASN  74  74.101  -3.608   9.904
  557    HA   ASN  74           HA       ASN  74  75.668  -3.520  11.649
  558    HB2  ASN  74           HB2      ASN  74  73.534  -4.350  12.951
  559    HB3  ASN  74           HB1      ASN  74  74.382  -5.895  12.975
  560   HD21  ASN  74          HD21      ASN  74  76.731  -5.765  13.828
  561   HD22  ASN  74          HD22      ASN  74  77.041  -4.663  15.081
  562    H    HIS  75           HN       HIS  75  74.921  -6.492  10.013
  563    HA   HIS  75           HA       HIS  75  77.220  -7.999  10.880
  564    HD1  HIS  75           HD1      HIS  75  76.210 -10.316  11.447
  565    HD2  HIS  75           HD2      HIS  75  77.664 -10.578   7.546
  566    HE1  HIS  75           HE1      HIS  75  77.470 -12.508  11.299
  567    HE2  HIS  75           HE2      HIS  75  78.360 -12.680   8.929
  568    HB2  HIS  75           HB2      HIS  75  75.018  -8.692   9.527
  569    HB3  HIS  75           HB1      HIS  75  76.067  -8.401   8.142
  570    H1U  RCY  76           H1U      RCY  76  78.629  -4.140   1.555
  571    H1S  RCY  76           H1S      RCY  76  80.793  -2.695   5.206
  572    HB1  RCY  76           HB1      RCY  76  78.367  -3.084   8.991
  573    HB2  RCY  76           HB2      RCY  76  77.785  -3.427   7.364
  574    HA   RCY  76           HA       RCY  76  79.042  -5.466   7.252
  575    HN1  RCY  76           HN1      RCY  76  77.270  -5.109   9.513
  576    H    GLU  77           HN       GLU  77  79.760  -3.897  10.396
  577    HA   GLU  77           HA       GLU  77  82.592  -4.206  10.124
  578    HB2  GLU  77           HB2      GLU  77  80.778  -3.677  12.479
  579    HB3  GLU  77           HB1      GLU  77  82.520  -3.856  12.688
  580    HG2  GLU  77           HG2      GLU  77  81.872  -1.480  12.393
  581    HG3  GLU  77           HG1      GLU  77  82.923  -2.038  11.090
  582    H    LEU  78           HN       LEU  78  82.884  -6.426   9.509
  583    HA   LEU  78           HA       LEU  78  83.416  -8.200  11.715
  584    HG   LEU  78           HG       LEU  78  82.768 -10.677  11.242
  585    HB2  LEU  78           HB2      LEU  78  80.874  -8.353  11.476
  586    HB3  LEU  78           HB1      LEU  78  81.161  -9.085   9.898
  587   HD11  LEU  78          HD11      LEU  78  81.871 -11.084  13.547
  588   HD12  LEU  78          HD12      LEU  78  80.884  -9.633  13.377
  589   HD13  LEU  78          HD13      LEU  78  82.643  -9.508  13.373
  590   HD21  LEU  78          HD21      LEU  78  79.741 -10.778  11.258
  591   HD22  LEU  78          HD22      LEU  78  80.741 -12.135  11.777
  592   HD23  LEU  78          HD23      LEU  78  80.840 -11.551  10.115
  593    H    HIS  79           HN       HIS  79  82.704  -7.962   8.247
  594    HA   HIS  79           HA       HIS  79  85.307  -8.989   7.525
  595    HD1  HIS  79           HD1      HIS  79  83.830 -11.552   4.576
  596    HD2  HIS  79           HD2      HIS  79  80.969 -10.362   7.368
  597    HE1  HIS  79           HE1      HIS  79  81.580 -11.766   3.431
  598    HE2  HIS  79           HE2      HIS  79  79.830 -11.045   5.120
  599    HB2  HIS  79           HB2      HIS  79  84.838 -11.157   6.852
  600    HB3  HIS  79           HB1      HIS  79  83.723 -11.034   8.211
  601    H    GLU  80           HN       GLU  80  82.380  -7.485   6.940
  602    HA   GLU  80           HA       GLU  80  82.553  -7.516   4.004
  603    HB2  GLU  80           HB2      GLU  80  80.760  -6.000   5.920
  604    HB3  GLU  80           HB1      GLU  80  80.598  -5.970   4.164
  605    HG2  GLU  80           HG2      GLU  80  80.417  -8.507   4.258
  606    HG3  GLU  80           HG1      GLU  80  80.266  -8.346   6.008
  607    H    LEU  81           HN       LEU  81  83.636  -5.568   6.665
  608    HA   LEU  81           HA       LEU  81  83.915  -3.044   5.429
  609    HG   LEU  81           HG       LEU  81  85.970  -5.550   6.861
  610    HB2  LEU  81           HB2      LEU  81  85.951  -2.812   6.962
  611    HB3  LEU  81           HB1      LEU  81  84.425  -3.195   7.758
  612   HD11  LEU  81          HD11      LEU  81  86.967  -3.781   9.116
  613   HD12  LEU  81          HD12      LEU  81  87.814  -4.098   7.603
  614   HD13  LEU  81          HD13      LEU  81  87.556  -5.404   8.759
  615   HD21  LEU  81          HD21      LEU  81  85.068  -6.498   8.811
  616   HD22  LEU  81          HD22      LEU  81  83.828  -5.333   8.349
  617   HD23  LEU  81          HD23      LEU  81  84.969  -4.942   9.635
  618    H    ALA  82           HN       ALA  82  85.190  -5.961   4.406
  619    HA   ALA  82           HA       ALA  82  87.815  -5.477   3.602
  620    HB1  ALA  82           HB1      ALA  82  86.360  -7.565   3.189
  621    HB2  ALA  82           HB2      ALA  82  87.508  -7.129   1.922
  622    HB3  ALA  82           HB3      ALA  82  85.798  -6.735   1.737
  623    H    GLN  83           HN       GLN  83  88.752  -4.486   1.739
  624    HA   GLN  83           HA       GLN  83  87.869  -1.987   0.961
  625    HB2  GLN  83           HB2      GLN  83  89.125  -3.739  -1.138
  626    HB3  GLN  83           HB1      GLN  83  89.447  -2.046  -0.762
  627    HG2  GLN  83           HG2      GLN  83  91.322  -3.094   0.156
  628    HG3  GLN  83           HG1      GLN  83  90.249  -2.998   1.552
  629   HE21  GLN  83          HE21      GLN  83  90.509  -5.263  -1.259
  630   HE22  GLN  83          HE22      GLN  83  90.492  -6.669  -0.308
  631    H    TYR  84           HN       TYR  84  87.321  -4.948  -0.974
  632    HA   TYR  84           HA       TYR  84  84.594  -4.090  -1.608
  633    HD1  TYR  84           HD2      TYR  84  84.379  -1.568  -2.938
  634    HD2  TYR  84           HD1      TYR  84  88.387  -3.054  -3.356
  635    HE1  TYR  84           HE2      TYR  84  85.264   0.722  -2.587
  636    HE2  TYR  84           HE1      TYR  84  89.273  -0.764  -3.005
  637    HH   TYR  84           HH       TYR  84  87.774   1.867  -3.416
  638    HB2  TYR  84           HB2      TYR  84  86.516  -4.445  -3.916
  639    HB3  TYR  84           HB1      TYR  84  84.877  -3.803  -3.959
  640    H    GLY  85           HN       GLY  85  86.337  -6.400  -0.547
  641    HA2  GLY  85           HA2      GLY  85  86.305  -8.606  -2.294
  642    HA3  GLY  85           HA1      GLY  85  86.151  -8.739  -0.543
  643    H    ILE  86           HN       ILE  86  83.763  -7.698   0.064
  644    HA   ILE  86           HA       ILE  86  81.922  -9.594  -1.223
  645    HB   ILE  86           HB       ILE  86  80.373  -9.095   0.550
  646   HG12  ILE  86          HG12      ILE  86  80.447  -6.704   0.639
  647   HG13  ILE  86          HG11      ILE  86  81.007  -7.259   2.217
  648   HG21  ILE  86          HG21      ILE  86  83.119  -8.925   1.809
  649   HG22  ILE  86          HG22      ILE  86  82.505 -10.404   1.071
  650   HG23  ILE  86          HG23      ILE  86  81.676  -9.702   2.461
  651   HD11  ILE  86          HD11      ILE  86  83.371  -7.086   1.342
  652   HD12  ILE  86          HD12      ILE  86  82.531  -5.541   1.478
  653   HD13  ILE  86          HD13      ILE  86  82.713  -6.309  -0.099
  654    H1U  RCY  87           H1U      RCY  87  81.073  -0.514  -2.002
  655    H1S  RCY  87           H1S      RCY  87  81.371  -4.916  -3.268
  656    HB1  RCY  87           HB1      RCY  87  81.148  -6.345  -6.016
  657    HB2  RCY  87           HB2      RCY  87  82.383  -7.382  -5.308
  658    HA   RCY  87           HA       RCY  87  80.791  -5.715  -3.420
  659    HN1  RCY  87           HN1      RCY  87  82.296  -8.216  -3.287
  Start of MODEL   48
    1    HA   MET   1           HA       MET   1  61.059  -7.158 -19.193
    2    HB2  MET   1           HB2      MET   1  59.050  -9.184 -20.227
    3    HB3  MET   1           HB1      MET   1  59.663  -9.093 -18.576
    4    HG2  MET   1           HG2      MET   1  57.575  -7.951 -18.526
    5    HG3  MET   1           HG1      MET   1  58.797  -6.679 -18.550
    6    HE1  MET   1           HE1      MET   1  55.370  -6.056 -20.771
    7    HE2  MET   1           HE2      MET   1  56.077  -5.725 -19.191
    8    HE3  MET   1           HE3      MET   1  55.551  -7.359 -19.589
    9    H    ASN   2           HN       ASN   2  62.818  -8.412 -18.717
   10    HA   ASN   2           HA       ASN   2  63.544 -10.594 -20.636
   11    HB2  ASN   2           HB2      ASN   2  65.415  -8.582 -19.345
   12    HB3  ASN   2           HB1      ASN   2  65.915  -9.939 -20.355
   13   HD21  ASN   2          HD21      ASN   2  63.367  -7.384 -20.644
   14   HD22  ASN   2          HD22      ASN   2  63.783  -6.951 -22.232
   15    H    LEU   3           HN       LEU   3  66.036 -10.523 -18.634
   16    HA   LEU   3           HA       LEU   3  65.425 -12.841 -17.187
   17    HG   LEU   3           HG       LEU   3  67.667 -13.461 -17.437
   18    HB2  LEU   3           HB2      LEU   3  67.320 -10.558 -16.621
   19    HB3  LEU   3           HB1      LEU   3  67.198 -11.936 -15.526
   20   HD11  LEU   3          HD11      LEU   3  67.824 -10.821 -18.891
   21   HD12  LEU   3          HD12      LEU   3  66.923 -12.269 -19.340
   22   HD13  LEU   3          HD13      LEU   3  68.681 -12.243 -19.485
   23   HD21  LEU   3          HD21      LEU   3  69.741 -11.267 -17.118
   24   HD22  LEU   3          HD22      LEU   3  70.046 -12.934 -17.606
   25   HD23  LEU   3          HD23      LEU   3  69.493 -12.583 -15.969
   26    H    GLU   4           HN       GLU   4  64.176 -13.253 -15.413
   27    HA   GLU   4           HA       GLU   4  62.696 -11.004 -14.215
   28    HB2  GLU   4           HB2      GLU   4  61.420 -12.805 -13.061
   29    HB3  GLU   4           HB1      GLU   4  61.451 -13.022 -14.809
   30    HG2  GLU   4           HG2      GLU   4  62.195 -15.119 -14.381
   31    HG3  GLU   4           HG1      GLU   4  63.735 -14.358 -13.980
   32    HA   PRO   5           HA       PRO   5  65.096 -10.227 -10.595
   33    HB2  PRO   5           HB2      PRO   5  62.629 -11.096  -9.121
   34    HB3  PRO   5           HB1      PRO   5  63.656  -9.674  -8.851
   35    HG2  PRO   5           HG2      PRO   5  61.316  -9.527 -10.156
   36    HG3  PRO   5           HG1      PRO   5  62.694  -8.488 -10.552
   37    HD2  PRO   5           HD2      PRO   5  61.522 -10.685 -12.127
   38    HD3  PRO   5           HD1      PRO   5  62.618  -9.388 -12.650
   39    HA   PRO   6           HA       PRO   6  66.267 -14.482  -9.614
   40    HB2  PRO   6           HB2      PRO   6  68.594 -13.947  -8.323
   41    HB3  PRO   6           HB1      PRO   6  68.435 -13.808 -10.086
   42    HG2  PRO   6           HG2      PRO   6  68.408 -11.667  -8.019
   43    HG3  PRO   6           HG1      PRO   6  69.148 -11.675  -9.628
   44    HD2  PRO   6           HD2      PRO   6  66.732 -10.459  -9.051
   45    HD3  PRO   6           HD1      PRO   6  67.197 -11.028 -10.669
   46    H    LYS   7           HN       LYS   7  65.583 -15.719  -7.904
   47    HA   LYS   7           HA       LYS   7  64.703 -16.208  -5.780
   48    HB2  LYS   7           HB2      LYS   7  67.401 -15.302  -5.553
   49    HB3  LYS   7           HB1      LYS   7  66.516 -14.640  -4.180
   50    HG2  LYS   7           HG2      LYS   7  65.705 -16.859  -3.576
   51    HG3  LYS   7           HG1      LYS   7  66.455 -17.557  -5.012
   52    HD2  LYS   7           HD2      LYS   7  67.986 -16.128  -2.820
   53    HD3  LYS   7           HD1      LYS   7  67.814 -17.880  -2.927
   54    HE2  LYS   7           HE2      LYS   7  68.679 -17.451  -5.412
   55    HE3  LYS   7           HE1      LYS   7  69.384 -16.019  -4.661
   56    HZ1  LYS   7           HZ1      LYS   7  71.015 -17.583  -4.342
   57    HZ2  LYS   7           HZ2      LYS   7  69.916 -18.858  -4.111
   58    HZ3  LYS   7           HZ3      LYS   7  70.158 -17.709  -2.883
   59    H    ALA   8           HN       ALA   8  64.599 -14.688  -3.423
   60    HA   ALA   8           HA       ALA   8  63.212 -13.073  -2.428
   61    HB1  ALA   8           HB1      ALA   8  65.062 -11.653  -3.480
   62    HB2  ALA   8           HB2      ALA   8  63.536 -10.824  -3.172
   63    HB3  ALA   8           HB3      ALA   8  63.940 -11.349  -4.806
   64    H    GLU   9           HN       GLU   9  61.490 -14.676  -3.298
   65    HA   GLU   9           HA       GLU   9  59.839 -13.491  -5.469
   66    HB2  GLU   9           HB2      GLU   9  60.420 -15.996  -5.321
   67    HB3  GLU   9           HB1      GLU   9  59.276 -16.060  -3.980
   68    HG2  GLU   9           HG2      GLU   9  58.024 -16.624  -5.938
   69    HG3  GLU   9           HG1      GLU   9  57.583 -14.963  -5.542
   70    H1U  RCY  10           H1U      RCY  10  56.830  -7.812   0.230
   71    H1S  RCY  10           H1S      RCY  10  54.961 -11.343  -0.916
   72    HB1  RCY  10           HB1      RCY  10  58.138 -12.141  -0.015
   73    HB2  RCY  10           HB2      RCY  10  58.516 -13.539  -1.019
   74    HA   RCY  10           HA       RCY  10  57.033 -11.701  -2.627
   75    HN1  RCY  10           HN1      RCY  10  59.797 -11.851  -3.302
   76    H    ARG  11           HN       ARG  11  56.758  -9.548  -2.316
   77    HA   ARG  11           HA       ARG  11  58.523  -8.040  -0.542
   78    HE   ARG  11           HE       ARG  11  58.398  -5.258  -4.032
   79    HB2  ARG  11           HB2      ARG  11  58.975  -6.345  -2.473
   80    HB3  ARG  11           HB1      ARG  11  59.969  -7.799  -2.383
   81    HG2  ARG  11           HG2      ARG  11  58.719  -8.880  -4.106
   82    HG3  ARG  11           HG1      ARG  11  57.438  -7.670  -4.032
   83    HD2  ARG  11           HD2      ARG  11  60.296  -7.088  -4.858
   84    HD3  ARG  11           HD1      ARG  11  58.964  -7.345  -5.985
   85   HH11  ARG  11          HH21      ARG  11  59.912  -6.092  -7.015
   86   HH12  ARG  11          HH22      ARG  11  59.824  -4.487  -7.662
   87   HH21  ARG  11          HH11      ARG  11  58.274  -3.158  -4.859
   88   HH22  ARG  11          HH12      ARG  11  58.897  -2.826  -6.441
   89    H    SER  12           HN       SER  12  55.938  -8.352  -0.065
   90    HA   SER  12           HA       SER  12  54.332  -6.263  -1.375
   91    HG   SER  12           HG       SER  12  52.315  -8.999  -0.730
   92    HB2  SER  12           HB2      SER  12  53.779  -8.238   0.848
   93    HB3  SER  12           HB1      SER  12  52.619  -7.000   0.376
   94    H    ALA  13           HN       ALA  13  55.973  -6.798   1.714
   95    HA   ALA  13           HA       ALA  13  55.829  -3.892   2.240
   96    HB1  ALA  13           HB1      ALA  13  54.844  -4.094   4.406
   97    HB2  ALA  13           HB2      ALA  13  54.978  -5.852   4.381
   98    HB3  ALA  13           HB3      ALA  13  53.817  -5.042   3.331
   99    H    THR  14           HN       THR  14  56.906  -3.874   4.790
  100    HA   THR  14           HA       THR  14  59.103  -5.757   5.039
  101    HB   THR  14           HB       THR  14  59.815  -2.915   4.250
  102    HG1  THR  14           HG1      THR  14  58.975  -4.122   2.503
  103   HG21  THR  14          HG21      THR  14  62.055  -4.328   3.891
  104   HG22  THR  14          HG22      THR  14  61.318  -5.336   5.136
  105   HG23  THR  14          HG23      THR  14  61.641  -3.633   5.458
  106    H    ARG  15           HN       ARG  15  56.956  -4.562   6.677
  107    HA   ARG  15           HA       ARG  15  56.699  -3.791   8.879
  108    HE   ARG  15           HE       ARG  15  55.493  -5.313   9.572
  109    HB2  ARG  15           HB2      ARG  15  59.694  -4.097   9.126
  110    HB3  ARG  15           HB1      ARG  15  58.498  -4.154  10.417
  111    HG2  ARG  15           HG2      ARG  15  58.416  -6.118   8.127
  112    HG3  ARG  15           HG1      ARG  15  59.419  -6.411   9.549
  113    HD2  ARG  15           HD2      ARG  15  57.353  -7.481  10.033
  114    HD3  ARG  15           HD1      ARG  15  57.300  -5.965  10.932
  115   HH11  ARG  15          HH21      ARG  15  57.372  -7.803   8.105
  116   HH12  ARG  15          HH22      ARG  15  56.306  -7.994   6.753
  117   HH21  ARG  15          HH11      ARG  15  54.090  -5.548   7.816
  118   HH22  ARG  15          HH12      ARG  15  54.448  -6.717   6.589
  119    H    VAL  16           HN       VAL  16  58.936  -2.327  10.240
  120    HA   VAL  16           HA       VAL  16  59.480  -0.093  10.578
  121    HB   VAL  16           HB       VAL  16  60.851   0.627   8.927
  122   HG11  VAL  16          HG11      VAL  16  59.764  -1.381   6.981
  123   HG12  VAL  16          HG12      VAL  16  60.530  -1.957   8.462
  124   HG13  VAL  16          HG13      VAL  16  61.441  -0.958   7.330
  125   HG21  VAL  16          HG21      VAL  16  59.045   1.981   8.000
  126   HG22  VAL  16          HG22      VAL  16  58.393   0.582   7.147
  127   HG23  VAL  16          HG23      VAL  16  59.952   1.256   6.673
  128    H    MET  17           HN       MET  17  58.563   2.073  10.524
  129    HA   MET  17           HA       MET  17  56.190   2.695   9.021
  130    HB2  MET  17           HB2      MET  17  55.611   0.919  10.999
  131    HB3  MET  17           HB1      MET  17  55.435   2.430  11.888
  132    HG2  MET  17           HG2      MET  17  54.068   1.774   9.261
  133    HG3  MET  17           HG1      MET  17  53.296   1.752  10.847
  134    HE1  MET  17           HE1      MET  17  51.676   2.965   9.516
  135    HE2  MET  17           HE2      MET  17  51.587   4.721   9.405
  136    HE3  MET  17           HE3      MET  17  51.520   3.940  10.983
  137    H    GLY  18           HN       GLY  18  58.691   3.947   9.766
  138    HA2  GLY  18           HA2      GLY  18  58.302   5.878  11.863
  139    HA3  GLY  18           HA1      GLY  18  59.501   6.000  10.574
  140    H    GLY  19           HN       GLY  19  55.969   6.316  11.058
  141    HA2  GLY  19           HA2      GLY  19  54.431   7.742   9.995
  142    HA3  GLY  19           HA1      GLY  19  55.717   8.943  10.126
  143    HA   PRO  20           HA       PRO  20  54.655   8.027   5.596
  144    HB2  PRO  20           HB2      PRO  20  55.022  10.988   5.560
  145    HB3  PRO  20           HB1      PRO  20  53.775   9.996   4.780
  146    HG2  PRO  20           HG2      PRO  20  53.249  11.457   6.946
  147    HG3  PRO  20           HG1      PRO  20  52.492   9.877   6.680
  148    HD2  PRO  20           HD2      PRO  20  54.689  10.617   8.570
  149    HD3  PRO  20           HD1      PRO  20  53.409   9.396   8.748
  150    H1U  RCY  21           H1U      RCY  21  65.091   7.756   2.758
  151    H1S  RCY  21           H1S      RCY  21  61.209   9.316   2.236
  152    HB1  RCY  21           HB1      RCY  21  58.609   9.946   1.868
  153    HB2  RCY  21           HB2      RCY  21  57.339   8.808   2.317
  154    HA   RCY  21           HA       RCY  21  58.896   9.388   4.656
  155    HN1  RCY  21           HN1      RCY  21  56.064  10.138   4.034
  156    H    THR  22           HN       THR  22  59.608  11.307   5.541
  157    HA   THR  22           HA       THR  22  59.472  13.709   3.779
  158    HB   THR  22           HB       THR  22  59.178  15.083   5.898
  159    HG1  THR  22           HG1      THR  22  58.436  12.537   6.901
  160   HG21  THR  22          HG21      THR  22  57.290  14.876   4.460
  161   HG22  THR  22          HG22      THR  22  56.698  14.476   6.072
  162   HG23  THR  22          HG23      THR  22  57.038  13.191   4.913
  163    HA   PRO  23           HA       PRO  23  63.927  13.114   4.471
  164    HB2  PRO  23           HB2      PRO  23  63.807  15.968   3.544
  165    HB3  PRO  23           HB1      PRO  23  64.912  14.669   3.048
  166    HG2  PRO  23           HG2      PRO  23  62.858  15.405   1.521
  167    HG3  PRO  23           HG1      PRO  23  63.359  13.710   1.643
  168    HD2  PRO  23           HD2      PRO  23  60.947  15.036   2.771
  169    HD3  PRO  23           HD1      PRO  23  61.198  13.332   2.334
  170    H    ARG  24           HN       ARG  24  64.692  13.243   6.544
  171    HA   ARG  24           HA       ARG  24  63.748  15.314   8.371
  172    HE   ARG  24           HE       ARG  24  63.300  14.532  11.159
  173    HB2  ARG  24           HB2      ARG  24  65.862  13.164   8.702
  174    HB3  ARG  24           HB1      ARG  24  65.283  14.211   9.997
  175    HG2  ARG  24           HG2      ARG  24  62.920  13.273   8.979
  176    HG3  ARG  24           HG1      ARG  24  63.975  11.880   8.738
  177    HD2  ARG  24           HD2      ARG  24  63.068  11.612  10.926
  178    HD3  ARG  24           HD1      ARG  24  64.711  12.204  11.169
  179   HH11  ARG  24          HH21      ARG  24  62.817  11.473  12.676
  180   HH12  ARG  24          HH22      ARG  24  61.997  12.135  14.050
  181   HH21  ARG  24          HH11      ARG  24  62.231  15.413  12.945
  182   HH22  ARG  24          HH12      ARG  24  61.665  14.366  14.203
  183    H    LYS  25           HN       LYS  25  67.166  14.416   8.236
  184    HA   LYS  25           HA       LYS  25  67.987  17.130   8.599
  185    HB2  LYS  25           HB2      LYS  25  70.193  16.347   8.552
  186    HB3  LYS  25           HB1      LYS  25  69.297  14.929   9.083
  187    HG2  LYS  25           HG2      LYS  25  69.985  15.473   6.180
  188    HG3  LYS  25           HG1      LYS  25  70.974  14.469   7.240
  189    HD2  LYS  25           HD2      LYS  25  68.805  13.155   7.716
  190    HD3  LYS  25           HD1      LYS  25  68.148  13.977   6.300
  191    HE2  LYS  25           HE2      LYS  25  69.146  11.754   5.747
  192    HE3  LYS  25           HE1      LYS  25  69.932  13.086   4.900
  193    HZ1  LYS  25           HZ1      LYS  25  71.148  11.210   6.490
  194    HZ2  LYS  25           HZ2      LYS  25  71.123  12.619   7.440
  195    HZ3  LYS  25           HZ3      LYS  25  71.844  12.641   5.902
  196    H    GLY  26           HN       GLY  26  68.870  18.612   7.127
  197    HA2  GLY  26           HA2      GLY  26  68.779  17.951   4.243
  198    HA3  GLY  26           HA1      GLY  26  67.749  19.269   4.802
  199    HA   PRO  27           HA       PRO  27  70.943  22.309   5.140
  200    HB2  PRO  27           HB2      PRO  27  71.517  21.770   8.029
  201    HB3  PRO  27           HB1      PRO  27  71.111  23.300   7.227
  202    HG2  PRO  27           HG2      PRO  27  69.338  21.995   8.719
  203    HG3  PRO  27           HG1      PRO  27  68.859  22.873   7.257
  204    HD2  PRO  27           HD2      PRO  27  69.098  19.927   7.689
  205    HD3  PRO  27           HD1      PRO  27  67.997  20.827   6.622
  206    HA   PRO  28           HA       PRO  28  75.100  20.859   4.687
  207    HB2  PRO  28           HB2      PRO  28  75.921  22.038   7.326
  208    HB3  PRO  28           HB1      PRO  28  76.731  22.138   5.748
  209    HG2  PRO  28           HG2      PRO  28  75.303  24.169   6.692
  210    HG3  PRO  28           HG1      PRO  28  75.284  23.759   4.968
  211    HD2  PRO  28           HD2      PRO  28  73.159  23.352   7.018
  212    HD3  PRO  28           HD1      PRO  28  73.005  23.578   5.261
  213    H    LYS  29           HN       LYS  29  75.760  18.782   4.956
  214    HA   LYS  29           HA       LYS  29  76.484  17.510   7.354
  215    HB2  LYS  29           HB2      LYS  29  73.618  17.718   7.058
  216    HB3  LYS  29           HB1      LYS  29  74.078  16.024   6.929
  217    HG2  LYS  29           HG2      LYS  29  75.156  17.789   9.131
  218    HG3  LYS  29           HG1      LYS  29  73.624  16.931   9.298
  219    HD2  LYS  29           HD2      LYS  29  74.827  14.798   8.744
  220    HD3  LYS  29           HD1      LYS  29  76.344  15.699   8.778
  221    HE2  LYS  29           HE2      LYS  29  76.107  14.734  10.953
  222    HE3  LYS  29           HE1      LYS  29  75.699  16.440  11.133
  223    HZ1  LYS  29           HZ1      LYS  29  73.532  15.984  11.489
  224    HZ2  LYS  29           HZ2      LYS  29  74.153  14.496  12.025
  225    HZ3  LYS  29           HZ3      LYS  29  73.515  14.637  10.457
  226    H1U  RCY  30           H1U      RCY  30  73.786   8.358   2.502
  227    H1S  RCY  30           H1S      RCY  30  74.904  10.953   5.787
  228    HB1  RCY  30           HB1      RCY  30  76.429  12.637   4.086
  229    HB2  RCY  30           HB2      RCY  30  75.587  14.159   3.812
  230    HA   RCY  30           HA       RCY  30  78.015  13.651   5.536
  231    HN1  RCY  30           HN1      RCY  30  77.238  15.382   6.916
  232    H    LYS  31           HN       LYS  31  77.734  16.798   4.547
  233    HA   LYS  31           HA       LYS  31  78.372  17.948   2.554
  234    HB2  LYS  31           HB2      LYS  31  80.831  16.241   2.927
  235    HB3  LYS  31           HB1      LYS  31  80.733  17.939   2.455
  236    HG2  LYS  31           HG2      LYS  31  79.901  18.534   4.684
  237    HG3  LYS  31           HG1      LYS  31  79.935  16.837   5.165
  238    HD2  LYS  31           HD2      LYS  31  82.023  17.322   5.925
  239    HD3  LYS  31           HD1      LYS  31  82.486  17.180   4.229
  240    HE2  LYS  31           HE2      LYS  31  83.348  19.284   4.866
  241    HE3  LYS  31           HE1      LYS  31  81.834  19.682   4.055
  242    HZ1  LYS  31           HZ1      LYS  31  82.430  20.631   6.423
  243    HZ2  LYS  31           HZ2      LYS  31  81.737  19.164   6.928
  244    HZ3  LYS  31           HZ3      LYS  31  80.833  20.255   5.991
  245    H    GLN  32           HN       GLN  32  80.538  16.708   0.826
  246    HA   GLN  32           HA       GLN  32  79.505  14.377  -0.463
  247    HB2  GLN  32           HB2      GLN  32  77.956  16.648  -0.996
  248    HB3  GLN  32           HB1      GLN  32  79.006  16.518  -2.404
  249    HG2  GLN  32           HG2      GLN  32  78.318  14.209  -2.764
  250    HG3  GLN  32           HG1      GLN  32  77.364  14.228  -1.280
  251   HE21  GLN  32          HE21      GLN  32  75.722  16.254  -1.284
  252   HE22  GLN  32          HE22      GLN  32  74.859  16.456  -2.731
  253    H    ARG  33           HN       ARG  33  80.519  14.227  -2.779
  254    HA   ARG  33           HA       ARG  33  83.047  15.804  -2.937
  255    HE   ARG  33           HE       ARG  33  86.964  14.269  -0.852
  256    HB2  ARG  33           HB2      ARG  33  82.757  12.793  -2.924
  257    HB3  ARG  33           HB1      ARG  33  84.168  13.592  -3.616
  258    HG2  ARG  33           HG2      ARG  33  83.195  14.084  -0.789
  259    HG3  ARG  33           HG1      ARG  33  84.443  12.905  -1.197
  260    HD2  ARG  33           HD2      ARG  33  85.449  15.029  -2.498
  261    HD3  ARG  33           HD1      ARG  33  84.564  15.882  -1.233
  262   HH11  ARG  33          HH21      ARG  33  84.045  15.494   0.514
  263   HH12  ARG  33          HH22      ARG  33  84.621  15.420   2.146
  264   HH21  ARG  33          HH11      ARG  33  87.732  14.164   1.272
  265   HH22  ARG  33          HH12      ARG  33  86.708  14.667   2.575
  266    H    GLN  34           HN       GLN  34  81.374  16.729  -4.583
  267    HA   GLN  34           HA       GLN  34  80.787  15.183  -6.949
  268    HB2  GLN  34           HB2      GLN  34  79.673  17.377  -6.053
  269    HB3  GLN  34           HB1      GLN  34  80.963  18.191  -6.938
  270    HG2  GLN  34           HG2      GLN  34  79.124  18.026  -8.460
  271    HG3  GLN  34           HG1      GLN  34  80.282  16.793  -8.960
  272   HE21  GLN  34          HE21      GLN  34  78.866  15.177  -9.760
  273   HE22  GLN  34          HE22      GLN  34  77.655  14.442  -8.824
  274    H    THR  35           HN       THR  35  83.701  15.624  -5.931
  275    HA   THR  35           HA       THR  35  84.843  16.639  -8.506
  276    HB   THR  35           HB       THR  35  85.559  17.781  -6.380
  277    HG1  THR  35           HG1      THR  35  86.980  16.961  -8.385
  278   HG21  THR  35          HG21      THR  35  86.785  16.635  -4.723
  279   HG22  THR  35          HG22      THR  35  87.073  15.246  -5.772
  280   HG23  THR  35          HG23      THR  35  85.465  15.530  -5.105
  281    H    ARG  36           HN       ARG  36  85.222  14.060  -6.063
  282    HA   ARG  36           HA       ARG  36  86.752  12.460  -8.045
  283    HE   ARG  36           HE       ARG  36  87.509  10.545  -3.290
  284    HB2  ARG  36           HB2      ARG  36  87.483  12.761  -5.593
  285    HB3  ARG  36           HB1      ARG  36  86.146  11.684  -5.189
  286    HG2  ARG  36           HG2      ARG  36  87.070   9.920  -6.572
  287    HG3  ARG  36           HG1      ARG  36  88.329  10.998  -7.176
  288    HD2  ARG  36           HD2      ARG  36  89.275   9.589  -5.431
  289    HD3  ARG  36           HD1      ARG  36  89.173  11.246  -4.834
  290   HH11  ARG  36          HH21      ARG  36  88.227   8.164  -5.678
  291   HH12  ARG  36          HH22      ARG  36  87.335   6.909  -4.886
  292   HH21  ARG  36          HH11      ARG  36  86.341   8.919  -2.242
  293   HH22  ARG  36          HH12      ARG  36  86.267   7.336  -2.940
  294    H    GLN  37           HN       GLN  37  83.882  12.230  -5.960
  295    HA   GLN  37           HA       GLN  37  82.052  10.747  -6.053
  296    HB2  GLN  37           HB2      GLN  37  82.621  11.162  -9.004
  297    HB3  GLN  37           HB1      GLN  37  81.137  10.462  -8.358
  298    HG2  GLN  37           HG2      GLN  37  80.626  12.512  -7.160
  299    HG3  GLN  37           HG1      GLN  37  82.176  13.214  -7.627
  300   HE21  GLN  37          HE21      GLN  37  82.486  13.714  -9.967
  301   HE22  GLN  37          HE22      GLN  37  81.134  13.962 -10.963
  302    H1U  RCY  38           H1U      RCY  38  83.969   1.375  -1.526
  303    H1S  RCY  38           H1S      RCY  38  85.779   3.722  -4.975
  304    HB1  RCY  38           HB1      RCY  38  83.086   6.724  -6.392
  305    HB2  RCY  38           HB2      RCY  38  84.284   6.805  -5.102
  306    HA   RCY  38           HA       RCY  38  85.986   7.568  -6.644
  307    HN1  RCY  38           HN1      RCY  38  85.010   9.690  -6.492
  308    H    LYS  39           HN       LYS  39  83.256   8.239  -8.785
  309    HA   LYS  39           HA       LYS  39  82.847   7.549 -10.998
  310    HB2  LYS  39           HB2      LYS  39  85.847   7.961 -10.937
  311    HB3  LYS  39           HB1      LYS  39  84.946   7.678 -12.424
  312    HG2  LYS  39           HG2      LYS  39  83.613   9.718 -10.890
  313    HG3  LYS  39           HG1      LYS  39  85.313  10.150 -11.077
  314    HD2  LYS  39           HD2      LYS  39  84.222  11.040 -13.000
  315    HD3  LYS  39           HD1      LYS  39  85.033   9.576 -13.557
  316    HE2  LYS  39           HE2      LYS  39  82.881   8.327 -13.198
  317    HE3  LYS  39           HE1      LYS  39  82.102   9.869 -12.842
  318    HZ1  LYS  39           HZ1      LYS  39  83.661   9.672 -15.305
  319    HZ2  LYS  39           HZ2      LYS  39  82.241  10.547 -14.986
  320    HZ3  LYS  39           HZ3      LYS  39  82.165   8.873 -15.264
  321    H    SER  40           HN       SER  40  85.618   6.098 -12.003
  322    HA   SER  40           HA       SER  40  84.551   3.538 -12.377
  323    HG   SER  40           HG       SER  40  86.093   5.438 -13.425
  324    HB2  SER  40           HB2      SER  40  87.483   4.036 -11.837
  325    HB3  SER  40           HB1      SER  40  86.770   2.806 -12.875
  326    H    LYS  41           HN       LYS  41  85.826   1.519 -11.288
  327    HA   LYS  41           HA       LYS  41  86.050   1.917  -8.365
  328    HB2  LYS  41           HB2      LYS  41  84.567  -0.368  -8.359
  329    HB3  LYS  41           HB1      LYS  41  83.875   1.237  -8.137
  330    HG2  LYS  41           HG2      LYS  41  82.610   0.064  -9.859
  331    HG3  LYS  41           HG1      LYS  41  83.518   1.377 -10.610
  332    HD2  LYS  41           HD2      LYS  41  85.160  -0.113 -11.475
  333    HD3  LYS  41           HD1      LYS  41  84.609  -1.437 -10.447
  334    HE2  LYS  41           HE2      LYS  41  82.921  -0.163 -12.618
  335    HE3  LYS  41           HE1      LYS  41  83.854  -1.644 -12.834
  336    HZ1  LYS  41           HZ1      LYS  41  82.601  -2.688 -11.089
  337    HZ2  LYS  41           HZ2      LYS  41  81.523  -2.060 -12.242
  338    HZ3  LYS  41           HZ3      LYS  41  81.759  -1.251 -10.767
  339    HA   PRO  42           HA       PRO  42  89.222  -1.114  -8.885
  340    HB2  PRO  42           HB2      PRO  42  89.383  -2.172  -6.383
  341    HB3  PRO  42           HB1      PRO  42  89.885  -0.509  -6.747
  342    HG2  PRO  42           HG2      PRO  42  87.362  -1.487  -5.506
  343    HG3  PRO  42           HG1      PRO  42  88.349  -0.074  -5.097
  344    HD2  PRO  42           HD2      PRO  42  86.042   0.068  -6.595
  345    HD3  PRO  42           HD1      PRO  42  87.369   1.244  -6.718
  346    HA   PRO  43           HA       PRO  43  87.620  -5.148  -9.765
  347    HB2  PRO  43           HB2      PRO  43  89.719  -6.758  -8.894
  348    HB3  PRO  43           HB1      PRO  43  89.666  -5.918 -10.455
  349    HG2  PRO  43           HG2      PRO  43  91.065  -5.158  -7.948
  350    HG3  PRO  43           HG1      PRO  43  91.573  -4.961  -9.633
  351    HD2  PRO  43           HD2      PRO  43  90.617  -2.882  -8.167
  352    HD3  PRO  43           HD1      PRO  43  90.343  -3.006  -9.920
  353    H    LYS  44           HN       LYS  44  87.053  -7.284  -8.706
  354    HA   LYS  44           HA       LYS  44  85.655  -7.008  -6.319
  355    HB2  LYS  44           HB2      LYS  44  85.834  -9.509  -6.117
  356    HB3  LYS  44           HB1      LYS  44  85.346  -8.959  -7.719
  357    HG2  LYS  44           HG2      LYS  44  87.578  -9.260  -8.584
  358    HG3  LYS  44           HG1      LYS  44  88.216  -9.575  -6.970
  359    HD2  LYS  44           HD2      LYS  44  86.598 -11.555  -6.873
  360    HD3  LYS  44           HD1      LYS  44  86.361 -11.316  -8.605
  361    HE2  LYS  44           HE2      LYS  44  88.100 -12.932  -8.437
  362    HE3  LYS  44           HE1      LYS  44  88.917 -11.414  -8.810
  363    HZ1  LYS  44           HZ1      LYS  44  88.555 -11.761  -6.005
  364    HZ2  LYS  44           HZ2      LYS  44  89.980 -11.463  -6.881
  365    HZ3  LYS  44           HZ3      LYS  44  89.422 -13.055  -6.677
  366    H    LYS  45           HN       LYS  45  87.200  -9.490  -5.098
  367    HA   LYS  45           HA       LYS  45  88.771  -9.815  -3.387
  368    HB2  LYS  45           HB2      LYS  45  90.246  -8.569  -5.147
  369    HB3  LYS  45           HB1      LYS  45  90.046  -7.174  -4.088
  370    HG2  LYS  45           HG2      LYS  45  90.860  -8.591  -2.177
  371    HG3  LYS  45           HG1      LYS  45  91.215  -9.868  -3.341
  372    HD2  LYS  45           HD2      LYS  45  92.294  -7.117  -3.843
  373    HD3  LYS  45           HD1      LYS  45  93.094  -8.139  -2.648
  374    HE2  LYS  45           HE2      LYS  45  92.422  -9.282  -5.341
  375    HE3  LYS  45           HE1      LYS  45  93.842  -8.251  -5.171
  376    HZ1  LYS  45           HZ1      LYS  45  94.786  -9.696  -3.612
  377    HZ2  LYS  45           HZ2      LYS  45  94.178 -10.716  -4.827
  378    HZ3  LYS  45           HZ3      LYS  45  93.333 -10.537  -3.364
  379    H    GLY  46           HN       GLY  46  87.893  -6.353  -3.672
  380    HA2  GLY  46           HA2      GLY  46  87.164  -4.843  -2.033
  381    HA3  GLY  46           HA1      GLY  46  86.337  -6.234  -1.331
  382    H    VAL  47           HN       VAL  47  89.844  -5.832  -1.720
  383    HA   VAL  47           HA       VAL  47  90.540  -6.800   0.811
  384    HB   VAL  47           HB       VAL  47  92.110  -6.284  -1.107
  385   HG11  VAL  47          HG11      VAL  47  92.280  -3.507   0.037
  386   HG12  VAL  47          HG12      VAL  47  91.102  -3.869  -1.225
  387   HG13  VAL  47          HG13      VAL  47  92.823  -4.094  -1.535
  388   HG21  VAL  47          HG21      VAL  47  93.989  -5.670   0.376
  389   HG22  VAL  47          HG22      VAL  47  92.937  -6.854   1.153
  390   HG23  VAL  47          HG23      VAL  47  92.844  -5.154   1.614
  391    H    GLN  48           HN       GLN  48  90.013  -6.039   2.795
  392    HA   GLN  48           HA       GLN  48  88.750  -3.529   3.252
  393    HB2  GLN  48           HB2      GLN  48  89.188  -3.984   5.660
  394    HB3  GLN  48           HB1      GLN  48  88.518  -5.385   4.826
  395    HG2  GLN  48           HG2      GLN  48  90.277  -6.523   5.701
  396    HG3  GLN  48           HG1      GLN  48  91.232  -5.725   4.451
  397   HE21  GLN  48          HE21      GLN  48  93.158  -5.245   5.587
  398   HE22  GLN  48          HE22      GLN  48  93.211  -4.317   7.008
  399    H    GLY  49           HN       GLY  49  89.852  -1.702   2.616
  400    HA2  GLY  49           HA2      GLY  49  92.712  -1.413   3.323
  401    HA3  GLY  49           HA1      GLY  49  91.788  -0.315   2.296
  402    H1U  RCY  50           H1U      RCY  50  84.971  -2.281   2.669
  403    H1S  RCY  50           H1S      RCY  50  88.054   0.749   2.833
  404    HB1  RCY  50           HB1      RCY  50  89.082   2.055   6.966
  405    HB2  RCY  50           HB2      RCY  50  88.280   0.556   6.496
  406    HA   RCY  50           HA       RCY  50  91.233   1.140   6.665
  407    HN1  RCY  50           HN1      RCY  50  90.282  -1.291   5.242
  408    H    GLY  51           HN       GLY  51  88.793  -1.471   6.947
  409    HA2  GLY  51           HA2      GLY  51  89.123  -3.295   8.585
  410    HA3  GLY  51           HA1      GLY  51  89.972  -2.139   9.614
  411    H    ASP  52           HN       ASP  52  86.861  -3.348   8.660
  412    HA   ASP  52           HA       ASP  52  85.424  -1.233  10.141
  413    HB2  ASP  52           HB2      ASP  52  83.407  -2.684   9.484
  414    HB3  ASP  52           HB1      ASP  52  84.295  -1.916   8.167
  415    H    ASP  53           HN       ASP  53  83.660  -2.065  11.674
  416    HA   ASP  53           HA       ASP  53  83.686  -4.493  13.046
  417    HB2  ASP  53           HB2      ASP  53  85.036  -3.580  15.139
  418    HB3  ASP  53           HB1      ASP  53  85.889  -4.370  13.815
  419    H    ILE  54           HN       ILE  54  84.106  -1.165  14.272
  420    HA   ILE  54           HA       ILE  54  81.241  -1.204  15.139
  421    HB   ILE  54           HB       ILE  54  82.340   0.415  17.000
  422   HG12  ILE  54          HG12      ILE  54  84.448  -1.722  16.625
  423   HG13  ILE  54          HG11      ILE  54  84.624  -0.107  15.936
  424   HG21  ILE  54          HG21      ILE  54  80.920  -1.529  17.466
  425   HG22  ILE  54          HG22      ILE  54  82.340  -1.560  18.511
  426   HG23  ILE  54          HG23      ILE  54  82.259  -2.616  17.100
  427   HD11  ILE  54          HD11      ILE  54  85.714  -0.294  18.164
  428   HD12  ILE  54          HD12      ILE  54  84.149  -0.693  18.874
  429   HD13  ILE  54          HD13      ILE  54  84.413   0.897  18.159
  430    HA   PRO  55           HA       PRO  55  82.181   2.531  12.571
  431    HB2  PRO  55           HB2      PRO  55  80.072   2.311  10.867
  432    HB3  PRO  55           HB1      PRO  55  81.591   1.425  10.632
  433    HG2  PRO  55           HG2      PRO  55  78.988   0.467  11.686
  434    HG3  PRO  55           HG1      PRO  55  80.179  -0.371  10.680
  435    HD2  PRO  55           HD2      PRO  55  79.891  -0.728  13.428
  436    HD3  PRO  55           HD1      PRO  55  81.348  -1.137  12.498
  437    H    GLY  56           HN       GLY  56  78.682   2.063  12.432
  438    HA2  GLY  56           HA2      GLY  56  78.247   4.702  13.588
  439    HA3  GLY  56           HA1      GLY  56  76.988   3.578  13.078
  440    H    MET  57           HN       MET  57  78.059   1.377  14.727
  441    HA   MET  57           HA       MET  57  77.498   0.500  16.833
  442    HB2  MET  57           HB2      MET  57  78.432   2.851  18.334
  443    HB3  MET  57           HB1      MET  57  79.028   1.195  18.362
  444    HG2  MET  57           HG2      MET  57  80.856   2.148  17.353
  445    HG3  MET  57           HG1      MET  57  79.879   1.933  15.901
  446    HE1  MET  57           HE1      MET  57  82.130   3.701  15.863
  447    HE2  MET  57           HE2      MET  57  82.139   4.386  17.486
  448    HE3  MET  57           HE3      MET  57  81.912   5.441  16.093
  449    H    GLU  58           HN       GLU  58  75.715   2.801  15.545
  450    HA   GLU  58           HA       GLU  58  73.536   2.587  17.324
  451    HB2  GLU  58           HB2      GLU  58  75.542   4.457  18.232
  452    HB3  GLU  58           HB1      GLU  58  74.081   5.346  17.813
  453    HG2  GLU  58           HG2      GLU  58  72.741   4.021  19.299
  454    HG3  GLU  58           HG1      GLU  58  74.048   2.862  19.544
  455    H    GLY  59           HN       GLY  59  75.257   4.645  15.025
  456    HA2  GLY  59           HA2      GLY  59  73.070   6.201  14.110
  457    HA3  GLY  59           HA1      GLY  59  74.479   5.791  13.132
  458    H1U  RCY  60           H1U      RCY  60  76.718  -1.027   6.123
  459    H1S  RCY  60           H1S      RCY  60  76.842   1.509   9.746
  460    HB1  RCY  60           HB1      RCY  60  73.233   1.246  10.085
  461    HB2  RCY  60           HB2      RCY  60  73.480   0.344  11.580
  462    HA   RCY  60           HA       RCY  60  71.959   2.802  11.128
  463    HN1  RCY  60           HN1      RCY  60  74.231   3.012  12.992
  464    H    GLY  61           HN       GLY  61  73.175   0.491  13.561
  465    HA2  GLY  61           HA2      GLY  61  71.362   0.234  15.478
  466    HA3  GLY  61           HA1      GLY  61  70.362  -0.287  14.120
  467    H    THR  62           HN       THR  62  73.795  -0.951  14.227
  468    HA   THR  62           HA       THR  62  74.957  -2.983  14.272
  469    HB   THR  62           HB       THR  62  74.478  -4.425  16.064
  470    HG1  THR  62           HG1      THR  62  71.800  -3.537  16.111
  471   HG21  THR  62          HG21      THR  62  74.729  -1.939  16.673
  472   HG22  THR  62          HG22      THR  62  74.042  -2.997  17.905
  473   HG23  THR  62          HG23      THR  62  72.987  -1.955  16.950
  474    H    ASP  63           HN       ASP  63  72.013  -2.619  12.829
  475    HA   ASP  63           HA       ASP  63  71.345  -5.344  12.161
  476    HB2  ASP  63           HB2      ASP  63  69.843  -3.287  11.920
  477    HB3  ASP  63           HB1      ASP  63  70.761  -2.907  10.463
  478    H    ILE  64           HN       ILE  64  74.128  -3.837  11.591
  479    HA   ILE  64           HA       ILE  64  74.462  -4.905   8.819
  480    HB   ILE  64           HB       ILE  64  76.239  -2.959  10.318
  481   HG12  ILE  64          HG12      ILE  64  74.302  -2.327   8.080
  482   HG13  ILE  64          HG11      ILE  64  73.861  -2.166   9.781
  483   HG21  ILE  64          HG21      ILE  64  77.329  -2.629   8.212
  484   HG22  ILE  64          HG22      ILE  64  76.088  -3.542   7.352
  485   HG23  ILE  64          HG23      ILE  64  77.208  -4.375   8.430
  486   HD11  ILE  64          HD11      ILE  64  76.320  -0.848   8.613
  487   HD12  ILE  64          HD12      ILE  64  75.544  -0.515  10.161
  488   HD13  ILE  64          HD13      ILE  64  74.748  -0.049   8.658
  489    H    THR  65           HN       THR  65  77.142  -4.205  10.886
  490    HA   THR  65           HA       THR  65  78.612  -5.599  12.107
  491    HB   THR  65           HB       THR  65  77.179  -8.085  11.230
  492    HG1  THR  65           HG1      THR  65  76.207  -6.061  12.920
  493   HG21  THR  65          HG21      THR  65  79.237  -8.048  12.701
  494   HG22  THR  65          HG22      THR  65  77.841  -8.859  13.410
  495   HG23  THR  65          HG23      THR  65  78.265  -7.226  13.922
  496    H    VAL  66           HN       VAL  66  79.680  -4.727   9.982
  497    HA   VAL  66           HA       VAL  66  81.247  -5.155   8.293
  498    HB   VAL  66           HB       VAL  66  81.055  -8.084   9.013
  499   HG11  VAL  66          HG11      VAL  66  82.429  -7.282   7.046
  500   HG12  VAL  66          HG12      VAL  66  83.354  -8.131   8.284
  501   HG13  VAL  66          HG13      VAL  66  83.415  -6.371   8.190
  502   HG21  VAL  66          HG21      VAL  66  82.361  -5.807  10.509
  503   HG22  VAL  66          HG22      VAL  66  82.962  -7.460  10.642
  504   HG23  VAL  66          HG23      VAL  66  81.316  -7.077  11.146
  505    H    ILE  67           HN       ILE  67  78.878  -7.824   8.430
  506    HA   ILE  67           HA       ILE  67  78.253  -7.284   5.556
  507    HB   ILE  67           HB       ILE  67  78.632  -9.950   6.945
  508   HG12  ILE  67          HG12      ILE  67  79.676  -8.993   4.272
  509   HG13  ILE  67          HG11      ILE  67  80.546  -8.693   5.777
  510   HG21  ILE  67          HG21      ILE  67  77.111  -9.250   4.432
  511   HG22  ILE  67          HG22      ILE  67  76.592 -10.261   5.780
  512   HG23  ILE  67          HG23      ILE  67  77.823 -10.847   4.662
  513   HD11  ILE  67          HD11      ILE  67  80.561 -11.132   6.235
  514   HD12  ILE  67          HD12      ILE  67  81.377 -10.747   4.720
  515   HD13  ILE  67          HD13      ILE  67  79.744 -11.412   4.698
  516    H1U  RCY  68           H1U      RCY  68  73.857  -0.707   1.472
  517    H1S  RCY  68           H1S      RCY  68  73.149  -4.469   2.781
  518    HB1  RCY  68           HB1      RCY  68  74.172  -4.833   6.539
  519    HB2  RCY  68           HB2      RCY  68  72.744  -5.810   6.204
  520    HA   RCY  68           HA       RCY  68  74.423  -6.836   7.823
  521    HN1  RCY  68           HN1      RCY  68  76.246  -6.400   5.660
  522    HA   PRO  69           HA       PRO  69  72.988 -10.837   6.433
  523    HB2  PRO  69           HB2      PRO  69  71.039 -11.220   8.296
  524    HB3  PRO  69           HB1      PRO  69  72.767 -11.356   8.677
  525    HG2  PRO  69           HG2      PRO  69  70.899  -9.097   9.194
  526    HG3  PRO  69           HG1      PRO  69  72.186  -9.755  10.217
  527    HD2  PRO  69           HD2      PRO  69  72.474  -7.473   8.706
  528    HD3  PRO  69           HD1      PRO  69  73.834  -8.521   9.168
  529    H    TRP  70           HN       TRP  70  70.911  -8.031   6.757
  530    HA   TRP  70           HA       TRP  70  68.640  -9.310   5.432
  531    HD1  TRP  70           HD1      TRP  70  67.345  -6.444   3.554
  532    HE1  TRP  70           HE1      TRP  70  68.192  -4.182   2.654
  533    HE3  TRP  70           HE3      TRP  70  70.683  -5.229   7.223
  534    HZ2  TRP  70           HZ2      TRP  70  70.043  -2.125   3.393
  535    HZ3  TRP  70           HZ3      TRP  70  71.971  -3.119   7.101
  536    HH2  TRP  70           HH2      TRP  70  71.658  -1.566   5.195
  537    HB2  TRP  70           HB2      TRP  70  67.492  -7.469   6.106
  538    HB3  TRP  70           HB1      TRP  70  68.941  -7.050   7.013
  539    H    GLU  71           HN       GLU  71  71.621  -8.266   4.369
  540    HA   GLU  71           HA       GLU  71  70.695  -8.314   1.583
  541    HB2  GLU  71           HB2      GLU  71  70.398  -5.951   2.079
  542    HB3  GLU  71           HB1      GLU  71  72.004  -5.858   2.794
  543    HG2  GLU  71           HG2      GLU  71  71.658  -5.067   0.311
  544    HG3  GLU  71           HG1      GLU  71  73.084  -6.021   0.722
  545    H    ALA  72           HN       ALA  72  72.111 -10.294   2.248
  546    HA   ALA  72           HA       ALA  72  74.982  -9.818   2.442
  547    HB1  ALA  72           HB1      ALA  72  73.309 -12.305   2.025
  548    HB2  ALA  72           HB2      ALA  72  74.170 -11.814   3.484
  549    HB3  ALA  72           HB3      ALA  72  75.071 -12.343   2.063
  550    H1U  RCY  73           H1U      RCY  73  74.700  -1.958   1.348
  551    H1S  RCY  73           H1S      RCY  73  75.145  -6.198  -0.113
  552    HB1  RCY  73           HB1      RCY  73  74.587  -7.076  -1.710
  553    HB2  RCY  73           HB2      RCY  73  75.559  -7.629  -3.073
  554    HA   RCY  73           HA       RCY  73  74.319  -9.524  -2.193
  555    HN1  RCY  73           HN1      RCY  73  74.737  -8.387   0.365
  556    H    ASN  74           HN       ASN  74  76.626 -10.403   0.050
  557    HA   ASN  74           HA       ASN  74  78.581 -11.692  -0.088
  558    HB2  ASN  74           HB2      ASN  74  76.896 -13.046  -1.487
  559    HB3  ASN  74           HB1      ASN  74  77.702 -12.365  -2.900
  560   HD21  ASN  74          HD21      ASN  74  77.880 -15.115  -2.612
  561   HD22  ASN  74          HD22      ASN  74  79.441 -15.561  -2.115
  562    H    HIS  75           HN       HIS  75  79.741  -9.561  -0.174
  563    HA   HIS  75           HA       HIS  75  81.291  -8.088  -1.146
  564    HD1  HIS  75           HD1      HIS  75  84.544  -8.255  -2.133
  565    HD2  HIS  75           HD2      HIS  75  82.732 -10.727   0.696
  566    HE1  HIS  75           HE1      HIS  75  86.040  -8.219  -0.090
  567    HE2  HIS  75           HE2      HIS  75  84.949  -9.720   1.640
  568    HB2  HIS  75           HB2      HIS  75  81.883 -10.825  -2.098
  569    HB3  HIS  75           HB1      HIS  75  82.585  -9.551  -3.092
  570    H1U  RCY  76           H1U      RCY  76  80.119   0.231  -5.487
  571    H1S  RCY  76           H1S      RCY  76  81.932  -3.977  -4.105
  572    HB1  RCY  76           HB1      RCY  76  79.178  -5.082  -3.554
  573    HB2  RCY  76           HB2      RCY  76  78.722  -5.178  -5.254
  574    HA   RCY  76           HA       RCY  76  77.570  -6.938  -4.032
  575    HN1  RCY  76           HN1      RCY  76  78.814  -7.617  -2.139
  576    H    GLU  77           HN       GLU  77  76.934  -8.479  -5.478
  577    HA   GLU  77           HA       GLU  77  78.679 -10.215  -6.920
  578    HB2  GLU  77           HB2      GLU  77  76.612 -10.449  -8.462
  579    HB3  GLU  77           HB1      GLU  77  76.423 -10.914  -6.772
  580    HG2  GLU  77           HG2      GLU  77  75.870  -8.069  -7.508
  581    HG3  GLU  77           HG1      GLU  77  74.673  -9.287  -7.953
  582    H    LEU  78           HN       LEU  78  80.320  -9.029  -7.971
  583    HA   LEU  78           HA       LEU  78  81.279  -7.598  -9.578
  584    HG   LEU  78           HG       LEU  78  81.500  -9.739 -10.383
  585    HB2  LEU  78           HB2      LEU  78  78.849  -8.605 -11.093
  586    HB3  LEU  78           HB1      LEU  78  80.242  -7.813 -11.828
  587   HD11  LEU  78          HD11      LEU  78  78.966 -11.057 -11.391
  588   HD12  LEU  78          HD12      LEU  78  79.217 -10.620  -9.701
  589   HD13  LEU  78          HD13      LEU  78  80.272 -11.805 -10.472
  590   HD21  LEU  78          HD21      LEU  78  81.977  -9.392 -12.701
  591   HD22  LEU  78          HD22      LEU  78  80.338  -9.838 -13.176
  592   HD23  LEU  78          HD23      LEU  78  81.446 -11.069 -12.571
  593    H    HIS  79           HN       HIS  79  78.542  -6.753 -11.354
  594    HA   HIS  79           HA       HIS  79  77.528  -4.573  -9.775
  595    HD1  HIS  79           HD1      HIS  79  78.840  -3.948 -13.754
  596    HD2  HIS  79           HD2      HIS  79  81.912  -4.658 -11.023
  597    HE1  HIS  79           HE1      HIS  79  80.810  -4.799 -15.099
  598    HE2  HIS  79           HE2      HIS  79  82.687  -5.235 -13.449
  599    HB2  HIS  79           HB2      HIS  79  78.573  -2.772 -11.311
  600    HB3  HIS  79           HB1      HIS  79  79.601  -3.460 -10.054
  601    H    GLU  80           HN       GLU  80  76.020  -6.300 -11.057
  602    HA   GLU  80           HA       GLU  80  75.371  -5.203 -13.753
  603    HB2  GLU  80           HB2      GLU  80  74.650  -7.764 -12.321
  604    HB3  GLU  80           HB1      GLU  80  73.811  -7.250 -13.785
  605    HG2  GLU  80           HG2      GLU  80  76.824  -7.434 -13.653
  606    HG3  GLU  80           HG1      GLU  80  75.824  -8.815 -14.107
  607    H    LEU  81           HN       LEU  81  74.370  -5.048 -10.500
  608    HA   LEU  81           HA       LEU  81  71.540  -4.514 -11.118
  609    HG   LEU  81           HG       LEU  81  73.501  -6.301  -9.154
  610    HB2  LEU  81           HB2      LEU  81  72.950  -4.026  -8.488
  611    HB3  LEU  81           HB1      LEU  81  71.234  -4.327  -8.760
  612   HD11  LEU  81          HD11      LEU  81  71.121  -6.290  -7.272
  613   HD12  LEU  81          HD12      LEU  81  72.784  -5.929  -6.809
  614   HD13  LEU  81          HD13      LEU  81  72.355  -7.545  -7.370
  615   HD21  LEU  81          HD21      LEU  81  71.482  -7.867  -9.574
  616   HD22  LEU  81          HD22      LEU  81  71.960  -6.790 -10.887
  617   HD23  LEU  81          HD23      LEU  81  70.570  -6.388  -9.878
  618    H    ALA  82           HN       ALA  82  74.201  -2.789 -11.713
  619    HA   ALA  82           HA       ALA  82  73.654  -0.238 -10.489
  620    HB1  ALA  82           HB1      ALA  82  75.861  -0.820 -11.440
  621    HB2  ALA  82           HB2      ALA  82  75.223   0.655 -12.166
  622    HB3  ALA  82           HB3      ALA  82  75.149  -0.867 -13.053
  623    H    GLN  83           HN       GLN  83  71.438  -1.695 -12.052
  624    HA   GLN  83           HA       GLN  83  70.746  -0.372 -14.420
  625    HB2  GLN  83           HB2      GLN  83  68.934  -1.263 -12.158
  626    HB3  GLN  83           HB1      GLN  83  68.378  -0.829 -13.775
  627    HG2  GLN  83           HG2      GLN  83  69.523  -2.656 -14.777
  628    HG3  GLN  83           HG1      GLN  83  70.485  -2.946 -13.327
  629   HE21  GLN  83          HE21      GLN  83  67.271  -3.380 -14.759
  630   HE22  GLN  83          HE22      GLN  83  66.697  -4.454 -13.577
  631    H    TYR  84           HN       TYR  84  70.315   0.730 -11.070
  632    HA   TYR  84           HA       TYR  84  70.143   3.506 -12.008
  633    HD1  TYR  84           HD1      TYR  84  68.099   5.021 -12.986
  634    HD2  TYR  84           HD2      TYR  84  67.565   4.054  -8.834
  635    HE1  TYR  84           HE1      TYR  84  67.524   7.386 -12.509
  636    HE2  TYR  84           HE2      TYR  84  66.990   6.419  -8.358
  637    HH   TYR  84           HH       TYR  84  67.695   8.897 -10.245
  638    HB2  TYR  84           HB2      TYR  84  67.784   2.651 -12.175
  639    HB3  TYR  84           HB1      TYR  84  67.831   2.315 -10.444
  640    H    GLY  85           HN       GLY  85  71.387   1.371  -9.977
  641    HA2  GLY  85           HA2      GLY  85  71.007   2.586  -7.383
  642    HA3  GLY  85           HA1      GLY  85  72.272   1.431  -7.799
  643    H    ILE  86           HN       ILE  86  71.492   4.758  -8.889
  644    HA   ILE  86           HA       ILE  86  74.252   5.481  -9.206
  645    HB   ILE  86           HB       ILE  86  72.427   6.692 -10.343
  646   HG12  ILE  86          HG12      ILE  86  73.198   9.004  -9.818
  647   HG13  ILE  86          HG11      ILE  86  74.014   8.382  -8.384
  648   HG21  ILE  86          HG21      ILE  86  71.753   7.912  -7.662
  649   HG22  ILE  86          HG22      ILE  86  70.899   6.499  -8.282
  650   HG23  ILE  86          HG23      ILE  86  70.844   8.022  -9.169
  651   HD11  ILE  86          HD11      ILE  86  75.675   7.361  -9.601
  652   HD12  ILE  86          HD12      ILE  86  75.273   8.641 -10.745
  653   HD13  ILE  86          HD13      ILE  86  74.610   7.022 -10.965
  654    H1U  RCY  87           H1U      RCY  87  79.545   1.869  -3.534
  655    H1S  RCY  87           H1S      RCY  87  79.506   5.823  -4.275
  656    HB1  RCY  87           HB1      RCY  87  77.509   6.345  -6.347
  657    HB2  RCY  87           HB2      RCY  87  76.999   5.191  -5.121
  658    HA   RCY  87           HA       RCY  87  74.895   6.185  -4.876
  659    HN1  RCY  87           HN1      RCY  87  75.717   6.119  -7.687
  Start of MODEL   49
    1    HA   MET   1           HA       MET   1  47.001  -4.173  -2.285
    2    HB2  MET   1           HB2      MET   1  49.503  -3.406  -3.159
    3    HB3  MET   1           HB1      MET   1  48.132  -3.737  -4.215
    4    HG2  MET   1           HG2      MET   1  49.205  -1.521  -4.669
    5    HG3  MET   1           HG1      MET   1  47.504  -1.387  -4.224
    6    HE1  MET   1           HE1      MET   1  50.532   0.325  -4.022
    7    HE2  MET   1           HE2      MET   1  50.091   1.498  -2.783
    8    HE3  MET   1           HE3      MET   1  48.982   1.171  -4.113
    9    H    ASN   2           HN       ASN   2  47.847  -5.211  -0.551
   10    HA   ASN   2           HA       ASN   2  50.169  -4.141   0.867
   11    HB2  ASN   2           HB2      ASN   2  47.427  -4.187   2.141
   12    HB3  ASN   2           HB1      ASN   2  48.905  -4.230   3.102
   13   HD21  ASN   2          HD21      ASN   2  50.416  -2.345   2.851
   14   HD22  ASN   2          HD22      ASN   2  49.796  -0.842   2.364
   15    H    LEU   3           HN       LEU   3  48.169  -5.983   2.892
   16    HA   LEU   3           HA       LEU   3  48.184  -8.246   3.510
   17    HG   LEU   3           HG       LEU   3  46.781  -9.645   2.310
   18    HB2  LEU   3           HB2      LEU   3  48.139  -8.280   0.730
   19    HB3  LEU   3           HB1      LEU   3  49.544  -9.274   1.109
   20   HD11  LEU   3          HD11      LEU   3  46.899 -11.794   0.935
   21   HD12  LEU   3          HD12      LEU   3  48.259 -11.064   0.082
   22   HD13  LEU   3          HD13      LEU   3  46.667 -10.308   0.014
   23   HD21  LEU   3          HD21      LEU   3  49.455 -10.962   2.685
   24   HD22  LEU   3          HD22      LEU   3  47.989 -11.927   2.856
   25   HD23  LEU   3          HD23      LEU   3  48.249 -10.527   3.896
   26    H    GLU   4           HN       GLU   4  49.726  -9.777   4.369
   27    HA   GLU   4           HA       GLU   4  52.142  -8.747   5.295
   28    HB2  GLU   4           HB2      GLU   4  51.197 -10.782   6.227
   29    HB3  GLU   4           HB1      GLU   4  51.436 -11.632   4.701
   30    HG2  GLU   4           HG2      GLU   4  53.792 -11.620   4.927
   31    HG3  GLU   4           HG1      GLU   4  53.749 -10.367   6.168
   32    HA   PRO   5           HA       PRO   5  54.538  -8.234   1.510
   33    HB2  PRO   5           HB2      PRO   5  56.729  -8.761   3.493
   34    HB3  PRO   5           HB1      PRO   5  56.625  -7.510   2.237
   35    HG2  PRO   5           HG2      PRO   5  56.142  -6.961   4.802
   36    HG3  PRO   5           HG1      PRO   5  55.237  -6.178   3.497
   37    HD2  PRO   5           HD2      PRO   5  54.322  -8.236   5.431
   38    HD3  PRO   5           HD1      PRO   5  53.371  -7.047   4.514
   39    HA   PRO   6           HA       PRO   6  55.109 -12.739   1.041
   40    HB2  PRO   6           HB2      PRO   6  54.725 -12.850  -1.642
   41    HB3  PRO   6           HB1      PRO   6  53.378 -12.686  -0.498
   42    HG2  PRO   6           HG2      PRO   6  54.669 -10.623  -2.200
   43    HG3  PRO   6           HG1      PRO   6  52.966 -10.819  -1.755
   44    HD2  PRO   6           HD2      PRO   6  54.717  -9.012  -0.560
   45    HD3  PRO   6           HD1      PRO   6  53.209  -9.597   0.174
   46    H    LYS   7           HN       LYS   7  57.077 -13.728   0.826
   47    HA   LYS   7           HA       LYS   7  58.893 -13.163  -1.342
   48    HB2  LYS   7           HB2      LYS   7  59.226 -11.153   0.173
   49    HB3  LYS   7           HB1      LYS   7  59.827 -12.272   1.395
   50    HG2  LYS   7           HG2      LYS   7  61.764 -11.477   0.249
   51    HG3  LYS   7           HG1      LYS   7  61.476 -13.101  -0.376
   52    HD2  LYS   7           HD2      LYS   7  59.947 -11.244  -1.934
   53    HD3  LYS   7           HD1      LYS   7  61.611 -10.666  -1.846
   54    HE2  LYS   7           HE2      LYS   7  62.453 -12.798  -2.644
   55    HE3  LYS   7           HE1      LYS   7  60.837 -13.502  -2.584
   56    HZ1  LYS   7           HZ1      LYS   7  60.609 -12.829  -4.671
   57    HZ2  LYS   7           HZ2      LYS   7  62.036 -11.907  -4.616
   58    HZ3  LYS   7           HZ3      LYS   7  60.566 -11.234  -4.095
   59    H    ALA   8           HN       ALA   8  58.498 -14.425   1.924
   60    HA   ALA   8           HA       ALA   8  59.138 -17.097   1.280
   61    HB1  ALA   8           HB1      ALA   8  61.491 -15.374   2.021
   62    HB2  ALA   8           HB2      ALA   8  61.384 -16.639   0.798
   63    HB3  ALA   8           HB3      ALA   8  61.463 -17.069   2.506
   64    H    GLU   9           HN       GLU   9  60.935 -16.028   4.005
   65    HA   GLU   9           HA       GLU   9  58.625 -16.160   5.841
   66    HB2  GLU   9           HB2      GLU   9  59.926 -17.922   7.216
   67    HB3  GLU   9           HB1      GLU   9  59.071 -18.486   5.782
   68    HG2  GLU   9           HG2      GLU   9  61.323 -19.435   5.805
   69    HG3  GLU   9           HG1      GLU   9  61.189 -18.279   4.479
   70    H1U  RCY  10           H1U      RCY  10  67.584 -10.778   2.286
   71    H1S  RCY  10           H1S      RCY  10  66.699 -13.713   6.021
   72    HB1  RCY  10           HB1      RCY  10  64.045 -12.652   6.183
   73    HB2  RCY  10           HB2      RCY  10  63.283 -13.414   4.788
   74    HA   RCY  10           HA       RCY  10  62.687 -14.373   7.584
   75    HN1  RCY  10           HN1      RCY  10  61.594 -14.939   4.946
   76    H    ARG  11           HN       ARG  11  63.230 -11.772   7.759
   77    HA   ARG  11           HA       ARG  11  62.365  -9.627   8.151
   78    HE   ARG  11           HE       ARG  11  63.272  -8.830   6.952
   79    HB2  ARG  11           HB2      ARG  11  61.284 -10.206   5.778
   80    HB3  ARG  11           HB1      ARG  11  59.805 -10.271   6.732
   81    HG2  ARG  11           HG2      ARG  11  59.767  -8.018   6.354
   82    HG3  ARG  11           HG1      ARG  11  60.911  -7.976   7.697
   83    HD2  ARG  11           HD2      ARG  11  61.552  -7.986   4.737
   84    HD3  ARG  11           HD1      ARG  11  61.893  -6.708   5.904
   85   HH11  ARG  11          HH21      ARG  11  63.011  -7.430   3.812
   86   HH12  ARG  11          HH22      ARG  11  64.622  -7.858   3.341
   87   HH21  ARG  11          HH11      ARG  11  65.378  -9.397   6.355
   88   HH22  ARG  11          HH12      ARG  11  65.962  -8.971   4.781
   89    H    SER  12           HN       SER  12  60.312  -8.606   9.202
   90    HA   SER  12           HA       SER  12  58.572 -10.462  10.646
   91    HG   SER  12           HG       SER  12  61.484 -10.968  12.127
   92    HB2  SER  12           HB2      SER  12  60.830  -9.001  12.021
   93    HB3  SER  12           HB1      SER  12  59.375  -9.474  12.893
   94    H    ALA  13           HN       ALA  13  59.811  -7.245  11.545
   95    HA   ALA  13           HA       ALA  13  57.627  -5.777  10.381
   96    HB1  ALA  13           HB1      ALA  13  57.432  -6.091  13.384
   97    HB2  ALA  13           HB2      ALA  13  56.482  -7.073  12.270
   98    HB3  ALA  13           HB3      ALA  13  56.274  -5.323  12.299
   99    H    THR  14           HN       THR  14  59.377  -4.382   9.825
  100    HA   THR  14           HA       THR  14  60.033  -2.418  11.873
  101    HB   THR  14           HB       THR  14  62.466  -3.691  10.674
  102    HG1  THR  14           HG1      THR  14  61.896  -5.500  11.574
  103   HG21  THR  14          HG21      THR  14  62.345  -1.562  12.132
  104   HG22  THR  14          HG22      THR  14  63.535  -2.785  12.577
  105   HG23  THR  14          HG23      THR  14  62.021  -2.660  13.473
  106    H    ARG  15           HN       ARG  15  58.687  -1.889   9.637
  107    HA   ARG  15           HA       ARG  15  58.716  -0.333   7.875
  108    HE   ARG  15           HE       ARG  15  58.536   4.013   7.206
  109    HB2  ARG  15           HB2      ARG  15  60.813   0.493   9.326
  110    HB3  ARG  15           HB1      ARG  15  61.700  -0.108   7.928
  111    HG2  ARG  15           HG2      ARG  15  61.267   2.123   7.335
  112    HG3  ARG  15           HG1      ARG  15  59.957   1.252   6.538
  113    HD2  ARG  15           HD2      ARG  15  58.381   1.877   8.193
  114    HD3  ARG  15           HD1      ARG  15  59.642   2.363   9.327
  115   HH11  ARG  15          HH21      ARG  15  61.316   3.253   9.099
  116   HH12  ARG  15          HH22      ARG  15  62.019   4.828   8.940
  117   HH21  ARG  15          HH11      ARG  15  59.438   6.074   6.988
  118   HH22  ARG  15          HH12      ARG  15  60.955   6.425   7.745
  119    H    VAL  16           HN       VAL  16  58.470  -1.018   5.811
  120    HA   VAL  16           HA       VAL  16  60.582  -2.258   4.290
  121    HB   VAL  16           HB       VAL  16  59.930  -4.168   5.776
  122   HG11  VAL  16          HG11      VAL  16  57.485  -3.374   5.844
  123   HG12  VAL  16          HG12      VAL  16  57.749  -5.111   5.684
  124   HG13  VAL  16          HG13      VAL  16  57.310  -4.151   4.271
  125   HG21  VAL  16          HG21      VAL  16  59.162  -4.511   2.859
  126   HG22  VAL  16          HG22      VAL  16  59.674  -5.795   3.955
  127   HG23  VAL  16          HG23      VAL  16  60.813  -4.536   3.478
  128    H    MET  17           HN       MET  17  60.120  -1.870   2.155
  129    HA   MET  17           HA       MET  17  57.621  -0.579   1.458
  130    HB2  MET  17           HB2      MET  17  60.047  -0.385   0.390
  131    HB3  MET  17           HB1      MET  17  59.461  -1.694  -0.636
  132    HG2  MET  17           HG2      MET  17  58.082   0.978  -0.233
  133    HG3  MET  17           HG1      MET  17  58.996   0.501  -1.664
  134    HE1  MET  17           HE1      MET  17  56.716   1.628  -2.231
  135    HE2  MET  17           HE2      MET  17  55.340   0.671  -2.774
  136    HE3  MET  17           HE3      MET  17  56.885   0.533  -3.610
  137    H    GLY  18           HN       GLY  18  59.089  -3.547   0.079
  138    HA2  GLY  18           HA2      GLY  18  58.032  -5.640  -0.304
  139    HA3  GLY  18           HA1      GLY  18  56.539  -4.975   0.358
  140    H    GLY  19           HN       GLY  19  57.557  -6.297  -2.351
  141    HA2  GLY  19           HA2      GLY  19  55.624  -5.839  -4.113
  142    HA3  GLY  19           HA1      GLY  19  56.451  -4.284  -4.232
  143    HA   PRO  20           HA       PRO  20  58.221  -8.031  -6.920
  144    HB2  PRO  20           HB2      PRO  20  57.441  -5.957  -8.945
  145    HB3  PRO  20           HB1      PRO  20  57.435  -7.726  -9.086
  146    HG2  PRO  20           HG2      PRO  20  55.193  -6.323  -8.664
  147    HG3  PRO  20           HG1      PRO  20  55.439  -7.941  -7.989
  148    HD2  PRO  20           HD2      PRO  20  55.379  -5.333  -6.595
  149    HD3  PRO  20           HD1      PRO  20  55.135  -6.966  -5.940
  150    H1U  RCY  21           H1U      RCY  21  67.380  -2.763  -2.061
  151    H1S  RCY  21           H1S      RCY  21  64.620  -3.528  -5.471
  152    HB1  RCY  21           HB1      RCY  21  62.490  -7.346  -5.239
  153    HB2  RCY  21           HB2      RCY  21  62.142  -5.797  -4.473
  154    HA   RCY  21           HA       RCY  21  61.495  -4.809  -6.553
  155    HN1  RCY  21           HN1      RCY  21  60.203  -7.284  -5.815
  156    H    THR  22           HN       THR  22  62.110  -4.467  -8.636
  157    HA   THR  22           HA       THR  22  63.239  -6.750 -10.192
  158    HB   THR  22           HB       THR  22  62.161  -4.063 -11.086
  159    HG1  THR  22           HG1      THR  22  60.742  -5.873 -10.382
  160   HG21  THR  22          HG21      THR  22  62.388  -5.166 -13.381
  161   HG22  THR  22          HG22      THR  22  63.435  -6.349 -12.597
  162   HG23  THR  22          HG23      THR  22  63.891  -4.645 -12.619
  163    HA   PRO  23           HA       PRO  23  67.206  -4.811  -8.998
  164    HB2  PRO  23           HB2      PRO  23  68.032  -6.707 -11.172
  165    HB3  PRO  23           HB1      PRO  23  68.777  -6.418  -9.586
  166    HG2  PRO  23           HG2      PRO  23  67.268  -8.563 -10.041
  167    HG3  PRO  23           HG1      PRO  23  67.235  -7.724  -8.481
  168    HD2  PRO  23           HD2      PRO  23  65.179  -7.760 -10.636
  169    HD3  PRO  23           HD1      PRO  23  64.977  -7.520  -8.887
  170    H    ARG  24           HN       ARG  24  66.926  -2.721  -9.897
  171    HA   ARG  24           HA       ARG  24  66.753  -2.251 -12.741
  172    HE   ARG  24           HE       ARG  24  64.423   1.572 -10.878
  173    HB2  ARG  24           HB2      ARG  24  66.125  -0.719 -10.663
  174    HB3  ARG  24           HB1      ARG  24  67.781  -0.149 -10.862
  175    HG2  ARG  24           HG2      ARG  24  67.284   0.285 -13.281
  176    HG3  ARG  24           HG1      ARG  24  65.600  -0.139 -12.968
  177    HD2  ARG  24           HD2      ARG  24  67.173   2.174 -11.816
  178    HD3  ARG  24           HD1      ARG  24  65.713   2.243 -12.803
  179   HH11  ARG  24          HH21      ARG  24  67.825   1.784 -10.362
  180   HH12  ARG  24          HH22      ARG  24  67.699   1.774  -8.635
  181   HH21  ARG  24          HH11      ARG  24  64.238   1.557  -8.625
  182   HH22  ARG  24          HH12      ARG  24  65.668   1.645  -7.651
  183    H    LYS  25           HN       LYS  25  68.522  -3.259 -13.767
  184    HA   LYS  25           HA       LYS  25  71.223  -3.161 -12.932
  185    HB2  LYS  25           HB2      LYS  25  70.668  -3.031 -15.862
  186    HB3  LYS  25           HB1      LYS  25  71.700  -4.143 -14.961
  187    HG2  LYS  25           HG2      LYS  25  69.471  -5.049 -13.969
  188    HG3  LYS  25           HG1      LYS  25  68.712  -4.235 -15.338
  189    HD2  LYS  25           HD2      LYS  25  70.265  -5.470 -16.867
  190    HD3  LYS  25           HD1      LYS  25  70.866  -6.365 -15.470
  191    HE2  LYS  25           HE2      LYS  25  67.962  -6.290 -16.340
  192    HE3  LYS  25           HE1      LYS  25  69.083  -7.600 -16.711
  193    HZ1  LYS  25           HZ1      LYS  25  67.715  -8.027 -14.728
  194    HZ2  LYS  25           HZ2      LYS  25  68.419  -6.680 -13.968
  195    HZ3  LYS  25           HZ3      LYS  25  69.377  -8.020 -14.385
  196    H    GLY  26           HN       GLY  26  69.301  -0.823 -14.761
  197    HA2  GLY  26           HA2      GLY  26  69.730   1.458 -15.151
  198    HA3  GLY  26           HA1      GLY  26  71.131   1.321 -14.087
  199    HA   PRO  27           HA       PRO  27  72.274   1.965 -18.705
  200    HB2  PRO  27           HB2      PRO  27  74.195   3.702 -17.197
  201    HB3  PRO  27           HB1      PRO  27  73.392   3.997 -18.752
  202    HG2  PRO  27           HG2      PRO  27  72.570   5.176 -16.506
  203    HG3  PRO  27           HG1      PRO  27  71.432   4.669 -17.765
  204    HD2  PRO  27           HD2      PRO  27  71.918   3.472 -15.086
  205    HD3  PRO  27           HD1      PRO  27  70.453   3.433 -16.092
  206    HA   PRO  28           HA       PRO  28  75.232  -1.392 -18.251
  207    HB2  PRO  28           HB2      PRO  28  76.463  -0.003 -20.609
  208    HB3  PRO  28           HB1      PRO  28  76.113  -1.727 -20.376
  209    HG2  PRO  28           HG2      PRO  28  74.554  -0.154 -21.877
  210    HG3  PRO  28           HG1      PRO  28  73.899  -1.488 -20.915
  211    HD2  PRO  28           HD2      PRO  28  73.634   1.429 -20.480
  212    HD3  PRO  28           HD1      PRO  28  72.614   0.103 -19.881
  213    H    LYS  29           HN       LYS  29  76.970  -1.433 -16.892
  214    HA   LYS  29           HA       LYS  29  79.397  -0.119 -17.100
  215    HB2  LYS  29           HB2      LYS  29  77.297   1.713 -16.182
  216    HB3  LYS  29           HB1      LYS  29  78.611   1.592 -15.019
  217    HG2  LYS  29           HG2      LYS  29  80.226   2.318 -16.583
  218    HG3  LYS  29           HG1      LYS  29  79.174   1.978 -17.958
  219    HD2  LYS  29           HD2      LYS  29  77.626   3.779 -17.132
  220    HD3  LYS  29           HD1      LYS  29  78.829   4.184 -15.908
  221    HE2  LYS  29           HE2      LYS  29  79.314   5.674 -17.672
  222    HE3  LYS  29           HE1      LYS  29  80.484   4.373 -17.895
  223    HZ1  LYS  29           HZ1      LYS  29  77.896   4.077 -19.206
  224    HZ2  LYS  29           HZ2      LYS  29  79.443   3.620 -19.738
  225    HZ3  LYS  29           HZ3      LYS  29  78.949   5.242 -19.847
  226    H1U  RCY  30           H1U      RCY  30  78.424  -3.146  -8.357
  227    H1S  RCY  30           H1S      RCY  30  78.375  -1.786 -12.653
  228    HB1  RCY  30           HB1      RCY  30  78.781  -4.552 -13.161
  229    HB2  RCY  30           HB2      RCY  30  78.590  -4.529 -14.911
  230    HA   RCY  30           HA       RCY  30  79.685  -2.247 -13.239
  231    HN1  RCY  30           HN1      RCY  30  79.716  -2.291 -16.208
  232    H    LYS  31           HN       LYS  31  80.267  -5.338 -13.962
  233    HA   LYS  31           HA       LYS  31  82.256  -6.591 -14.021
  234    HB2  LYS  31           HB2      LYS  31  83.097  -4.420 -15.967
  235    HB3  LYS  31           HB1      LYS  31  83.767  -6.047 -15.856
  236    HG2  LYS  31           HG2      LYS  31  82.060  -6.948 -17.044
  237    HG3  LYS  31           HG1      LYS  31  80.847  -6.027 -16.154
  238    HD2  LYS  31           HD2      LYS  31  81.403  -4.020 -17.500
  239    HD3  LYS  31           HD1      LYS  31  82.569  -4.974 -18.418
  240    HE2  LYS  31           HE2      LYS  31  80.883  -6.317 -19.389
  241    HE3  LYS  31           HE1      LYS  31  79.685  -5.829 -18.190
  242    HZ1  LYS  31           HZ1      LYS  31  79.665  -3.624 -19.100
  243    HZ2  LYS  31           HZ2      LYS  31  79.382  -4.735 -20.353
  244    HZ3  LYS  31           HZ3      LYS  31  80.908  -4.007 -20.189
  245    H    GLN  32           HN       GLN  32  84.935  -5.676 -14.382
  246    HA   GLN  32           HA       GLN  32  85.475  -4.687 -11.711
  247    HB2  GLN  32           HB2      GLN  32  87.477  -4.709 -13.971
  248    HB3  GLN  32           HB1      GLN  32  87.762  -4.957 -12.248
  249    HG2  GLN  32           HG2      GLN  32  86.289  -6.842 -14.112
  250    HG3  GLN  32           HG1      GLN  32  87.883  -7.107 -13.404
  251   HE21  GLN  32          HE21      GLN  32  85.240  -8.618 -13.022
  252   HE22  GLN  32          HE22      GLN  32  85.016  -8.648 -11.340
  253    H    ARG  33           HN       ARG  33  84.075  -3.042 -14.028
  254    HA   ARG  33           HA       ARG  33  85.823  -0.673 -14.092
  255    HE   ARG  33           HE       ARG  33  85.850   3.176 -16.283
  256    HB2  ARG  33           HB2      ARG  33  84.077  -1.708 -15.902
  257    HB3  ARG  33           HB1      ARG  33  83.043  -0.511 -15.128
  258    HG2  ARG  33           HG2      ARG  33  85.778   0.027 -16.328
  259    HG3  ARG  33           HG1      ARG  33  84.232   0.483 -17.044
  260    HD2  ARG  33           HD2      ARG  33  83.806   1.707 -14.786
  261    HD3  ARG  33           HD1      ARG  33  85.551   1.571 -14.564
  262   HH11  ARG  33          HH21      ARG  33  82.634   1.941 -16.154
  263   HH12  ARG  33          HH22      ARG  33  82.003   3.096 -17.280
  264   HH21  ARG  33          HH11      ARG  33  85.045   4.692 -17.753
  265   HH22  ARG  33          HH12      ARG  33  83.368   4.654 -18.185
  266    H    GLN  34           HN       GLN  34  85.746   0.729 -12.419
  267    HA   GLN  34           HA       GLN  34  83.337   0.809 -10.689
  268    HB2  GLN  34           HB2      GLN  34  86.141   1.914 -10.436
  269    HB3  GLN  34           HB1      GLN  34  84.850   2.392  -9.333
  270    HG2  GLN  34           HG2      GLN  34  84.471   0.019  -8.752
  271    HG3  GLN  34           HG1      GLN  34  85.778  -0.451  -9.839
  272   HE21  GLN  34          HE21      GLN  34  87.460  -1.077  -8.449
  273   HE22  GLN  34          HE22      GLN  34  88.052  -0.128  -7.172
  274    H    THR  35           HN       THR  35  85.302   3.648 -11.003
  275    HA   THR  35           HA       THR  35  83.848   5.021 -13.039
  276    HB   THR  35           HB       THR  35  82.887   6.473 -10.784
  277    HG1  THR  35           HG1      THR  35  82.373   4.987  -9.421
  278   HG21  THR  35          HG21      THR  35  80.657   5.749 -11.755
  279   HG22  THR  35          HG22      THR  35  81.564   4.745 -12.886
  280   HG23  THR  35          HG23      THR  35  81.766   6.497 -12.905
  281    H    ARG  36           HN       ARG  36  86.358   4.680 -11.025
  282    HA   ARG  36           HA       ARG  36  88.109   6.072 -10.281
  283    HE   ARG  36           HE       ARG  36  89.455   2.895 -13.234
  284    HB2  ARG  36           HB2      ARG  36  87.297   7.207 -12.958
  285    HB3  ARG  36           HB1      ARG  36  88.639   7.896 -12.043
  286    HG2  ARG  36           HG2      ARG  36  89.358   6.145 -13.689
  287    HG3  ARG  36           HG1      ARG  36  89.793   5.758 -12.023
  288    HD2  ARG  36           HD2      ARG  36  88.048   4.168 -11.818
  289    HD3  ARG  36           HD1      ARG  36  87.216   4.775 -13.249
  290   HH11  ARG  36          HH21      ARG  36  87.676   5.302 -14.946
  291   HH12  ARG  36          HH22      ARG  36  88.140   4.722 -16.510
  292   HH21  ARG  36          HH11      ARG  36  90.071   2.124 -15.267
  293   HH22  ARG  36          HH12      ARG  36  89.496   2.923 -16.692
  294    H    GLN  37           HN       GLN  37  86.373   6.728  -8.578
  295    HA   GLN  37           HA       GLN  37  86.311   9.686  -8.530
  296    HB2  GLN  37           HB2      GLN  37  83.961   9.850  -8.135
  297    HB3  GLN  37           HB1      GLN  37  84.134   8.802  -9.542
  298    HG2  GLN  37           HG2      GLN  37  83.604   7.964  -6.680
  299    HG3  GLN  37           HG1      GLN  37  82.551   7.737  -8.077
  300   HE21  GLN  37          HE21      GLN  37  84.289   5.870  -6.134
  301   HE22  GLN  37          HE22      GLN  37  84.953   4.758  -7.231
  302    H1U  RCY  38           H1U      RCY  38  78.285   5.500  -3.241
  303    H1S  RCY  38           H1S      RCY  38  82.881   6.229  -3.976
  304    HB1  RCY  38           HB1      RCY  38  85.210   7.929  -2.873
  305    HB2  RCY  38           HB2      RCY  38  85.222   7.222  -4.488
  306    HA   RCY  38           HA       RCY  38  85.480  10.189  -3.917
  307    HN1  RCY  38           HN1      RCY  38  85.076  10.211  -6.235
  308    H    LYS  39           HN       LYS  39  86.952   8.792  -2.206
  309    HA   LYS  39           HA       LYS  39  89.692   9.131  -3.231
  310    HB2  LYS  39           HB2      LYS  39  88.561   8.495  -0.494
  311    HB3  LYS  39           HB1      LYS  39  90.291   8.583  -0.825
  312    HG2  LYS  39           HG2      LYS  39  90.199  10.883  -1.342
  313    HG3  LYS  39           HG1      LYS  39  88.451  10.849  -1.581
  314    HD2  LYS  39           HD2      LYS  39  88.077  10.513   0.794
  315    HD3  LYS  39           HD1      LYS  39  89.810  10.358   1.083
  316    HE2  LYS  39           HE2      LYS  39  88.806  12.643   1.611
  317    HE3  LYS  39           HE1      LYS  39  90.203  12.652   0.535
  318    HZ1  LYS  39           HZ1      LYS  39  87.853  13.838  -0.002
  319    HZ2  LYS  39           HZ2      LYS  39  87.665  12.351  -0.803
  320    HZ3  LYS  39           HZ3      LYS  39  88.979  13.361  -1.178
  321    H    SER  40           HN       SER  40  91.167   7.250  -1.958
  322    HA   SER  40           HA       SER  40  90.366   4.773  -3.372
  323    HG   SER  40           HG       SER  40  92.431   6.146  -1.131
  324    HB2  SER  40           HB2      SER  40  92.681   4.026  -2.750
  325    HB3  SER  40           HB1      SER  40  92.656   5.507  -3.703
  326    H    LYS  41           HN       LYS  41  92.300   4.692  -0.459
  327    HA   LYS  41           HA       LYS  41  90.046   3.393   1.016
  328    HB2  LYS  41           HB2      LYS  41  92.892   2.379   0.755
  329    HB3  LYS  41           HB1      LYS  41  91.696   1.721   1.872
  330    HG2  LYS  41           HG2      LYS  41  90.275   1.016   0.071
  331    HG3  LYS  41           HG1      LYS  41  91.232   1.907  -1.113
  332    HD2  LYS  41           HD2      LYS  41  93.188   0.442  -0.548
  333    HD3  LYS  41           HD1      LYS  41  92.122  -0.510   0.485
  334    HE2  LYS  41           HE2      LYS  41  92.206  -1.627  -1.643
  335    HE3  LYS  41           HE1      LYS  41  90.629  -0.845  -1.536
  336    HZ1  LYS  41           HZ1      LYS  41  92.122  -0.567  -3.645
  337    HZ2  LYS  41           HZ2      LYS  41  92.859   0.648  -2.714
  338    HZ3  LYS  41           HZ3      LYS  41  91.198   0.731  -3.062
  339    HA   PRO  42           HA       PRO  42  92.189   6.495   3.678
  340    HB2  PRO  42           HB2      PRO  42  89.972   7.832   4.503
  341    HB3  PRO  42           HB1      PRO  42  90.756   8.164   2.946
  342    HG2  PRO  42           HG2      PRO  42  88.283   6.637   3.528
  343    HG3  PRO  42           HG1      PRO  42  88.678   7.666   2.144
  344    HD2  PRO  42           HD2      PRO  42  88.786   4.868   2.158
  345    HD3  PRO  42           HD1      PRO  42  89.582   5.922   0.969
  346    HA   PRO  43           HA       PRO  43  91.586   4.387   7.520
  347    HB2  PRO  43           HB2      PRO  43  91.689   6.494   9.331
  348    HB3  PRO  43           HB1      PRO  43  93.108   5.731   8.590
  349    HG2  PRO  43           HG2      PRO  43  91.731   8.261   7.867
  350    HG3  PRO  43           HG1      PRO  43  93.459   7.870   7.860
  351    HD2  PRO  43           HD2      PRO  43  91.991   7.957   5.572
  352    HD3  PRO  43           HD1      PRO  43  93.357   6.836   5.778
  353    H    LYS  44           HN       LYS  44  89.919   3.825   8.978
  354    HA   LYS  44           HA       LYS  44  87.549   5.629   9.109
  355    HB2  LYS  44           HB2      LYS  44  87.623   3.402   7.452
  356    HB3  LYS  44           HB1      LYS  44  86.848   2.776   8.905
  357    HG2  LYS  44           HG2      LYS  44  85.047   3.627   7.635
  358    HG3  LYS  44           HG1      LYS  44  85.380   4.910   8.799
  359    HD2  LYS  44           HD2      LYS  44  87.060   5.682   6.851
  360    HD3  LYS  44           HD1      LYS  44  85.865   4.845   5.859
  361    HE2  LYS  44           HE2      LYS  44  85.024   7.040   5.966
  362    HE3  LYS  44           HE1      LYS  44  84.113   6.200   7.221
  363    HZ1  LYS  44           HZ1      LYS  44  86.632   7.299   8.101
  364    HZ2  LYS  44           HZ2      LYS  44  85.100   7.369   8.831
  365    HZ3  LYS  44           HZ3      LYS  44  85.507   8.466   7.599
  366    H    LYS  45           HN       LYS  45  86.734   5.746  11.153
  367    HA   LYS  45           HA       LYS  45  86.702   3.573  13.020
  368    HB2  LYS  45           HB2      LYS  45  88.359   4.584  14.655
  369    HB3  LYS  45           HB1      LYS  45  89.077   3.847  13.224
  370    HG2  LYS  45           HG2      LYS  45  88.438   6.596  12.650
  371    HG3  LYS  45           HG1      LYS  45  89.398   6.518  14.128
  372    HD2  LYS  45           HD2      LYS  45  90.170   5.003  11.629
  373    HD3  LYS  45           HD1      LYS  45  90.714   6.653  11.934
  374    HE2  LYS  45           HE2      LYS  45  92.006   6.031  13.775
  375    HE3  LYS  45           HE1      LYS  45  91.066   4.567  14.065
  376    HZ1  LYS  45           HZ1      LYS  45  92.610   3.482  12.931
  377    HZ2  LYS  45           HZ2      LYS  45  93.379   4.922  12.461
  378    HZ3  LYS  45           HZ3      LYS  45  92.103   4.295  11.531
  379    H    GLY  46           HN       GLY  46  84.561   4.844  12.636
  380    HA2  GLY  46           HA2      GLY  46  84.066   6.435  15.020
  381    HA3  GLY  46           HA1      GLY  46  83.989   7.399  13.544
  382    H    VAL  47           HN       VAL  47  82.178   5.473  15.609
  383    HA   VAL  47           HA       VAL  47  80.328   4.438  13.573
  384    HB   VAL  47           HB       VAL  47  79.082   3.537  15.461
  385   HG11  VAL  47          HG11      VAL  47  80.752   2.081  16.351
  386   HG12  VAL  47          HG12      VAL  47  82.017   3.292  16.150
  387   HG13  VAL  47          HG13      VAL  47  81.312   2.512  14.735
  388   HG21  VAL  47          HG21      VAL  47  79.111   5.348  17.021
  389   HG22  VAL  47          HG22      VAL  47  80.874   5.383  17.055
  390   HG23  VAL  47          HG23      VAL  47  80.004   4.041  17.798
  391    H    GLN  48           HN       GLN  48  78.163   5.179  13.306
  392    HA   GLN  48           HA       GLN  48  76.606   6.916  12.994
  393    HB2  GLN  48           HB2      GLN  48  76.330   6.141  15.444
  394    HB3  GLN  48           HB1      GLN  48  77.201   7.614  15.873
  395    HG2  GLN  48           HG2      GLN  48  75.488   8.848  14.396
  396    HG3  GLN  48           HG1      GLN  48  74.542   7.361  14.463
  397   HE21  GLN  48          HE21      GLN  48  76.098   7.264  17.333
  398   HE22  GLN  48          HE22      GLN  48  75.003   8.119  18.309
  399    H    GLY  49           HN       GLY  49  79.102   7.684  12.059
  400    HA2  GLY  49           HA2      GLY  49  78.922  10.576  12.321
  401    HA3  GLY  49           HA1      GLY  49  80.377   9.922  13.072
  402    H1U  RCY  50           H1U      RCY  50  81.252   5.812   3.369
  403    H1S  RCY  50           H1S      RCY  50  81.412   8.565   6.589
  404    HB1  RCY  50           HB1      RCY  50  80.287  10.200   6.809
  405    HB2  RCY  50           HB2      RCY  50  78.922  10.488   7.887
  406    HA   RCY  50           HA       RCY  50  81.774  10.171   8.862
  407    HN1  RCY  50           HN1      RCY  50  79.707  11.512  10.465
  408    H    GLY  51           HN       GLY  51  81.224  11.651   6.466
  409    HA2  GLY  51           HA2      GLY  51  82.557  14.058   6.894
  410    HA3  GLY  51           HA1      GLY  51  81.424  13.820   5.561
  411    H    ASP  52           HN       ASP  52  79.011  13.823   6.458
  412    HA   ASP  52           HA       ASP  52  78.230  15.276   8.726
  413    HB2  ASP  52           HB2      ASP  52  77.731  17.514   7.406
  414    HB3  ASP  52           HB1      ASP  52  79.312  17.261   8.143
  415    H    ASP  53           HN       ASP  53  77.733  14.490   5.362
  416    HA   ASP  53           HA       ASP  53  75.149  13.456   5.661
  417    HB2  ASP  53           HB2      ASP  53  73.962  15.485   4.417
  418    HB3  ASP  53           HB1      ASP  53  74.087  15.461   6.176
  419    H    ILE  54           HN       ILE  54  77.714  14.692   3.800
  420    HA   ILE  54           HA       ILE  54  76.538  14.239   1.182
  421    HB   ILE  54           HB       ILE  54  78.383  15.820   1.430
  422   HG12  ILE  54          HG12      ILE  54  79.430  13.401  -0.059
  423   HG13  ILE  54          HG11      ILE  54  78.109  14.394  -0.676
  424   HG21  ILE  54          HG21      ILE  54  80.212  13.500   2.037
  425   HG22  ILE  54          HG22      ILE  54  79.407  14.383   3.335
  426   HG23  ILE  54          HG23      ILE  54  80.514  15.225   2.250
  427   HD11  ILE  54          HD11      ILE  54  80.449  15.016  -1.498
  428   HD12  ILE  54          HD12      ILE  54  80.771  15.570   0.145
  429   HD13  ILE  54          HD13      ILE  54  79.498  16.332  -0.808
  430    HA   PRO  55           HA       PRO  55  77.250   9.797   1.543
  431    HB2  PRO  55           HB2      PRO  55  76.026   9.043  -0.754
  432    HB3  PRO  55           HB1      PRO  55  75.111   9.579   0.669
  433    HG2  PRO  55           HG2      PRO  55  75.787  11.083  -1.809
  434    HG3  PRO  55           HG1      PRO  55  74.287  11.074  -0.867
  435    HD2  PRO  55           HD2      PRO  55  76.208  13.058  -0.690
  436    HD3  PRO  55           HD1      PRO  55  75.049  12.676   0.603
  437    H    GLY  56           HN       GLY  56  79.335  11.596   0.368
  438    HA2  GLY  56           HA2      GLY  56  81.418  11.070  -0.649
  439    HA3  GLY  56           HA1      GLY  56  80.734   9.537  -1.193
  440    H    MET  57           HN       MET  57  79.126  12.600  -1.751
  441    HA   MET  57           HA       MET  57  78.823  13.852  -3.719
  442    HB2  MET  57           HB2      MET  57  81.379  13.125  -4.005
  443    HB3  MET  57           HB1      MET  57  80.701  12.122  -5.287
  444    HG2  MET  57           HG2      MET  57  81.292  14.226  -6.290
  445    HG3  MET  57           HG1      MET  57  79.534  14.200  -6.155
  446    HE1  MET  57           HE1      MET  57  82.770  14.929  -4.504
  447    HE2  MET  57           HE2      MET  57  82.601  16.473  -3.672
  448    HE3  MET  57           HE3      MET  57  82.654  16.429  -5.433
  449    H    GLU  58           HN       GLU  58  76.971  11.982  -3.139
  450    HA   GLU  58           HA       GLU  58  76.272  10.909  -5.830
  451    HB2  GLU  58           HB2      GLU  58  75.850   9.314  -3.290
  452    HB3  GLU  58           HB1      GLU  58  75.626   8.772  -4.953
  453    HG2  GLU  58           HG2      GLU  58  78.270   9.580  -3.705
  454    HG3  GLU  58           HG1      GLU  58  77.754   7.926  -4.034
  455    H    GLY  59           HN       GLY  59  74.147   9.688  -3.601
  456    HA2  GLY  59           HA2      GLY  59  72.131  10.528  -2.643
  457    HA3  GLY  59           HA1      GLY  59  72.531  12.129  -3.268
  458    H1U  RCY  60           H1U      RCY  60  72.839   4.933  -2.236
  459    H1S  RCY  60           H1S      RCY  60  72.252   5.783  -6.182
  460    HB1  RCY  60           HB1      RCY  60  69.732   7.604  -7.229
  461    HB2  RCY  60           HB2      RCY  60  70.460   7.225  -5.668
  462    HA   RCY  60           HA       RCY  60  70.513   9.996  -6.888
  463    HN1  RCY  60           HN1      RCY  60  71.473   8.897  -4.328
  464    H    GLY  61           HN       GLY  61  68.748   7.720  -4.817
  465    HA2  GLY  61           HA2      GLY  61  66.230   9.032  -5.400
  466    HA3  GLY  61           HA1      GLY  61  66.458   7.709  -4.254
  467    H    THR  62           HN       THR  62  68.720   9.859  -3.367
  468    HA   THR  62           HA       THR  62  68.904  11.322  -1.552
  469    HB   THR  62           HB       THR  62  67.466  13.198  -1.572
  470    HG1  THR  62           HG1      THR  62  65.390  12.853  -2.829
  471   HG21  THR  62          HG21      THR  62  67.289  12.028  -4.362
  472   HG22  THR  62          HG22      THR  62  68.709  12.841  -3.705
  473   HG23  THR  62          HG23      THR  62  67.208  13.737  -3.934
  474    H    ASP  63           HN       ASP  63  66.716   8.834  -1.594
  475    HA   ASP  63           HA       ASP  63  65.208   9.388   0.812
  476    HB2  ASP  63           HB2      ASP  63  64.572   7.653  -0.894
  477    HB3  ASP  63           HB1      ASP  63  65.947   6.687  -0.359
  478    H    ILE  64           HN       ILE  64  68.308   9.550   0.665
  479    HA   ILE  64           HA       ILE  64  68.859   7.871   3.081
  480    HB   ILE  64           HB       ILE  64  70.189   7.174   1.136
  481   HG12  ILE  64          HG12      ILE  64  71.753   8.751   3.204
  482   HG13  ILE  64          HG11      ILE  64  71.294   7.051   3.305
  483   HG21  ILE  64          HG21      ILE  64  71.021   8.651  -0.354
  484   HG22  ILE  64          HG22      ILE  64  71.824   9.572   0.918
  485   HG23  ILE  64          HG23      ILE  64  70.139   9.905   0.517
  486   HD11  ILE  64          HD11      ILE  64  73.525   6.964   2.553
  487   HD12  ILE  64          HD12      ILE  64  73.313   8.348   1.481
  488   HD13  ILE  64          HD13      ILE  64  72.589   6.793   1.068
  489    H    THR  65           HN       THR  65  71.078  10.277   1.963
  490    HA   THR  65           HA       THR  65  71.531  12.473   2.715
  491    HB   THR  65           HB       THR  65  69.574  12.218   4.977
  492    HG1  THR  65           HG1      THR  65  68.813  12.946   2.357
  493   HG21  THR  65          HG21      THR  65  69.320  14.597   4.591
  494   HG22  THR  65          HG22      THR  65  70.240  14.493   3.090
  495   HG23  THR  65          HG23      THR  65  71.043  14.224   4.637
  496    H    VAL  66           HN       VAL  66  70.851   9.950   5.127
  497    HA   VAL  66           HA       VAL  66  73.596  10.270   6.162
  498    HB   VAL  66           HB       VAL  66  72.510  10.253   8.556
  499   HG11  VAL  66          HG11      VAL  66  72.676  12.665   8.638
  500   HG12  VAL  66          HG12      VAL  66  72.393  12.790   6.901
  501   HG13  VAL  66          HG13      VAL  66  73.893  12.082   7.502
  502   HG21  VAL  66          HG21      VAL  66  70.355  11.745   7.052
  503   HG22  VAL  66          HG22      VAL  66  70.351  11.226   8.738
  504   HG23  VAL  66          HG23      VAL  66  70.188  10.034   7.448
  505    H    ILE  67           HN       ILE  67  70.452   8.630   6.461
  506    HA   ILE  67           HA       ILE  67  71.939   6.063   6.852
  507    HB   ILE  67           HB       ILE  67  69.436   7.021   8.266
  508   HG12  ILE  67          HG12      ILE  67  72.050   5.973   9.385
  509   HG13  ILE  67          HG11      ILE  67  71.726   7.690   9.137
  510   HG21  ILE  67          HG21      ILE  67  69.009   4.740   7.711
  511   HG22  ILE  67          HG22      ILE  67  69.608   4.716   9.369
  512   HG23  ILE  67          HG23      ILE  67  70.678   4.273   8.038
  513   HD11  ILE  67          HD11      ILE  67  71.198   7.085  11.448
  514   HD12  ILE  67          HD12      ILE  67  70.125   5.802  10.889
  515   HD13  ILE  67          HD13      ILE  67  69.713   7.490  10.588
  516    H1U  RCY  68           H1U      RCY  68  73.091   1.461  -2.325
  517    H1S  RCY  68           H1S      RCY  68  73.764   3.746   1.364
  518    HB1  RCY  68           HB1      RCY  68  70.931   5.250   1.818
  519    HB2  RCY  68           HB2      RCY  68  70.416   3.574   1.991
  520    HA   RCY  68           HA       RCY  68  69.200   5.588   3.299
  521    HN1  RCY  68           HN1      RCY  68  71.666   5.271   4.783
  522    HA   PRO  69           HA       PRO  69  66.658   2.559   5.370
  523    HB2  PRO  69           HB2      PRO  69  65.927   1.961   2.517
  524    HB3  PRO  69           HB1      PRO  69  64.869   2.158   3.929
  525    HG2  PRO  69           HG2      PRO  69  65.210   4.111   2.134
  526    HG3  PRO  69           HG1      PRO  69  64.980   4.449   3.856
  527    HD2  PRO  69           HD2      PRO  69  67.419   4.754   2.211
  528    HD3  PRO  69           HD1      PRO  69  67.012   5.503   3.770
  529    H    TRP  70           HN       TRP  70  68.460   1.618   2.440
  530    HA   TRP  70           HA       TRP  70  68.461  -1.204   3.205
  531    HD1  TRP  70           HD1      TRP  70  66.653  -1.154   0.967
  532    HE1  TRP  70           HE1      TRP  70  65.445   0.502  -0.594
  533    HE3  TRP  70           HE3      TRP  70  70.509   2.015  -0.107
  534    HZ2  TRP  70           HZ2      TRP  70  66.037   2.864  -2.103
  535    HZ3  TRP  70           HZ3      TRP  70  70.162   3.955  -1.605
  536    HH2  TRP  70           HH2      TRP  70  67.935   4.385  -2.604
  537    HB2  TRP  70           HB2      TRP  70  70.376  -0.109   1.178
  538    HB3  TRP  70           HB1      TRP  70  69.443  -1.605   1.144
  539    H    GLU  71           HN       GLU  71  69.554   0.530   5.233
  540    HA   GLU  71           HA       GLU  71  72.177  -0.774   5.521
  541    HB2  GLU  71           HB2      GLU  71  73.524   1.093   5.436
  542    HB3  GLU  71           HB1      GLU  71  72.271   1.631   4.328
  543    HG2  GLU  71           HG2      GLU  71  72.408   3.449   5.794
  544    HG3  GLU  71           HG1      GLU  71  71.096   2.512   6.510
  545    H    ALA  72           HN       ALA  72  69.343   0.582   6.784
  546    HA   ALA  72           HA       ALA  72  70.082   1.300   9.416
  547    HB1  ALA  72           HB1      ALA  72  67.723   0.574  10.012
  548    HB2  ALA  72           HB2      ALA  72  67.557   0.017   8.347
  549    HB3  ALA  72           HB3      ALA  72  67.835   1.726   8.681
  550    H1U  RCY  73           H1U      RCY  73  73.608   0.010   2.990
  551    H1S  RCY  73           H1S      RCY  73  71.712  -1.689   6.489
  552    HB1  RCY  73           HB1      RCY  73  71.380  -5.016   8.766
  553    HB2  RCY  73           HB2      RCY  73  72.529  -3.709   8.477
  554    HA   RCY  73           HA       RCY  73  69.848  -3.610   9.836
  555    HN1  RCY  73           HN1      RCY  73  70.488  -1.680   7.913
  556    H    ASN  74           HN       ASN  74  72.522  -1.308   9.801
  557    HA   ASN  74           HA       ASN  74  74.133  -0.792  11.429
  558    HB2  ASN  74           HB2      ASN  74  71.913  -0.207  12.546
  559    HB3  ASN  74           HB1      ASN  74  72.035  -1.753  13.386
  560   HD21  ASN  74          HD21      ASN  74  73.314   1.511  13.233
  561   HD22  ASN  74          HD22      ASN  74  74.360   1.369  14.562
  562    H    HIS  75           HN       HIS  75  75.162  -1.789  13.575
  563    HA   HIS  75           HA       HIS  75  76.380  -3.564  14.491
  564    HD1  HIS  75           HD1      HIS  75  75.712  -7.561  13.987
  565    HD2  HIS  75           HD2      HIS  75  75.591  -4.704  17.024
  566    HE1  HIS  75           HE1      HIS  75  76.774  -8.633  16.021
  567    HE2  HIS  75           HE2      HIS  75  76.706  -6.905  17.877
  568    HB2  HIS  75           HB2      HIS  75  73.897  -4.444  14.589
  569    HB3  HIS  75           HB1      HIS  75  74.430  -5.518  13.296
  570    H1U  RCY  76           H1U      RCY  76  75.267  -3.077   2.795
  571    H1S  RCY  76           H1S      RCY  76  75.570  -1.095   7.189
  572    HB1  RCY  76           HB1      RCY  76  75.796  -4.932   8.765
  573    HB2  RCY  76           HB2      RCY  76  77.267  -4.251   8.077
  574    HA   RCY  76           HA       RCY  76  77.456  -5.491  10.345
  575    HN1  RCY  76           HN1      RCY  76  75.828  -3.191  11.192
  576    H    GLU  77           HN       GLU  77  77.881  -2.093  11.053
  577    HA   GLU  77           HA       GLU  77  80.299  -1.557   9.699
  578    HB2  GLU  77           HB2      GLU  77  79.157   0.224  10.858
  579    HB3  GLU  77           HB1      GLU  77  79.295  -0.618  12.401
  580    HG2  GLU  77           HG2      GLU  77  81.803   0.002  10.882
  581    HG3  GLU  77           HG1      GLU  77  81.006   1.306  11.762
  582    H    LEU  78           HN       LEU  78  79.685  -3.890  12.069
  583    HA   LEU  78           HA       LEU  78  81.922  -4.024  13.700
  584    HG   LEU  78           HG       LEU  78  80.991  -7.285  14.747
  585    HB2  LEU  78           HB2      LEU  78  79.870  -5.757  13.041
  586    HB3  LEU  78           HB1      LEU  78  81.285  -6.627  12.458
  587   HD11  LEU  78          HD11      LEU  78  83.310  -6.260  13.846
  588   HD12  LEU  78          HD12      LEU  78  83.132  -6.884  15.486
  589   HD13  LEU  78          HD13      LEU  78  83.022  -5.150  15.186
  590   HD21  LEU  78          HD21      LEU  78  80.270  -4.431  15.043
  591   HD22  LEU  78          HD22      LEU  78  81.207  -5.100  16.379
  592   HD23  LEU  78          HD23      LEU  78  79.672  -5.839  15.921
  593    H    HIS  79           HN       HIS  79  84.016  -3.699  13.099
  594    HA   HIS  79           HA       HIS  79  85.003  -4.229  10.435
  595    HD1  HIS  79           HD1      HIS  79  86.782  -2.260   9.535
  596    HD2  HIS  79           HD2      HIS  79  85.217  -1.032  13.201
  597    HE1  HIS  79           HE1      HIS  79  86.184   0.188   9.274
  598    HE2  HIS  79           HE2      HIS  79  85.230   0.947  11.499
  599    HB2  HIS  79           HB2      HIS  79  86.349  -3.588  13.065
  600    HB3  HIS  79           HB1      HIS  79  87.276  -3.899  11.597
  601    H    GLU  80           HN       GLU  80  83.769  -6.569  11.615
  602    HA   GLU  80           HA       GLU  80  86.003  -8.355  12.335
  603    HB2  GLU  80           HB2      GLU  80  83.862  -8.623  13.503
  604    HB3  GLU  80           HB1      GLU  80  83.041  -8.899  11.966
  605    HG2  GLU  80           HG2      GLU  80  84.248 -10.943  11.593
  606    HG3  GLU  80           HG1      GLU  80  85.332 -10.618  12.946
  607    H    LEU  81           HN       LEU  81  84.013  -7.577   9.554
  608    HA   LEU  81           HA       LEU  81  85.101  -9.907   8.065
  609    HG   LEU  81           HG       LEU  81  83.228  -6.866   8.086
  610    HB2  LEU  81           HB2      LEU  81  83.551  -8.753   6.230
  611    HB3  LEU  81           HB1      LEU  81  82.866  -9.778   7.491
  612   HD11  LEU  81          HD11      LEU  81  80.852  -6.569   7.146
  613   HD12  LEU  81          HD12      LEU  81  81.148  -8.057   6.247
  614   HD13  LEU  81          HD13      LEU  81  82.166  -6.643   5.972
  615   HD21  LEU  81          HD21      LEU  81  80.960  -8.771   8.719
  616   HD22  LEU  81          HD22      LEU  81  81.340  -7.246   9.520
  617   HD23  LEU  81          HD23      LEU  81  82.404  -8.638   9.723
  618    H    ALA  82           HN       ALA  82  85.709  -6.568   8.541
  619    HA   ALA  82           HA       ALA  82  86.770  -5.908   5.947
  620    HB1  ALA  82           HB1      ALA  82  86.222  -4.179   7.621
  621    HB2  ALA  82           HB2      ALA  82  87.913  -4.058   7.133
  622    HB3  ALA  82           HB3      ALA  82  87.492  -4.795   8.679
  623    H    GLN  83           HN       GLN  83  89.400  -4.977   6.772
  624    HA   GLN  83           HA       GLN  83  91.608  -5.754   6.705
  625    HB2  GLN  83           HB2      GLN  83  90.282  -7.718   8.575
  626    HB3  GLN  83           HB1      GLN  83  91.986  -7.874   8.154
  627    HG2  GLN  83           HG2      GLN  83  91.640  -6.551  10.238
  628    HG3  GLN  83           HG1      GLN  83  92.433  -5.615   8.970
  629   HE21  GLN  83          HE21      GLN  83  91.152  -3.947   7.869
  630   HE22  GLN  83          HE22      GLN  83  89.700  -3.376   8.537
  631    H    TYR  84           HN       TYR  84  89.069  -7.437   5.324
  632    HA   TYR  84           HA       TYR  84  90.713  -8.614   3.300
  633    HD1  TYR  84           HD2      TYR  84  87.771 -11.024   5.268
  634    HD2  TYR  84           HD1      TYR  84  91.521  -9.822   6.985
  635    HE1  TYR  84           HE2      TYR  84  86.799 -11.237   7.540
  636    HE2  TYR  84           HE1      TYR  84  90.549 -10.035   9.257
  637    HH   TYR  84           HH       TYR  84  88.026 -11.702  10.027
  638    HB2  TYR  84           HB2      TYR  84  89.899 -11.052   3.958
  639    HB3  TYR  84           HB1      TYR  84  91.374 -10.386   4.653
  640    H    GLY  85           HN       GLY  85  88.467  -6.969   3.266
  641    HA2  GLY  85           HA2      GLY  85  86.476  -8.740   1.922
  642    HA3  GLY  85           HA1      GLY  85  85.925  -7.501   3.052
  643    H    ILE  86           HN       ILE  86  88.486  -7.386   0.563
  644    HA   ILE  86           HA       ILE  86  88.103  -4.759  -0.250
  645    HB   ILE  86           HB       ILE  86  89.194  -5.298  -2.314
  646   HG12  ILE  86          HG12      ILE  86  87.638  -7.081  -3.024
  647   HG13  ILE  86          HG11      ILE  86  89.312  -7.620  -3.158
  648   HG21  ILE  86          HG21      ILE  86  90.028  -7.281  -0.175
  649   HG22  ILE  86          HG22      ILE  86  90.596  -5.619  -0.328
  650   HG23  ILE  86          HG23      ILE  86  91.016  -6.811  -1.558
  651   HD11  ILE  86          HD11      ILE  86  88.295  -9.433  -2.078
  652   HD12  ILE  86          HD12      ILE  86  87.235  -8.395  -1.124
  653   HD13  ILE  86          HD13      ILE  86  88.949  -8.511  -0.724
  654    H1U  RCY  87           H1U      RCY  87  82.913   2.448   1.627
  655    H1S  RCY  87           H1S      RCY  87  85.178  -0.644  -0.094
  656    HB1  RCY  87           HB1      RCY  87  83.522  -2.760  -3.139
  657    HB2  RCY  87           HB2      RCY  87  85.188  -2.235  -2.892
  658    HA   RCY  87           HA       RCY  87  84.129  -4.971  -2.126
  659    HN1  RCY  87           HN1      RCY  87  86.728  -3.687  -1.703
  Start of MODEL   50
    1    HA   MET   1           HA       MET   1  62.841   4.470 -13.091
    2    HB2  MET   1           HB2      MET   1  64.219   6.585 -13.539
    3    HB3  MET   1           HB1      MET   1  64.030   6.218 -15.254
    4    HG2  MET   1           HG2      MET   1  61.507   6.071 -14.773
    5    HG3  MET   1           HG1      MET   1  61.876   6.852 -13.235
    6    HE1  MET   1           HE1      MET   1  63.223  10.219 -13.980
    7    HE2  MET   1           HE2      MET   1  63.428   8.743 -13.040
    8    HE3  MET   1           HE3      MET   1  61.865   9.555 -13.062
    9    H    ASN   2           HN       ASN   2  64.215   4.706 -16.388
   10    HA   ASN   2           HA       ASN   2  61.938   3.683 -17.712
   11    HB2  ASN   2           HB2      ASN   2  63.542   3.122 -19.570
   12    HB3  ASN   2           HB1      ASN   2  63.702   4.773 -18.969
   13   HD21  ASN   2          HD21      ASN   2  65.603   5.287 -17.653
   14   HD22  ASN   2          HD22      ASN   2  66.952   4.256 -17.617
   15    H    LEU   3           HN       LEU   3  62.311   1.489 -19.116
   16    HA   LEU   3           HA       LEU   3  62.063  -0.657 -17.224
   17    HG   LEU   3           HG       LEU   3  60.106  -0.468 -18.492
   18    HB2  LEU   3           HB2      LEU   3  62.120  -0.393 -20.195
   19    HB3  LEU   3           HB1      LEU   3  62.474  -1.990 -19.540
   20   HD11  LEU   3          HD11      LEU   3  58.771  -1.730 -20.282
   21   HD12  LEU   3          HD12      LEU   3  60.305  -1.943 -21.125
   22   HD13  LEU   3          HD13      LEU   3  59.677  -0.321 -20.832
   23   HD21  LEU   3          HD21      LEU   3  59.252  -2.776 -18.200
   24   HD22  LEU   3          HD22      LEU   3  60.813  -2.565 -17.407
   25   HD23  LEU   3          HD23      LEU   3  60.717  -3.406 -18.954
   26    H    GLU   4           HN       GLU   4  64.121  -0.353 -16.037
   27    HA   GLU   4           HA       GLU   4  66.604  -1.010 -17.462
   28    HB2  GLU   4           HB2      GLU   4  66.423   0.636 -15.516
   29    HB3  GLU   4           HB1      GLU   4  66.225  -0.772 -14.472
   30    HG2  GLU   4           HG2      GLU   4  68.378  -1.661 -15.186
   31    HG3  GLU   4           HG1      GLU   4  68.569  -0.347 -16.347
   32    HA   PRO   5           HA       PRO   5  66.036  -5.461 -17.223
   33    HB2  PRO   5           HB2      PRO   5  68.986  -5.262 -16.694
   34    HB3  PRO   5           HB1      PRO   5  68.110  -6.365 -17.776
   35    HG2  PRO   5           HG2      PRO   5  69.380  -4.205 -18.700
   36    HG3  PRO   5           HG1      PRO   5  67.861  -4.771 -19.413
   37    HD2  PRO   5           HD2      PRO   5  68.364  -2.356 -17.775
   38    HD3  PRO   5           HD1      PRO   5  67.031  -2.697 -18.899
   39    HA   PRO   6           HA       PRO   6  66.251  -5.425 -12.645
   40    HB2  PRO   6           HB2      PRO   6  63.855  -6.566 -12.167
   41    HB3  PRO   6           HB1      PRO   6  63.992  -4.866 -12.662
   42    HG2  PRO   6           HG2      PRO   6  63.189  -7.235 -14.257
   43    HG3  PRO   6           HG1      PRO   6  62.612  -5.564 -14.342
   44    HD2  PRO   6           HD2      PRO   6  64.511  -6.731 -16.060
   45    HD3  PRO   6           HD1      PRO   6  64.200  -4.991 -15.885
   46    H    LYS   7           HN       LYS   7  67.280  -7.031 -11.503
   47    HA   LYS   7           HA       LYS   7  67.307  -9.767 -12.626
   48    HB2  LYS   7           HB2      LYS   7  69.430  -8.664 -11.902
   49    HB3  LYS   7           HB1      LYS   7  68.817  -8.631 -10.251
   50    HG2  LYS   7           HG2      LYS   7  68.671 -11.271 -11.574
   51    HG3  LYS   7           HG1      LYS   7  70.306 -10.680 -11.276
   52    HD2  LYS   7           HD2      LYS   7  68.257 -10.502  -9.089
   53    HD3  LYS   7           HD1      LYS   7  69.054 -12.043  -9.404
   54    HE2  LYS   7           HE2      LYS   7  71.261 -10.927  -9.179
   55    HE3  LYS   7           HE1      LYS   7  70.439  -9.414  -8.798
   56    HZ1  LYS   7           HZ1      LYS   7  70.731 -11.831  -7.186
   57    HZ2  LYS   7           HZ2      LYS   7  69.272 -10.973  -7.042
   58    HZ3  LYS   7           HZ3      LYS   7  70.749 -10.202  -6.711
   59    H    ALA   8           HN       ALA   8  65.780  -7.974 -10.124
   60    HA   ALA   8           HA       ALA   8  65.123 -10.400  -8.554
   61    HB1  ALA   8           HB1      ALA   8  64.189  -7.552  -8.105
   62    HB2  ALA   8           HB2      ALA   8  65.692  -8.198  -7.447
   63    HB3  ALA   8           HB3      ALA   8  64.145  -8.884  -6.950
   64    H    GLU   9           HN       GLU   9  63.493 -11.606  -9.405
   65    HA   GLU   9           HA       GLU   9  61.057 -10.164 -10.386
   66    HB2  GLU   9           HB2      GLU   9  62.552 -11.292 -12.180
   67    HB3  GLU   9           HB1      GLU   9  61.968 -12.815 -11.507
   68    HG2  GLU   9           HG2      GLU   9  60.453 -12.311 -13.267
   69    HG3  GLU   9           HG1      GLU   9  59.605 -11.842 -11.793
   70    H1U  RCY  10           H1U      RCY  10  56.936 -11.092  -2.364
   71    H1S  RCY  10           H1S      RCY  10  61.437 -11.114  -4.031
   72    HB1  RCY  10           HB1      RCY  10  61.618 -13.929  -7.353
   73    HB2  RCY  10           HB2      RCY  10  60.312 -14.528  -6.332
   74    HA   RCY  10           HA       RCY  10  59.139 -13.004  -7.629
   75    HN1  RCY  10           HN1      RCY  10  61.198 -10.896  -7.757
   76    H    ARG  11           HN       ARG  11  59.584 -10.036  -7.037
   77    HA   ARG  11           HA       ARG  11  59.653  -9.419  -4.328
   78    HE   ARG  11           HE       ARG  11  57.561  -5.966  -6.632
   79    HB2  ARG  11           HB2      ARG  11  59.255  -7.877  -6.387
   80    HB3  ARG  11           HB1      ARG  11  57.545  -8.204  -6.115
   81    HG2  ARG  11           HG2      ARG  11  58.612  -7.604  -3.574
   82    HG3  ARG  11           HG1      ARG  11  59.299  -6.406  -4.672
   83    HD2  ARG  11           HD2      ARG  11  56.372  -7.019  -4.211
   84    HD3  ARG  11           HD1      ARG  11  57.215  -5.501  -3.905
   85   HH11  ARG  11          HH21      ARG  11  54.947  -5.703  -4.400
   86   HH12  ARG  11          HH22      ARG  11  53.840  -5.059  -5.567
   87   HH21  ARG  11          HH11      ARG  11  56.132  -5.127  -8.168
   88   HH22  ARG  11          HH12      ARG  11  54.511  -4.733  -7.700
   89    H    SER  12           HN       SER  12  57.751  -8.926  -2.855
   90    HA   SER  12           HA       SER  12  55.859  -9.653  -1.679
   91    HG   SER  12           HG       SER  12  53.901 -10.008  -1.807
   92    HB2  SER  12           HB2      SER  12  54.893  -9.204  -4.080
   93    HB3  SER  12           HB1      SER  12  54.828 -10.961  -4.186
   94    H    ALA  13           HN       ALA  13  58.264 -11.482  -2.438
   95    HA   ALA  13           HA       ALA  13  57.088 -14.163  -2.289
   96    HB1  ALA  13           HB1      ALA  13  59.576 -14.785  -1.940
   97    HB2  ALA  13           HB2      ALA  13  59.909 -13.085  -2.273
   98    HB3  ALA  13           HB3      ALA  13  59.124 -14.086  -3.495
   99    H    THR  14           HN       THR  14  59.659 -12.847  -0.203
  100    HA   THR  14           HA       THR  14  58.541 -14.309   2.082
  101    HB   THR  14           HB       THR  14  60.524 -13.600   3.264
  102    HG1  THR  14           HG1      THR  14  61.149 -11.651   2.863
  103   HG21  THR  14          HG21      THR  14  61.379 -14.005   0.392
  104   HG22  THR  14          HG22      THR  14  60.725 -15.309   1.383
  105   HG23  THR  14          HG23      THR  14  62.225 -14.511   1.854
  106    H    ARG  15           HN       ARG  15  59.917 -11.435   3.153
  107    HA   ARG  15           HA       ARG  15  57.537  -9.760   3.066
  108    HE   ARG  15           HE       ARG  15  54.013  -8.843   6.937
  109    HB2  ARG  15           HB2      ARG  15  57.033 -11.559   4.822
  110    HB3  ARG  15           HB1      ARG  15  58.322 -10.836   5.784
  111    HG2  ARG  15           HG2      ARG  15  57.173  -8.752   5.942
  112    HG3  ARG  15           HG1      ARG  15  56.027  -9.205   4.680
  113    HD2  ARG  15           HD2      ARG  15  54.984 -10.840   6.096
  114    HD3  ARG  15           HD1      ARG  15  56.259 -10.694   7.306
  115   HH11  ARG  15          HH21      ARG  15  57.185  -9.420   8.159
  116   HH12  ARG  15          HH22      ARG  15  57.097  -8.169   9.353
  117   HH21  ARG  15          HH11      ARG  15  53.879  -7.206   8.490
  118   HH22  ARG  15          HH12      ARG  15  55.225  -6.915   9.541
  119    H    VAL  16           HN       VAL  16  60.052  -9.133   2.241
  120    HA   VAL  16           HA       VAL  16  61.564  -7.841   4.396
  121    HB   VAL  16           HB       VAL  16  61.943  -7.452   1.420
  122   HG11  VAL  16          HG11      VAL  16  63.214  -5.965   2.918
  123   HG12  VAL  16          HG12      VAL  16  64.293  -7.106   2.117
  124   HG13  VAL  16          HG13      VAL  16  63.827  -7.365   3.798
  125   HG21  VAL  16          HG21      VAL  16  61.911  -9.833   1.721
  126   HG22  VAL  16          HG22      VAL  16  62.832  -9.719   3.221
  127   HG23  VAL  16          HG23      VAL  16  63.610  -9.363   1.679
  128    H    MET  17           HN       MET  17  60.116  -6.553   1.378
  129    HA   MET  17           HA       MET  17  60.193  -3.837   2.075
  130    HB2  MET  17           HB2      MET  17  58.423  -3.499   0.439
  131    HB3  MET  17           HB1      MET  17  59.514  -4.748  -0.161
  132    HG2  MET  17           HG2      MET  17  57.895  -6.419   0.982
  133    HG3  MET  17           HG1      MET  17  56.758  -5.072   1.019
  134    HE1  MET  17           HE1      MET  17  56.236  -3.645  -0.765
  135    HE2  MET  17           HE2      MET  17  55.983  -4.122  -2.442
  136    HE3  MET  17           HE3      MET  17  57.560  -3.525  -1.931
  137    H    GLY  18           HN       GLY  18  59.156  -2.661   3.616
  138    HA2  GLY  18           HA2      GLY  18  57.127  -3.990   5.286
  139    HA3  GLY  18           HA1      GLY  18  57.863  -2.419   5.606
  140    H    GLY  19           HN       GLY  19  55.038  -2.917   5.733
  141    HA2  GLY  19           HA2      GLY  19  53.729  -2.062   3.309
  142    HA3  GLY  19           HA1      GLY  19  53.006  -2.057   4.918
  143    HA   PRO  20           HA       PRO  20  52.832   2.373   4.918
  144    HB2  PRO  20           HB2      PRO  20  54.003   2.057   7.662
  145    HB3  PRO  20           HB1      PRO  20  52.615   3.030   7.136
  146    HG2  PRO  20           HG2      PRO  20  52.318   0.676   8.382
  147    HG3  PRO  20           HG1      PRO  20  51.187   1.242   7.143
  148    HD2  PRO  20           HD2      PRO  20  53.164  -0.952   6.995
  149    HD3  PRO  20           HD1      PRO  20  51.722  -0.667   5.998
  150    H1U  RCY  21           H1U      RCY  21  61.013   7.184   7.124
  151    H1S  RCY  21           H1S      RCY  21  60.223   3.111   5.024
  152    HB1  RCY  21           HB1      RCY  21  58.570   0.450   4.180
  153    HB2  RCY  21           HB2      RCY  21  57.751  -0.060   5.655
  154    HA   RCY  21           HA       RCY  21  57.598   2.694   5.819
  155    HN1  RCY  21           HN1      RCY  21  55.728   0.568   5.450
  156    H    THR  22           HN       THR  22  57.248   4.430   4.416
  157    HA   THR  22           HA       THR  22  57.118   3.903   1.506
  158    HB   THR  22           HB       THR  22  56.844   6.455   1.445
  159    HG1  THR  22           HG1      THR  22  55.961   6.609   3.954
  160   HG21  THR  22          HG21      THR  22  54.892   4.677   2.928
  161   HG22  THR  22          HG22      THR  22  54.917   5.027   1.200
  162   HG23  THR  22          HG23      THR  22  54.492   6.295   2.350
  163    HA   PRO  23           HA       PRO  23  61.602   4.235   1.165
  164    HB2  PRO  23           HB2      PRO  23  60.777   5.350  -1.496
  165    HB3  PRO  23           HB1      PRO  23  62.020   4.140  -1.120
  166    HG2  PRO  23           HG2      PRO  23  59.634   3.443  -2.093
  167    HG3  PRO  23           HG1      PRO  23  60.488   2.439  -0.910
  168    HD2  PRO  23           HD2      PRO  23  58.060   4.108  -0.540
  169    HD3  PRO  23           HD1      PRO  23  58.609   2.694   0.386
  170    H    ARG  24           HN       ARG  24  62.560   5.919   2.242
  171    HA   ARG  24           HA       ARG  24  63.195   8.108   2.793
  172    HE   ARG  24           HE       ARG  24  62.972  11.284  -1.423
  173    HB2  ARG  24           HB2      ARG  24  63.689   7.942   0.224
  174    HB3  ARG  24           HB1      ARG  24  62.275   8.983   0.060
  175    HG2  ARG  24           HG2      ARG  24  63.298  10.629   1.582
  176    HG3  ARG  24           HG1      ARG  24  64.709   9.587   1.768
  177    HD2  ARG  24           HD2      ARG  24  65.483  10.951   0.074
  178    HD3  ARG  24           HD1      ARG  24  64.687   9.716  -0.901
  179   HH11  ARG  24          HH21      ARG  24  65.138  12.382   1.024
  180   HH12  ARG  24          HH22      ARG  24  64.558  14.014   0.992
  181   HH21  ARG  24          HH11      ARG  24  62.203  13.409  -1.480
  182   HH22  ARG  24          HH12      ARG  24  62.897  14.596  -0.426
  183    H    LYS  25           HN       LYS  25  61.819   8.997   4.274
  184    HA   LYS  25           HA       LYS  25  59.055   9.284   4.141
  185    HB2  LYS  25           HB2      LYS  25  61.158  10.979   5.493
  186    HB3  LYS  25           HB1      LYS  25  59.439  11.337   5.667
  187    HG2  LYS  25           HG2      LYS  25  58.996   9.280   6.738
  188    HG3  LYS  25           HG1      LYS  25  60.507   8.563   6.178
  189    HD2  LYS  25           HD2      LYS  25  60.527   9.226   8.611
  190    HD3  LYS  25           HD1      LYS  25  61.802   9.977   7.651
  191    HE2  LYS  25           HE2      LYS  25  60.644  12.056   7.552
  192    HE3  LYS  25           HE1      LYS  25  59.143  11.333   8.131
  193    HZ1  LYS  25           HZ1      LYS  25  60.657  10.726  10.161
  194    HZ2  LYS  25           HZ2      LYS  25  59.921  12.252  10.045
  195    HZ3  LYS  25           HZ3      LYS  25  61.555  12.061   9.624
  196    H    GLY  26           HN       GLY  26  61.455  11.762   3.171
  197    HA2  GLY  26           HA2      GLY  26  60.474  12.622   0.795
  198    HA3  GLY  26           HA1      GLY  26  59.326  13.360   1.912
  199    HA   PRO  27           HA       PRO  27  61.756  17.019   2.361
  200    HB2  PRO  27           HB2      PRO  27  61.567  16.402   5.291
  201    HB3  PRO  27           HB1      PRO  27  61.282  17.935   4.444
  202    HG2  PRO  27           HG2      PRO  27  59.273  16.365   5.268
  203    HG3  PRO  27           HG1      PRO  27  59.171  17.339   3.792
  204    HD2  PRO  27           HD2      PRO  27  59.377  14.406   4.071
  205    HD3  PRO  27           HD1      PRO  27  58.832  15.369   2.680
  206    HA   PRO  28           HA       PRO  28  65.835  15.017   2.549
  207    HB2  PRO  28           HB2      PRO  28  66.664  17.892   2.620
  208    HB3  PRO  28           HB1      PRO  28  67.261  16.572   1.597
  209    HG2  PRO  28           HG2      PRO  28  65.603  18.434   0.652
  210    HG3  PRO  28           HG1      PRO  28  65.510  16.747   0.120
  211    HD2  PRO  28           HD2      PRO  28  63.672  18.253   1.921
  212    HD3  PRO  28           HD1      PRO  28  63.326  16.880   0.847
  213    H    LYS  29           HN       LYS  29  67.085  14.460   4.315
  214    HA   LYS  29           HA       LYS  29  67.218  16.322   6.630
  215    HB2  LYS  29           HB2      LYS  29  65.316  14.587   6.877
  216    HB3  LYS  29           HB1      LYS  29  66.602  13.392   7.046
  217    HG2  LYS  29           HG2      LYS  29  67.511  14.545   8.969
  218    HG3  LYS  29           HG1      LYS  29  66.401  15.896   8.740
  219    HD2  LYS  29           HD2      LYS  29  64.486  14.403   9.162
  220    HD3  LYS  29           HD1      LYS  29  65.589  13.045   9.383
  221    HE2  LYS  29           HE2      LYS  29  64.783  14.209  11.520
  222    HE3  LYS  29           HE1      LYS  29  66.526  13.993  11.357
  223    HZ1  LYS  29           HZ1      LYS  29  65.016  16.460  10.682
  224    HZ2  LYS  29           HZ2      LYS  29  66.695  16.251  10.523
  225    HZ3  LYS  29           HZ3      LYS  29  65.976  16.236  12.063
  226    H1U  RCY  30           H1U      RCY  30  73.557  13.650   0.795
  227    H1S  RCY  30           H1S      RCY  30  74.822  13.953   4.774
  228    HB1  RCY  30           HB1      RCY  30  71.404  16.145   5.556
  229    HB2  RCY  30           HB2      RCY  30  71.311  14.408   5.265
  230    HA   RCY  30           HA       RCY  30  70.957  13.942   7.577
  231    HN1  RCY  30           HN1      RCY  30  69.207  16.220   7.671
  232    H    LYS  31           HN       LYS  31  72.550  14.216   9.115
  233    HA   LYS  31           HA       LYS  31  73.420  16.919   9.888
  234    HB2  LYS  31           HB2      LYS  31  72.844  16.507  12.303
  235    HB3  LYS  31           HB1      LYS  31  71.437  16.730  11.265
  236    HG2  LYS  31           HG2      LYS  31  72.396  13.936  11.529
  237    HG3  LYS  31           HG1      LYS  31  71.701  14.642  12.988
  238    HD2  LYS  31           HD2      LYS  31  69.645  15.170  11.838
  239    HD3  LYS  31           HD1      LYS  31  70.340  14.715  10.282
  240    HE2  LYS  31           HE2      LYS  31  68.815  12.999  11.544
  241    HE3  LYS  31           HE1      LYS  31  70.301  12.429  10.784
  242    HZ1  LYS  31           HZ1      LYS  31  70.508  13.398  13.525
  243    HZ2  LYS  31           HZ2      LYS  31  71.305  12.105  12.764
  244    HZ3  LYS  31           HZ3      LYS  31  69.704  11.921  13.301
  245    H    GLN  32           HN       GLN  32  75.083  16.669  11.770
  246    HA   GLN  32           HA       GLN  32  77.103  14.828  10.937
  247    HB2  GLN  32           HB2      GLN  32  78.378  15.614  12.810
  248    HB3  GLN  32           HB1      GLN  32  77.445  16.993  12.231
  249    HG2  GLN  32           HG2      GLN  32  76.824  15.230  14.617
  250    HG3  GLN  32           HG1      GLN  32  77.223  16.948  14.632
  251   HE21  GLN  32          HE21      GLN  32  74.620  14.983  15.010
  252   HE22  GLN  32          HE22      GLN  32  73.397  15.976  14.377
  253    H    ARG  33           HN       ARG  33  77.514  12.736  11.551
  254    HA   ARG  33           HA       ARG  33  75.534  11.418  13.298
  255    HE   ARG  33           HE       ARG  33  75.097   8.968   8.165
  256    HB2  ARG  33           HB2      ARG  33  77.896  10.258  11.788
  257    HB3  ARG  33           HB1      ARG  33  76.615   9.335  12.573
  258    HG2  ARG  33           HG2      ARG  33  74.964  10.144  11.049
  259    HG3  ARG  33           HG1      ARG  33  76.050  11.385  10.423
  260    HD2  ARG  33           HD2      ARG  33  77.554   9.563   9.580
  261    HD3  ARG  33           HD1      ARG  33  76.338   8.387  10.080
  262   HH11  ARG  33          HH21      ARG  33  77.371  11.416   9.016
  263   HH12  ARG  33          HH22      ARG  33  77.054  12.384   7.616
  264   HH21  ARG  33          HH11      ARG  33  74.670  10.218   6.332
  265   HH22  ARG  33          HH12      ARG  33  75.524  11.706   6.096
  266    H    GLN  34           HN       GLN  34  75.965  10.745  15.374
  267    HA   GLN  34           HA       GLN  34  78.100  11.829  16.865
  268    HB2  GLN  34           HB2      GLN  34  77.449  10.322  18.641
  269    HB3  GLN  34           HB1      GLN  34  75.982  10.825  17.802
  270    HG2  GLN  34           HG2      GLN  34  75.662   8.520  17.915
  271    HG3  GLN  34           HG1      GLN  34  76.438   8.678  16.338
  272   HE21  GLN  34          HE21      GLN  34  77.587   8.497  19.767
  273   HE22  GLN  34          HE22      GLN  34  78.798   7.351  19.448
  274    H    THR  35           HN       THR  35  78.188   9.340  14.570
  275    HA   THR  35           HA       THR  35  80.411   7.850  15.759
  276    HB   THR  35           HB       THR  35  80.450   6.667  13.585
  277    HG1  THR  35           HG1      THR  35  79.794   8.679  12.459
  278   HG21  THR  35          HG21      THR  35  77.718   7.130  14.807
  279   HG22  THR  35          HG22      THR  35  78.869   5.858  15.219
  280   HG23  THR  35          HG23      THR  35  78.067   5.847  13.648
  281    H    ARG  36           HN       ARG  36  81.274  10.366  15.869
  282    HA   ARG  36           HA       ARG  36  82.446  11.600  13.646
  283    HE   ARG  36           HE       ARG  36  83.082  13.716  17.449
  284    HB2  ARG  36           HB2      ARG  36  84.254  12.330  15.354
  285    HB3  ARG  36           HB1      ARG  36  82.582  12.784  15.687
  286    HG2  ARG  36           HG2      ARG  36  82.326  11.113  17.332
  287    HG3  ARG  36           HG1      ARG  36  83.725  10.206  16.755
  288    HD2  ARG  36           HD2      ARG  36  84.233  11.425  18.853
  289    HD3  ARG  36           HD1      ARG  36  85.224  11.999  17.512
  290   HH11  ARG  36          HH21      ARG  36  85.211  12.565  19.904
  291   HH12  ARG  36          HH22      ARG  36  85.125  14.016  20.845
  292   HH21  ARG  36          HH11      ARG  36  82.957  15.618  18.664
  293   HH22  ARG  36          HH12      ARG  36  83.849  15.745  20.143
  294    H    GLN  37           HN       GLN  37  83.126   8.508  14.855
  295    HA   GLN  37           HA       GLN  37  85.944   8.370  14.231
  296    HB2  GLN  37           HB2      GLN  37  85.592   5.909  14.312
  297    HB3  GLN  37           HB1      GLN  37  84.893   6.722  15.712
  298    HG2  GLN  37           HG2      GLN  37  82.693   6.774  14.417
  299    HG3  GLN  37           HG1      GLN  37  83.449   5.662  13.275
  300   HE21  GLN  37          HE21      GLN  37  84.962   4.793  16.013
  301   HE22  GLN  37          HE22      GLN  37  83.883   3.632  16.622
  302    H1U  RCY  38           H1U      RCY  38  81.189   5.046   8.813
  303    H1S  RCY  38           H1S      RCY  38  81.836   7.518   9.213
  304    HB1  RCY  38           HB1      RCY  38  83.434   9.381   8.608
  305    HB2  RCY  38           HB2      RCY  38  83.740  10.579   9.866
  306    HA   RCY  38           HA       RCY  38  84.528   7.650   9.926
  307    HN1  RCY  38           HN1      RCY  38  84.596   9.667  12.119
  308    H    LYS  39           HN       LYS  39  86.894   7.438   9.968
  309    HA   LYS  39           HA       LYS  39  88.801   9.431   9.738
  310    HB2  LYS  39           HB2      LYS  39  90.166   7.810   8.464
  311    HB3  LYS  39           HB1      LYS  39  89.378   7.047   9.843
  312    HG2  LYS  39           HG2      LYS  39  88.173   7.028   7.067
  313    HG3  LYS  39           HG1      LYS  39  89.246   5.752   7.646
  314    HD2  LYS  39           HD2      LYS  39  87.567   5.811   9.727
  315    HD3  LYS  39           HD1      LYS  39  86.462   6.418   8.493
  316    HE2  LYS  39           HE2      LYS  39  87.264   4.428   7.059
  317    HE3  LYS  39           HE1      LYS  39  87.921   3.777   8.561
  318    HZ1  LYS  39           HZ1      LYS  39  85.726   3.923   9.549
  319    HZ2  LYS  39           HZ2      LYS  39  85.683   2.968   8.145
  320    HZ3  LYS  39           HZ3      LYS  39  85.092   4.560   8.110
  321    H    SER  40           HN       SER  40  89.740  10.547   7.990
  322    HA   SER  40           HA       SER  40  87.849  11.232   5.851
  323    HG   SER  40           HG       SER  40  89.308  13.962   5.050
  324    HB2  SER  40           HB2      SER  40  89.119  13.031   6.906
  325    HB3  SER  40           HB1      SER  40  90.638  12.243   6.487
  326    H    LYS  41           HN       LYS  41  91.349  10.893   5.392
  327    HA   LYS  41           HA       LYS  41  91.122   9.846   2.780
  328    HB2  LYS  41           HB2      LYS  41  93.522   8.799   3.596
  329    HB3  LYS  41           HB1      LYS  41  93.303  10.455   3.042
  330    HG2  LYS  41           HG2      LYS  41  94.471  10.476   5.187
  331    HG3  LYS  41           HG1      LYS  41  92.853  11.146   5.402
  332    HD2  LYS  41           HD2      LYS  41  92.045   9.158   6.417
  333    HD3  LYS  41           HD1      LYS  41  93.436   8.220   5.871
  334    HE2  LYS  41           HE2      LYS  41  93.478   8.893   8.325
  335    HE3  LYS  41           HE1      LYS  41  94.905   9.347   7.394
  336    HZ1  LYS  41           HZ1      LYS  41  93.304  11.023   8.862
  337    HZ2  LYS  41           HZ2      LYS  41  92.887  11.346   7.247
  338    HZ3  LYS  41           HZ3      LYS  41  94.503  11.483   7.754
  339    HA   PRO  42           HA       PRO  42  89.778   5.720   3.967
  340    HB2  PRO  42           HB2      PRO  42  89.378   4.723   1.476
  341    HB3  PRO  42           HB1      PRO  42  88.278   5.909   2.206
  342    HG2  PRO  42           HG2      PRO  42  90.428   6.327   0.192
  343    HG3  PRO  42           HG1      PRO  42  88.819   7.060   0.296
  344    HD2  PRO  42           HD2      PRO  42  91.146   8.313   1.124
  345    HD3  PRO  42           HD1      PRO  42  89.527   8.712   1.738
  346    HA   PRO  43           HA       PRO  43  93.451   3.257   3.529
  347    HB2  PRO  43           HB2      PRO  43  92.464   0.733   3.760
  348    HB3  PRO  43           HB1      PRO  43  92.500   1.869   5.124
  349    HG2  PRO  43           HG2      PRO  43  90.224   1.117   3.359
  350    HG3  PRO  43           HG1      PRO  43  90.253   1.395   5.108
  351    HD2  PRO  43           HD2      PRO  43  89.364   3.263   3.288
  352    HD3  PRO  43           HD1      PRO  43  90.031   3.681   4.881
  353    H    LYS  44           HN       LYS  44  94.605   2.830   1.693
  354    HA   LYS  44           HA       LYS  44  95.119   2.112  -0.479
  355    HB2  LYS  44           HB2      LYS  44  94.257  -0.060   0.667
  356    HB3  LYS  44           HB1      LYS  44  92.792   0.203  -0.278
  357    HG2  LYS  44           HG2      LYS  44  94.609   0.546  -2.232
  358    HG3  LYS  44           HG1      LYS  44  95.528  -0.545  -1.193
  359    HD2  LYS  44           HD2      LYS  44  92.764  -1.038  -2.338
  360    HD3  LYS  44           HD1      LYS  44  94.252  -1.878  -2.776
  361    HE2  LYS  44           HE2      LYS  44  93.567  -3.396  -1.220
  362    HE3  LYS  44           HE1      LYS  44  94.241  -2.239  -0.072
  363    HZ1  LYS  44           HZ1      LYS  44  91.778  -1.245  -0.535
  364    HZ2  LYS  44           HZ2      LYS  44  92.197  -2.228   0.786
  365    HZ3  LYS  44           HZ3      LYS  44  91.492  -2.916  -0.598
  366    H    LYS  45           HN       LYS  45  94.332   2.252  -2.702
  367    HA   LYS  45           HA       LYS  45  92.064   4.126  -2.938
  368    HB2  LYS  45           HB2      LYS  45  94.156   3.099  -4.868
  369    HB3  LYS  45           HB1      LYS  45  92.795   4.087  -5.400
  370    HG2  LYS  45           HG2      LYS  45  93.483   5.941  -4.086
  371    HG3  LYS  45           HG1      LYS  45  94.595   4.954  -3.136
  372    HD2  LYS  45           HD2      LYS  45  96.125   4.744  -4.940
  373    HD3  LYS  45           HD1      LYS  45  94.937   5.309  -6.116
  374    HE2  LYS  45           HE2      LYS  45  95.904   7.053  -3.844
  375    HE3  LYS  45           HE1      LYS  45  96.721   7.007  -5.406
  376    HZ1  LYS  45           HZ1      LYS  45  94.253   8.265  -4.677
  377    HZ2  LYS  45           HZ2      LYS  45  94.096   7.280  -6.053
  378    HZ3  LYS  45           HZ3      LYS  45  95.245   8.531  -6.027
  379    H    GLY  46           HN       GLY  46  91.124   3.429  -5.496
  380    HA2  GLY  46           HA2      GLY  46  89.380   1.189  -4.806
  381    HA3  GLY  46           HA1      GLY  46  89.316   2.129  -6.298
  382    H    VAL  47           HN       VAL  47  89.993   1.085  -8.103
  383    HA   VAL  47           HA       VAL  47  90.961  -0.567  -9.456
  384    HB   VAL  47           HB       VAL  47  93.128  -0.837  -7.377
  385   HG11  VAL  47          HG11      VAL  47  94.524  -0.897  -9.465
  386   HG12  VAL  47          HG12      VAL  47  93.037  -0.809 -10.408
  387   HG13  VAL  47          HG13      VAL  47  93.343  -2.204  -9.373
  388   HG21  VAL  47          HG21      VAL  47  92.850   1.525  -7.418
  389   HG22  VAL  47          HG22      VAL  47  92.511   1.533  -9.149
  390   HG23  VAL  47          HG23      VAL  47  94.145   1.207  -8.572
  391    H    GLN  48           HN       GLN  48  89.286  -1.276  -6.928
  392    HA   GLN  48           HA       GLN  48  89.419  -4.147  -7.320
  393    HB2  GLN  48           HB2      GLN  48  91.349  -3.875  -5.804
  394    HB3  GLN  48           HB1      GLN  48  90.317  -3.041  -4.641
  395    HG2  GLN  48           HG2      GLN  48  88.997  -5.007  -4.268
  396    HG3  GLN  48           HG1      GLN  48  89.740  -5.841  -5.634
  397   HE21  GLN  48          HE21      GLN  48  90.389  -4.636  -2.335
  398   HE22  GLN  48          HE22      GLN  48  91.753  -5.612  -2.072
  399    H    GLY  49           HN       GLY  49  87.353  -4.846  -7.051
  400    HA2  GLY  49           HA2      GLY  49  85.111  -4.887  -6.364
  401    HA3  GLY  49           HA1      GLY  49  85.683  -4.217  -4.835
  402    H1U  RCY  50           H1U      RCY  50  81.142  -1.472  -1.252
  403    H1S  RCY  50           H1S      RCY  50  81.606   1.582  -4.791
  404    HB1  RCY  50           HB1      RCY  50  83.682  -0.202  -5.761
  405    HB2  RCY  50           HB2      RCY  50  82.485  -1.481  -5.555
  406    HA   RCY  50           HA       RCY  50  82.606  -1.654  -8.168
  407    HN1  RCY  50           HN1      RCY  50  83.734  -3.585  -7.464
  408    H    GLY  51           HN       GLY  51  83.206  -0.141  -9.668
  409    HA2  GLY  51           HA2      GLY  51  86.026   0.399 -10.077
  410    HA3  GLY  51           HA1      GLY  51  84.700   1.080 -11.020
  411    H    ASP  52           HN       ASP  52  87.191   2.170  -9.427
  412    HA   ASP  52           HA       ASP  52  86.453   3.825  -7.321
  413    HB2  ASP  52           HB2      ASP  52  88.147   5.488  -8.347
  414    HB3  ASP  52           HB1      ASP  52  88.736   3.872  -7.957
  415    H    ASP  53           HN       ASP  53  86.804   5.355 -10.512
  416    HA   ASP  53           HA       ASP  53  85.095   7.516 -10.023
  417    HB2  ASP  53           HB2      ASP  53  84.927   7.772 -12.441
  418    HB3  ASP  53           HB1      ASP  53  86.565   7.260 -12.034
  419    H    ILE  54           HN       ILE  54  82.883   7.882 -10.997
  420    HA   ILE  54           HA       ILE  54  80.917   6.248  -9.934
  421    HB   ILE  54           HB       ILE  54  80.468   7.548 -12.613
  422   HG12  ILE  54          HG12      ILE  54  80.031   9.609 -10.945
  423   HG13  ILE  54          HG11      ILE  54  81.328   8.813 -10.051
  424   HG21  ILE  54          HG21      ILE  54  78.287   7.919 -11.791
  425   HG22  ILE  54          HG22      ILE  54  78.790   7.715 -10.113
  426   HG23  ILE  54          HG23      ILE  54  78.692   6.315 -11.180
  427   HD11  ILE  54          HD11      ILE  54  82.449   8.708 -12.462
  428   HD12  ILE  54          HD12      ILE  54  82.588  10.151 -11.457
  429   HD13  ILE  54          HD13      ILE  54  81.395  10.091 -12.755
  430    HA   PRO  55           HA       PRO  55  81.565   2.761 -12.791
  431    HB2  PRO  55           HB2      PRO  55  80.731   0.796 -11.139
  432    HB3  PRO  55           HB1      PRO  55  82.312   1.576 -10.936
  433    HG2  PRO  55           HG2      PRO  55  79.804   1.974  -9.399
  434    HG3  PRO  55           HG1      PRO  55  81.486   2.000  -8.847
  435    HD2  PRO  55           HD2      PRO  55  79.923   4.265  -9.398
  436    HD3  PRO  55           HD1      PRO  55  81.693   4.243  -9.253
  437    H    GLY  56           HN       GLY  56  78.668   2.716 -10.671
  438    HA2  GLY  56           HA2      GLY  56  77.013   1.423 -12.647
  439    HA3  GLY  56           HA1      GLY  56  76.428   2.226 -11.189
  440    H    MET  57           HN       MET  57  78.433   4.253 -13.016
  441    HA   MET  57           HA       MET  57  77.942   6.232 -14.178
  442    HB2  MET  57           HB2      MET  57  77.445   4.492 -15.915
  443    HB3  MET  57           HB1      MET  57  75.761   4.509 -15.394
  444    HG2  MET  57           HG2      MET  57  76.765   7.204 -15.882
  445    HG3  MET  57           HG1      MET  57  76.901   6.185 -17.315
  446    HE1  MET  57           HE1      MET  57  74.709   8.786 -16.028
  447    HE2  MET  57           HE2      MET  57  73.659   8.536 -17.420
  448    HE3  MET  57           HE3      MET  57  75.409   8.516 -17.629
  449    H    GLU  58           HN       GLU  58  76.685   5.906 -11.596
  450    HA   GLU  58           HA       GLU  58  74.478   7.839 -11.954
  451    HB2  GLU  58           HB2      GLU  58  74.147   5.123 -10.653
  452    HB3  GLU  58           HB1      GLU  58  73.044   6.466 -10.353
  453    HG2  GLU  58           HG2      GLU  58  72.686   6.633 -12.841
  454    HG3  GLU  58           HG1      GLU  58  73.630   5.154 -13.020
  455    H    GLY  59           HN       GLY  59  76.861   6.224  -9.988
  456    HA2  GLY  59           HA2      GLY  59  77.995   7.015  -8.083
  457    HA3  GLY  59           HA1      GLY  59  77.141   8.546  -8.279
  458    H1U  RCY  60           H1U      RCY  60  76.106   8.366  -1.219
  459    H1S  RCY  60           H1S      RCY  60  74.722  10.037  -4.615
  460    HB1  RCY  60           HB1      RCY  60  72.319   7.370  -5.255
  461    HB2  RCY  60           HB2      RCY  60  72.109   7.335  -7.006
  462    HA   RCY  60           HA       RCY  60  74.429   6.305  -5.374
  463    HN1  RCY  60           HN1      RCY  60  74.586   6.747  -8.330
  464    H    GLY  61           HN       GLY  61  72.832   5.650  -8.496
  465    HA2  GLY  61           HA2      GLY  61  71.152   3.557  -7.805
  466    HA3  GLY  61           HA1      GLY  61  72.027   3.597  -9.336
  467    H    THR  62           HN       THR  62  73.992   2.426  -9.520
  468    HA   THR  62           HA       THR  62  75.162   0.393  -9.146
  469    HB   THR  62           HB       THR  62  76.547   0.571  -7.066
  470    HG1  THR  62           HG1      THR  62  75.912   1.839  -5.530
  471   HG21  THR  62          HG21      THR  62  76.207   3.023  -8.806
  472   HG22  THR  62          HG22      THR  62  77.362   1.707  -9.016
  473   HG23  THR  62          HG23      THR  62  77.539   2.828  -7.666
  474    H    ASP  63           HN       ASP  63  72.389   0.061  -8.578
  475    HA   ASP  63           HA       ASP  63  71.935  -1.096  -5.989
  476    HB2  ASP  63           HB2      ASP  63  70.001  -2.266  -7.311
  477    HB3  ASP  63           HB1      ASP  63  69.968  -0.512  -7.124
  478    H    ILE  64           HN       ILE  64  74.294  -2.087  -7.730
  479    HA   ILE  64           HA       ILE  64  73.803  -4.977  -7.187
  480    HB   ILE  64           HB       ILE  64  75.189  -4.028  -9.705
  481   HG12  ILE  64          HG12      ILE  64  72.880  -5.057 -10.630
  482   HG13  ILE  64          HG11      ILE  64  72.294  -4.402  -9.101
  483   HG21  ILE  64          HG21      ILE  64  73.900  -6.690  -9.064
  484   HG22  ILE  64          HG22      ILE  64  75.594  -6.346  -8.713
  485   HG23  ILE  64          HG23      ILE  64  75.015  -6.317 -10.379
  486   HD11  ILE  64          HD11      ILE  64  72.048  -2.605 -10.616
  487   HD12  ILE  64          HD12      ILE  64  73.597  -2.935 -11.393
  488   HD13  ILE  64          HD13      ILE  64  73.554  -2.243  -9.771
  489    H    THR  65           HN       THR  65  76.263  -2.659  -8.332
  490    HA   THR  65           HA       THR  65  78.620  -2.779  -8.035
  491    HB   THR  65           HB       THR  65  77.749  -1.352  -6.186
  492    HG1  THR  65           HG1      THR  65  79.748  -2.925  -5.032
  493   HG21  THR  65          HG21      THR  65  77.498  -2.364  -3.941
  494   HG22  THR  65          HG22      THR  65  77.778  -3.960  -4.639
  495   HG23  THR  65          HG23      THR  65  76.342  -3.040  -5.088
  496    H    VAL  66           HN       VAL  66  77.495  -5.369  -8.451
  497    HA   VAL  66           HA       VAL  66  78.205  -7.599  -8.322
  498    HB   VAL  66           HB       VAL  66  80.387  -6.735  -6.415
  499   HG11  VAL  66          HG11      VAL  66  81.595  -8.583  -7.498
  500   HG12  VAL  66          HG12      VAL  66  80.235  -8.847  -8.588
  501   HG13  VAL  66          HG13      VAL  66  80.052  -9.150  -6.860
  502   HG21  VAL  66          HG21      VAL  66  81.709  -6.534  -8.677
  503   HG22  VAL  66          HG22      VAL  66  80.750  -5.165  -8.114
  504   HG23  VAL  66          HG23      VAL  66  80.115  -6.230  -9.368
  505    H    ILE  67           HN       ILE  67  78.540  -5.876  -5.221
  506    HA   ILE  67           HA       ILE  67  76.689  -7.872  -4.002
  507    HB   ILE  67           HB       ILE  67  79.276  -6.883  -2.759
  508   HG12  ILE  67          HG12      ILE  67  78.458  -9.704  -3.505
  509   HG13  ILE  67          HG11      ILE  67  79.438  -8.676  -4.552
  510   HG21  ILE  67          HG21      ILE  67  77.788  -7.121  -0.959
  511   HG22  ILE  67          HG22      ILE  67  78.542  -8.713  -1.046
  512   HG23  ILE  67          HG23      ILE  67  76.932  -8.462  -1.721
  513   HD11  ILE  67          HD11      ILE  67  81.190  -8.538  -2.915
  514   HD12  ILE  67          HD12      ILE  67  80.757 -10.242  -3.051
  515   HD13  ILE  67          HD13      ILE  67  80.179  -9.292  -1.682
  516    H1U  RCY  68           H1U      RCY  68  71.862   2.718  -2.046
  517    H1S  RCY  68           H1S      RCY  68  72.841  -1.991  -2.586
  518    HB1  RCY  68           HB1      RCY  68  72.728  -4.069  -3.032
  519    HB2  RCY  68           HB2      RCY  68  73.413  -4.921  -4.412
  520    HA   RCY  68           HA       RCY  68  75.516  -3.622  -2.901
  521    HN1  RCY  68           HN1      RCY  68  75.022  -6.257  -4.058
  522    HA   PRO  69           HA       PRO  69  75.474  -4.860   1.401
  523    HB2  PRO  69           HB2      PRO  69  73.960  -2.259   1.417
  524    HB3  PRO  69           HB1      PRO  69  75.165  -2.857   2.577
  525    HG2  PRO  69           HG2      PRO  69  75.827  -1.152   0.637
  526    HG3  PRO  69           HG1      PRO  69  76.929  -2.442   1.146
  527    HD2  PRO  69           HD2      PRO  69  75.443  -2.173  -1.390
  528    HD3  PRO  69           HD1      PRO  69  76.842  -3.201  -1.012
  529    H    TRP  70           HN       TRP  70  72.358  -3.285   0.428
  530    HA   TRP  70           HA       TRP  70  70.825  -4.734   2.331
  531    HD1  TRP  70           HD1      TRP  70  69.696  -5.746  -1.301
  532    HE1  TRP  70           HE1      TRP  70  69.901  -4.835  -3.703
  533    HE3  TRP  70           HE3      TRP  70  70.172  -0.759  -0.314
  534    HZ2  TRP  70           HZ2      TRP  70  70.225  -2.319  -5.033
  535    HZ3  TRP  70           HZ3      TRP  70  70.427   0.869  -2.160
  536    HH2  TRP  70           HH2      TRP  70  70.454   0.100  -4.516
  537    HB2  TRP  70           HB2      TRP  70  68.850  -4.114   1.024
  538    HB3  TRP  70           HB1      TRP  70  69.951  -2.747   1.150
  539    H    GLU  71           HN       GLU  71  72.553  -6.013  -0.152
  540    HA   GLU  71           HA       GLU  71  70.614  -8.234  -0.634
  541    HB2  GLU  71           HB2      GLU  71  71.834  -6.914  -2.542
  542    HB3  GLU  71           HB1      GLU  71  73.225  -7.904  -2.100
  543    HG2  GLU  71           HG2      GLU  71  71.883  -9.947  -2.430
  544    HG3  GLU  71           HG1      GLU  71  70.488  -8.961  -2.870
  545    H    ALA  72           HN       ALA  72  73.834  -7.469   0.589
  546    HA   ALA  72           HA       ALA  72  74.567 -10.261   1.007
  547    HB1  ALA  72           HB1      ALA  72  76.375  -8.717   0.712
  548    HB2  ALA  72           HB2      ALA  72  76.419  -9.205   2.406
  549    HB3  ALA  72           HB3      ALA  72  75.743  -7.639   1.957
  550    H1U  RCY  73           H1U      RCY  73  70.211  -7.821   0.648
  551    H1S  RCY  73           H1S      RCY  73  71.898  -6.795   4.228
  552    HB1  RCY  73           HB1      RCY  73  74.388  -7.588   6.541
  553    HB2  RCY  73           HB2      RCY  73  72.686  -7.129   6.493
  554    HA   RCY  73           HA       RCY  73  73.662  -9.509   5.547
  555    HN1  RCY  73           HN1      RCY  73  74.176  -7.632   3.410
  556    H    ASN  74           HN       ASN  74  71.649  -7.836   3.229
  557    HA   ASN  74           HA       ASN  74  69.353  -8.034   2.792
  558    HB2  ASN  74           HB2      ASN  74  69.136 -10.260   4.797
  559    HB3  ASN  74           HB1      ASN  74  68.366 -10.100   3.218
  560   HD21  ASN  74          HD21      ASN  74  69.804 -12.475   3.949
  561   HD22  ASN  74          HD22      ASN  74  71.186 -12.582   2.970
  562    H    HIS  75           HN       HIS  75  70.644  -7.277   5.774
  563    HA   HIS  75           HA       HIS  75  68.177  -5.912   6.578
  564    HD1  HIS  75           HD1      HIS  75  66.511  -9.285   8.607
  565    HD2  HIS  75           HD2      HIS  75  66.689  -5.136   8.210
  566    HE1  HIS  75           HE1      HIS  75  64.167  -8.425   9.032
  567    HE2  HIS  75           HE2      HIS  75  64.262  -5.900   8.793
  568    HB2  HIS  75           HB2      HIS  75  68.737  -8.479   7.643
  569    HB3  HIS  75           HB1      HIS  75  69.149  -7.332   8.915
  570    H1U  RCY  76           H1U      RCY  76  72.161   2.994   9.934
  571    H1S  RCY  76           H1S      RCY  76  72.075   0.036   6.090
  572    HB1  RCY  76           HB1      RCY  76  70.732  -1.144   8.513
  573    HB2  RCY  76           HB2      RCY  76  69.138  -1.845   8.228
  574    HA   RCY  76           HA       RCY  76  71.692  -3.262   7.441
  575    HN1  RCY  76           HN1      RCY  76  69.005  -3.910   6.958
  576    H    GLU  77           HN       GLU  77  69.594  -4.930   9.495
  577    HA   GLU  77           HA       GLU  77  70.582  -3.962  12.042
  578    HB2  GLU  77           HB2      GLU  77  69.053  -6.407  11.158
  579    HB3  GLU  77           HB1      GLU  77  69.640  -6.262  12.815
  580    HG2  GLU  77           HG2      GLU  77  67.358  -5.404  12.695
  581    HG3  GLU  77           HG1      GLU  77  68.466  -4.066  12.997
  582    H    LEU  78           HN       LEU  78  71.210  -7.010  10.246
  583    HA   LEU  78           HA       LEU  78  73.225  -8.052  11.877
  584    HG   LEU  78           HG       LEU  78  72.921 -10.251  11.106
  585    HB2  LEU  78           HB2      LEU  78  72.725  -8.159   8.916
  586    HB3  LEU  78           HB1      LEU  78  74.222  -8.841   9.553
  587   HD11  LEU  78          HD11      LEU  78  70.573  -8.897   9.752
  588   HD12  LEU  78          HD12      LEU  78  70.976  -8.874  11.469
  589   HD13  LEU  78          HD13      LEU  78  70.422 -10.368  10.713
  590   HD21  LEU  78          HD21      LEU  78  71.781 -10.548   8.319
  591   HD22  LEU  78          HD22      LEU  78  72.150 -11.823   9.480
  592   HD23  LEU  78          HD23      LEU  78  73.459 -10.939   8.696
  593    H    HIS  79           HN       HIS  79  75.361  -7.547  12.256
  594    HA   HIS  79           HA       HIS  79  76.653  -5.469  10.554
  595    HD1  HIS  79           HD1      HIS  79  77.897  -3.896  10.368
  596    HD2  HIS  79           HD2      HIS  79  78.356  -3.357  14.479
  597    HE1  HIS  79           HE1      HIS  79  79.840  -2.299  10.668
  598    HE2  HIS  79           HE2      HIS  79  80.130  -1.963  13.165
  599    HB2  HIS  79           HB2      HIS  79  75.630  -4.347  12.541
  600    HB3  HIS  79           HB1      HIS  79  76.602  -5.385  13.586
  601    H    GLU  80           HN       GLU  80  77.371  -7.265  13.573
  602    HA   GLU  80           HA       GLU  80  80.126  -7.675  12.858
  603    HB2  GLU  80           HB2      GLU  80  78.421  -9.245  14.815
  604    HB3  GLU  80           HB1      GLU  80  80.184  -9.210  14.767
  605    HG2  GLU  80           HG2      GLU  80  78.475  -6.740  15.156
  606    HG3  GLU  80           HG1      GLU  80  79.161  -7.670  16.489
  607    H    LEU  81           HN       LEU  81  77.354  -9.017  11.564
  608    HA   LEU  81           HA       LEU  81  78.595 -11.661  11.022
  609    HG   LEU  81           HG       LEU  81  75.142 -12.373  11.915
  610    HB2  LEU  81           HB2      LEU  81  75.850 -10.491  10.546
  611    HB3  LEU  81           HB1      LEU  81  76.352 -11.984   9.754
  612   HD11  LEU  81          HD11      LEU  81  77.948 -13.250  12.421
  613   HD12  LEU  81          HD12      LEU  81  77.213 -13.737  10.894
  614   HD13  LEU  81          HD13      LEU  81  76.458 -14.194  12.421
  615   HD21  LEU  81          HD21      LEU  81  76.243 -10.262  12.943
  616   HD22  LEU  81          HD22      LEU  81  77.625 -11.310  13.263
  617   HD23  LEU  81          HD23      LEU  81  76.057 -11.675  13.982
  618    H    ALA  82           HN       ALA  82  79.280  -8.834   9.888
  619    HA   ALA  82           HA       ALA  82  78.712  -8.713   7.136
  620    HB1  ALA  82           HB1      ALA  82  81.118  -7.658   7.058
  621    HB2  ALA  82           HB2      ALA  82  81.044  -7.821   8.813
  622    HB3  ALA  82           HB3      ALA  82  79.846  -6.841   7.967
  623    H    GLN  83           HN       GLN  83  78.721 -10.892   6.321
  624    HA   GLN  83           HA       GLN  83  80.799 -12.766   6.528
  625    HB2  GLN  83           HB2      GLN  83  78.634 -13.231   5.415
  626    HB3  GLN  83           HB1      GLN  83  79.104 -12.187   4.074
  627    HG2  GLN  83           HG2      GLN  83  80.813 -13.653   3.371
  628    HG3  GLN  83           HG1      GLN  83  80.846 -14.498   4.920
  629   HE21  GLN  83          HE21      GLN  83  77.651 -13.807   3.842
  630   HE22  GLN  83          HE22      GLN  83  77.283 -15.348   3.232
  631    H    TYR  84           HN       TYR  84  80.910  -9.673   5.168
  632    HA   TYR  84           HA       TYR  84  83.679  -9.851   4.479
  633    HD1  TYR  84           HD1      TYR  84  80.042  -9.552   2.461
  634    HD2  TYR  84           HD2      TYR  84  83.805  -8.337   0.782
  635    HE1  TYR  84           HE1      TYR  84  78.874  -7.875   1.056
  636    HE2  TYR  84           HE2      TYR  84  82.636  -6.660  -0.622
  637    HH   TYR  84           HH       TYR  84  80.135  -5.366  -0.240
  638    HB2  TYR  84           HB2      TYR  84  83.724 -10.197   2.211
  639    HB3  TYR  84           HB1      TYR  84  82.190 -11.017   2.505
  640    H    GLY  85           HN       GLY  85  80.868  -8.229   5.095
  641    HA2  GLY  85           HA2      GLY  85  80.598  -5.854   3.905
  642    HA3  GLY  85           HA1      GLY  85  80.728  -5.900   5.662
  643    H    ILE  86           HN       ILE  86  83.327  -6.334   6.198
  644    HA   ILE  86           HA       ILE  86  85.365  -5.174   6.366
  645    HB   ILE  86           HB       ILE  86  84.887  -5.126   3.371
  646   HG12  ILE  86          HG12      ILE  86  85.342  -7.281   4.821
  647   HG13  ILE  86          HG11      ILE  86  86.208  -7.052   3.301
  648   HG21  ILE  86          HG21      ILE  86  87.170  -4.089   5.038
  649   HG22  ILE  86          HG22      ILE  86  86.383  -3.337   3.651
  650   HG23  ILE  86          HG23      ILE  86  87.465  -4.710   3.414
  651   HD11  ILE  86          HD11      ILE  86  87.394  -5.921   5.809
  652   HD12  ILE  86          HD12      ILE  86  88.203  -6.514   4.359
  653   HD13  ILE  86          HD13      ILE  86  87.526  -7.656   5.520
  654    H1U  RCY  87           H1U      RCY  87  79.911   0.097  -1.323
  655    H1S  RCY  87           H1S      RCY  87  83.185   1.767   0.760
  656    HB1  RCY  87           HB1      RCY  87  82.161  -1.052   3.077
  657    HB2  RCY  87           HB2      RCY  87  83.647  -1.635   2.331
  658    HA   RCY  87           HA       RCY  87  84.670  -0.790   4.673
  659    HN1  RCY  87           HN1      RCY  87  84.027  -3.337   3.633
  Start of MODEL   51
    1    HA   MET   1           HA       MET   1  59.819   0.881  13.769
    2    HB2  MET   1           HB2      MET   1  58.176   2.872  12.193
    3    HB3  MET   1           HB1      MET   1  58.575   2.911  13.911
    4    HG2  MET   1           HG2      MET   1  60.971   3.199  13.330
    5    HG3  MET   1           HG1      MET   1  60.539   3.222  11.621
    6    HE1  MET   1           HE1      MET   1  60.679   5.399  10.501
    7    HE2  MET   1           HE2      MET   1  61.980   5.412  11.689
    8    HE3  MET   1           HE3      MET   1  61.007   6.860  11.441
    9    H    ASN   2           HN       ASN   2  57.160   1.410  14.316
   10    HA   ASN   2           HA       ASN   2  55.909  -1.107  13.443
   11    HB2  ASN   2           HB2      ASN   2  54.778   1.037  15.263
   12    HB3  ASN   2           HB1      ASN   2  54.234  -0.635  15.124
   13   HD21  ASN   2          HD21      ASN   2  56.113   1.363  17.043
   14   HD22  ASN   2          HD22      ASN   2  57.139   0.195  17.726
   15    H    LEU   3           HN       LEU   3  55.960   0.009  11.147
   16    HA   LEU   3           HA       LEU   3  53.829   1.963  10.684
   17    HG   LEU   3           HG       LEU   3  56.788   1.696  10.247
   18    HB2  LEU   3           HB2      LEU   3  55.366   0.305   8.662
   19    HB3  LEU   3           HB1      LEU   3  54.441   1.770   8.337
   20   HD11  LEU   3          HD11      LEU   3  58.013   2.837   8.348
   21   HD12  LEU   3          HD12      LEU   3  56.683   2.360   7.293
   22   HD13  LEU   3          HD13      LEU   3  57.671   1.128   8.077
   23   HD21  LEU   3          HD21      LEU   3  56.695   4.202   9.619
   24   HD22  LEU   3          HD22      LEU   3  55.429   3.591  10.684
   25   HD23  LEU   3          HD23      LEU   3  55.093   3.847   8.972
   26    H    GLU   4           HN       GLU   4  52.832   0.775   8.219
   27    HA   GLU   4           HA       GLU   4  50.545  -0.549   9.125
   28    HB2  GLU   4           HB2      GLU   4  51.863  -0.129   6.552
   29    HB3  GLU   4           HB1      GLU   4  51.024  -1.679   6.603
   30    HG2  GLU   4           HG2      GLU   4  49.539   0.151   5.815
   31    HG3  GLU   4           HG1      GLU   4  48.959  -0.565   7.319
   32    HA   PRO   5           HA       PRO   5  51.716  -4.502  10.782
   33    HB2  PRO   5           HB2      PRO   5  49.618  -5.467   8.859
   34    HB3  PRO   5           HB1      PRO   5  49.869  -5.906  10.561
   35    HG2  PRO   5           HG2      PRO   5  47.996  -4.143   9.799
   36    HG3  PRO   5           HG1      PRO   5  48.859  -4.004  11.338
   37    HD2  PRO   5           HD2      PRO   5  49.054  -2.292   8.948
   38    HD3  PRO   5           HD1      PRO   5  49.588  -1.964  10.610
   39    HA   PRO   6           HA       PRO   6  54.152  -5.670   7.074
   40    HB2  PRO   6           HB2      PRO   6  56.565  -5.829   8.263
   41    HB3  PRO   6           HB1      PRO   6  55.831  -4.264   7.861
   42    HG2  PRO   6           HG2      PRO   6  56.060  -5.618  10.488
   43    HG3  PRO   6           HG1      PRO   6  56.110  -3.893  10.095
   44    HD2  PRO   6           HD2      PRO   6  53.874  -5.301  11.089
   45    HD3  PRO   6           HD1      PRO   6  53.854  -3.671  10.381
   46    H    LYS   7           HN       LYS   7  54.633  -7.767   6.396
   47    HA   LYS   7           HA       LYS   7  53.965  -9.976   8.128
   48    HB2  LYS   7           HB2      LYS   7  55.205  -9.776   5.379
   49    HB3  LYS   7           HB1      LYS   7  54.996 -11.331   6.186
   50    HG2  LYS   7           HG2      LYS   7  52.642 -11.132   6.219
   51    HG3  LYS   7           HG1      LYS   7  52.698  -9.395   5.913
   52    HD2  LYS   7           HD2      LYS   7  53.470  -9.758   3.645
   53    HD3  LYS   7           HD1      LYS   7  53.632 -11.491   3.933
   54    HE2  LYS   7           HE2      LYS   7  51.315 -11.832   3.989
   55    HE3  LYS   7           HE1      LYS   7  50.978 -10.139   4.355
   56    HZ1  LYS   7           HZ1      LYS   7  52.363 -10.579   1.860
   57    HZ2  LYS   7           HZ2      LYS   7  51.034  -9.579   2.206
   58    HZ3  LYS   7           HZ3      LYS   7  50.800 -11.235   1.911
   59    H    ALA   8           HN       ALA   8  56.727 -10.899   6.460
   60    HA   ALA   8           HA       ALA   8  58.877 -10.063   8.073
   61    HB1  ALA   8           HB1      ALA   8  57.231 -12.279   9.243
   62    HB2  ALA   8           HB2      ALA   8  58.072 -10.963  10.061
   63    HB3  ALA   8           HB3      ALA   8  58.983 -12.338   9.436
   64    H    GLU   9           HN       GLU   9  59.386 -10.378   5.686
   65    HA   GLU   9           HA       GLU   9  59.954 -13.203   4.957
   66    HB2  GLU   9           HB2      GLU   9  60.266 -10.678   3.304
   67    HB3  GLU   9           HB1      GLU   9  60.369 -12.337   2.713
   68    HG2  GLU   9           HG2      GLU   9  57.916 -11.095   3.993
   69    HG3  GLU   9           HG1      GLU   9  58.142 -11.339   2.261
   70    H1U  RCY  10           H1U      RCY  10  60.996 -10.613   2.738
   71    H1S  RCY  10           H1S      RCY  10  63.543 -14.019   2.255
   72    HB1  RCY  10           HB1      RCY  10  63.968 -13.327   6.019
   73    HB2  RCY  10           HB2      RCY  10  65.572 -13.162   5.304
   74    HA   RCY  10           HA       RCY  10  64.258 -11.211   4.697
   75    HN1  RCY  10           HN1      RCY  10  62.158 -12.503   3.193
   76    H    ARG  11           HN       ARG  11  62.939 -12.415   1.925
   77    HA   ARG  11           HA       ARG  11  65.422 -11.865   0.411
   78    HE   ARG  11           HE       ARG  11  64.686 -16.880   0.083
   79    HB2  ARG  11           HB2      ARG  11  64.191 -14.537   0.724
   80    HB3  ARG  11           HB1      ARG  11  64.505 -14.078  -0.949
   81    HG2  ARG  11           HG2      ARG  11  66.822 -13.812  -0.566
   82    HG3  ARG  11           HG1      ARG  11  66.612 -13.728   1.183
   83    HD2  ARG  11           HD2      ARG  11  67.436 -15.970  -0.033
   84    HD3  ARG  11           HD1      ARG  11  66.425 -16.011   1.412
   85   HH11  ARG  11          HH21      ARG  11  67.089 -15.296  -1.814
   86   HH12  ARG  11          HH22      ARG  11  66.385 -15.752  -3.329
   87   HH21  ARG  11          HH11      ARG  11  63.752 -17.486  -1.885
   88   HH22  ARG  11          HH12      ARG  11  64.496 -16.992  -3.369
   89    H    SER  12           HN       SER  12  62.306 -13.401  -0.428
   90    HA   SER  12           HA       SER  12  60.652 -12.728  -1.946
   91    HG   SER  12           HG       SER  12  61.353 -10.387   0.552
   92    HB2  SER  12           HB2      SER  12  61.565  -9.891  -1.480
   93    HB3  SER  12           HB1      SER  12  59.942 -10.478  -1.827
   94    H    ALA  13           HN       ALA  13  61.436 -13.483  -3.905
   95    HA   ALA  13           HA       ALA  13  62.273 -11.587  -5.874
   96    HB1  ALA  13           HB1      ALA  13  64.433 -11.530  -4.887
   97    HB2  ALA  13           HB2      ALA  13  64.591 -12.651  -6.239
   98    HB3  ALA  13           HB3      ALA  13  64.432 -13.269  -4.595
   99    H    THR  14           HN       THR  14  62.617 -12.649  -7.982
  100    HA   THR  14           HA       THR  14  62.373 -15.527  -8.234
  101    HB   THR  14           HB       THR  14  59.955 -13.885  -9.045
  102    HG1  THR  14           HG1      THR  14  60.087 -15.785  -6.965
  103   HG21  THR  14          HG21      THR  14  60.285 -15.851 -10.427
  104   HG22  THR  14          HG22      THR  14  58.956 -16.169  -9.312
  105   HG23  THR  14          HG23      THR  14  60.551 -16.855  -9.002
  106    H    ARG  15           HN       ARG  15  63.773 -15.711  -9.930
  107    HA   ARG  15           HA       ARG  15  64.803 -15.269 -11.997
  108    HE   ARG  15           HE       ARG  15  61.772 -18.811 -13.622
  109    HB2  ARG  15           HB2      ARG  15  61.975 -14.423 -12.702
  110    HB3  ARG  15           HB1      ARG  15  63.243 -14.846 -13.852
  111    HG2  ARG  15           HG2      ARG  15  63.242 -17.118 -13.199
  112    HG3  ARG  15           HG1      ARG  15  62.386 -16.774 -11.695
  113    HD2  ARG  15           HD2      ARG  15  60.329 -16.475 -12.784
  114    HD3  ARG  15           HD1      ARG  15  61.092 -16.173 -14.345
  115   HH11  ARG  15          HH21      ARG  15  58.982 -16.890 -14.266
  116   HH12  ARG  15          HH22      ARG  15  58.049 -18.213 -14.881
  117   HH21  ARG  15          HH11      ARG  15  60.569 -20.550 -14.422
  118   HH22  ARG  15          HH12      ARG  15  58.948 -20.286 -14.970
  119    H    VAL  16           HN       VAL  16  65.261 -13.254 -10.208
  120    HA   VAL  16           HA       VAL  16  65.294 -10.859  -9.934
  121    HB   VAL  16           HB       VAL  16  67.438 -11.753 -10.916
  122   HG11  VAL  16          HG11      VAL  16  66.761 -10.472 -13.513
  123   HG12  VAL  16          HG12      VAL  16  66.036 -12.050 -13.206
  124   HG13  VAL  16          HG13      VAL  16  67.789 -11.866 -13.180
  125   HG21  VAL  16          HG21      VAL  16  68.253  -9.507 -11.621
  126   HG22  VAL  16          HG22      VAL  16  67.270  -9.426 -10.159
  127   HG23  VAL  16          HG23      VAL  16  66.581  -8.951 -11.711
  128    H    MET  17           HN       MET  17  63.168 -10.085 -10.292
  129    HA   MET  17           HA       MET  17  62.868  -8.316 -12.531
  130    HB2  MET  17           HB2      MET  17  62.034 -11.038 -12.969
  131    HB3  MET  17           HB1      MET  17  60.603 -10.011 -12.952
  132    HG2  MET  17           HG2      MET  17  63.091  -9.482 -14.604
  133    HG3  MET  17           HG1      MET  17  61.602 -10.194 -15.225
  134    HE1  MET  17           HE1      MET  17  62.211  -6.415 -16.408
  135    HE2  MET  17           HE2      MET  17  62.931  -8.021 -16.494
  136    HE3  MET  17           HE3      MET  17  63.451  -6.895 -15.242
  137    H    GLY  18           HN       GLY  18  62.497  -7.045 -10.579
  138    HA2  GLY  18           HA2      GLY  18  59.935  -7.560  -9.166
  139    HA3  GLY  18           HA1      GLY  18  61.183  -6.426  -8.644
  140    H    GLY  19           HN       GLY  19  58.323  -6.813 -10.538
  141    HA2  GLY  19           HA2      GLY  19  57.077  -5.284 -11.819
  142    HA3  GLY  19           HA1      GLY  19  57.662  -4.097 -10.652
  143    HA   PRO  20           HA       PRO  20  59.313  -3.185 -14.989
  144    HB2  PRO  20           HB2      PRO  20  58.392  -0.458 -14.263
  145    HB3  PRO  20           HB1      PRO  20  58.117  -1.381 -15.752
  146    HG2  PRO  20           HG2      PRO  20  56.177  -0.953 -13.960
  147    HG3  PRO  20           HG1      PRO  20  56.274  -2.444 -14.911
  148    HD2  PRO  20           HD2      PRO  20  56.989  -1.994 -12.034
  149    HD3  PRO  20           HD1      PRO  20  56.269  -3.425 -12.807
  150    H1U  RCY  21           H1U      RCY  21  62.706  -2.168  -8.759
  151    H1S  RCY  21           H1S      RCY  21  62.430  -3.531 -12.900
  152    HB1  RCY  21           HB1      RCY  21  64.288  -0.539 -14.265
  153    HB2  RCY  21           HB2      RCY  21  63.348  -0.426 -15.753
  154    HA   RCY  21           HA       RCY  21  62.337  -0.428 -12.903
  155    HN1  RCY  21           HN1      RCY  21  60.499  -0.664 -15.239
  156    H    THR  22           HN       THR  22  61.512   1.605 -12.344
  157    HA   THR  22           HA       THR  22  61.732   3.745 -14.434
  158    HB   THR  22           HB       THR  22  59.969   3.624 -11.971
  159    HG1  THR  22           HG1      THR  22  58.443   3.847 -13.920
  160   HG21  THR  22          HG21      THR  22  60.363   5.737 -14.101
  161   HG22  THR  22          HG22      THR  22  60.610   5.910 -12.364
  162   HG23  THR  22          HG23      THR  22  58.981   5.708 -13.007
  163    HA   PRO  23           HA       PRO  23  65.211   4.663 -11.558
  164    HB2  PRO  23           HB2      PRO  23  65.677   6.694 -13.693
  165    HB3  PRO  23           HB1      PRO  23  66.815   5.547 -12.959
  166    HG2  PRO  23           HG2      PRO  23  65.851   5.187 -15.419
  167    HG3  PRO  23           HG1      PRO  23  66.170   3.824 -14.332
  168    HD2  PRO  23           HD2      PRO  23  63.547   5.034 -15.116
  169    HD3  PRO  23           HD1      PRO  23  63.941   3.343 -14.734
  170    H    ARG  24           HN       ARG  24  65.414   6.340 -10.042
  171    HA   ARG  24           HA       ARG  24  63.289   8.424 -10.133
  172    HE   ARG  24           HE       ARG  24  61.967  10.854  -6.523
  173    HB2  ARG  24           HB2      ARG  24  63.500   6.980  -8.097
  174    HB3  ARG  24           HB1      ARG  24  65.118   7.631  -7.845
  175    HG2  ARG  24           HG2      ARG  24  63.864   9.057  -6.498
  176    HG3  ARG  24           HG1      ARG  24  63.874   9.958  -8.015
  177    HD2  ARG  24           HD2      ARG  24  61.699   8.807  -8.604
  178    HD3  ARG  24           HD1      ARG  24  61.668   8.171  -6.959
  179   HH11  ARG  24          HH21      ARG  24  59.905   8.960  -8.535
  180   HH12  ARG  24          HH22      ARG  24  58.588  10.084  -8.470
  181   HH21  ARG  24          HH11      ARG  24  60.260  12.332  -6.427
  182   HH22  ARG  24          HH12      ARG  24  58.790  11.994  -7.277
  183    H    LYS  25           HN       LYS  25  64.283   9.910 -11.576
  184    HA   LYS  25           HA       LYS  25  66.988  10.778 -11.419
  185    HB2  LYS  25           HB2      LYS  25  66.351  12.579 -12.854
  186    HB3  LYS  25           HB1      LYS  25  65.331  11.217 -13.307
  187    HG2  LYS  25           HG2      LYS  25  64.531  13.480 -11.449
  188    HG3  LYS  25           HG1      LYS  25  63.987  13.277 -13.115
  189    HD2  LYS  25           HD2      LYS  25  63.165  10.945 -12.354
  190    HD3  LYS  25           HD1      LYS  25  63.350  11.566 -10.714
  191    HE2  LYS  25           HE2      LYS  25  61.833  13.421 -11.212
  192    HE3  LYS  25           HE1      LYS  25  61.693  12.883 -12.886
  193    HZ1  LYS  25           HZ1      LYS  25  61.007  10.658 -11.708
  194    HZ2  LYS  25           HZ2      LYS  25  59.872  11.889 -11.994
  195    HZ3  LYS  25           HZ3      LYS  25  60.565  11.710 -10.454
  196    H    GLY  26           HN       GLY  26  67.495  13.201 -10.859
  197    HA2  GLY  26           HA2      GLY  26  67.681  14.848  -9.199
  198    HA3  GLY  26           HA1      GLY  26  65.996  14.514  -8.799
  199    HA   PRO  27           HA       PRO  27  68.599  11.435  -6.173
  200    HB2  PRO  27           HB2      PRO  27  71.405  12.172  -6.454
  201    HB3  PRO  27           HB1      PRO  27  70.623  10.632  -6.848
  202    HG2  PRO  27           HG2      PRO  27  71.650  12.351  -8.695
  203    HG3  PRO  27           HG1      PRO  27  70.360  11.185  -9.027
  204    HD2  PRO  27           HD2      PRO  27  70.153  14.140  -8.549
  205    HD3  PRO  27           HD1      PRO  27  69.212  13.105  -9.650
  206    HA   PRO  28           HA       PRO  28  69.231  13.762  -2.468
  207    HB2  PRO  28           HB2      PRO  28  71.952  12.579  -2.089
  208    HB3  PRO  28           HB1      PRO  28  70.577  12.627  -0.968
  209    HG2  PRO  28           HG2      PRO  28  71.249  10.399  -2.272
  210    HG3  PRO  28           HG1      PRO  28  69.561  10.808  -1.924
  211    HD2  PRO  28           HD2      PRO  28  71.022  10.906  -4.521
  212    HD3  PRO  28           HD1      PRO  28  69.294  10.634  -4.206
  213    H    LYS  29           HN       LYS  29  70.544  15.540  -1.493
  214    HA   LYS  29           HA       LYS  29  71.894  17.096  -3.582
  215    HB2  LYS  29           HB2      LYS  29  70.316  17.992  -1.722
  216    HB3  LYS  29           HB1      LYS  29  71.726  17.872  -0.670
  217    HG2  LYS  29           HG2      LYS  29  73.003  19.337  -2.145
  218    HG3  LYS  29           HG1      LYS  29  71.666  19.391  -3.294
  219    HD2  LYS  29           HD2      LYS  29  71.127  21.298  -2.155
  220    HD3  LYS  29           HD1      LYS  29  70.377  20.161  -1.035
  221    HE2  LYS  29           HE2      LYS  29  72.402  20.123   0.335
  222    HE3  LYS  29           HE1      LYS  29  73.223  21.184  -0.810
  223    HZ1  LYS  29           HZ1      LYS  29  72.467  22.635   0.798
  224    HZ2  LYS  29           HZ2      LYS  29  71.003  21.804   1.025
  225    HZ3  LYS  29           HZ3      LYS  29  71.244  22.739  -0.373
  226    H1U  RCY  30           H1U      RCY  30  77.470  10.417  -4.682
  227    H1S  RCY  30           H1S      RCY  30  75.311  12.283  -3.529
  228    HB1  RCY  30           HB1      RCY  30  77.149  14.965  -2.896
  229    HB2  RCY  30           HB2      RCY  30  76.039  15.183  -4.249
  230    HA   RCY  30           HA       RCY  30  75.864  16.574  -1.558
  231    HN1  RCY  30           HN1      RCY  30  74.089  17.274  -3.820
  232    H    LYS  31           HN       LYS  31  78.181  17.105  -2.129
  233    HA   LYS  31           HA       LYS  31  78.231  19.550  -3.809
  234    HB2  LYS  31           HB2      LYS  31  79.119  19.690  -1.513
  235    HB3  LYS  31           HB1      LYS  31  80.258  18.395  -1.870
  236    HG2  LYS  31           HG2      LYS  31  80.717  20.180  -3.934
  237    HG3  LYS  31           HG1      LYS  31  80.404  21.247  -2.564
  238    HD2  LYS  31           HD2      LYS  31  82.328  18.915  -2.421
  239    HD3  LYS  31           HD1      LYS  31  82.832  20.547  -2.859
  240    HE2  LYS  31           HE2      LYS  31  82.027  21.415  -0.728
  241    HE3  LYS  31           HE1      LYS  31  81.384  19.831  -0.293
  242    HZ1  LYS  31           HZ1      LYS  31  83.403  19.066   0.247
  243    HZ2  LYS  31           HZ2      LYS  31  83.823  20.707   0.378
  244    HZ3  LYS  31           HZ3      LYS  31  84.175  19.849  -1.045
  245    H    GLN  32           HN       GLN  32  81.233  17.998  -3.362
  246    HA   GLN  32           HA       GLN  32  81.230  16.268  -5.661
  247    HB2  GLN  32           HB2      GLN  32  81.015  18.407  -6.869
  248    HB3  GLN  32           HB1      GLN  32  82.448  19.021  -6.043
  249    HG2  GLN  32           HG2      GLN  32  83.858  17.390  -7.097
  250    HG3  GLN  32           HG1      GLN  32  82.468  16.505  -7.726
  251   HE21  GLN  32          HE21      GLN  32  83.643  16.923  -9.886
  252   HE22  GLN  32          HE22      GLN  32  83.332  18.394 -10.674
  253    H    ARG  33           HN       ARG  33  82.961  14.923  -5.418
  254    HA   ARG  33           HA       ARG  33  85.014  15.663  -3.409
  255    HE   ARG  33           HE       ARG  33  81.321  13.269  -6.514
  256    HB2  ARG  33           HB2      ARG  33  85.711  13.217  -3.795
  257    HB3  ARG  33           HB1      ARG  33  84.141  13.483  -3.037
  258    HG2  ARG  33           HG2      ARG  33  84.194  13.364  -6.015
  259    HG3  ARG  33           HG1      ARG  33  84.445  11.847  -5.150
  260    HD2  ARG  33           HD2      ARG  33  82.337  11.921  -4.139
  261    HD3  ARG  33           HD1      ARG  33  82.188  13.665  -4.353
  262   HH11  ARG  33          HH21      ARG  33  82.929  10.507  -5.221
  263   HH12  ARG  33          HH22      ARG  33  82.441   9.455  -6.508
  264   HH21  ARG  33          HH11      ARG  33  80.675  11.912  -8.202
  265   HH22  ARG  33          HH12      ARG  33  81.165  10.251  -8.195
  266    H    GLN  34           HN       GLN  34  86.141  13.357  -5.599
  267    HA   GLN  34           HA       GLN  34  87.222  15.097  -7.630
  268    HB2  GLN  34           HB2      GLN  34  89.538  15.165  -6.948
  269    HB3  GLN  34           HB1      GLN  34  88.572  15.791  -5.614
  270    HG2  GLN  34           HG2      GLN  34  89.665  12.971  -5.860
  271    HG3  GLN  34           HG1      GLN  34  90.237  14.217  -4.749
  272   HE21  GLN  34          HE21      GLN  34  88.212  15.212  -3.414
  273   HE22  GLN  34          HE22      GLN  34  87.182  14.040  -2.744
  274    H    THR  35           HN       THR  35  87.449  12.069  -5.833
  275    HA   THR  35           HA       THR  35  87.403  10.526  -8.281
  276    HB   THR  35           HB       THR  35  89.943  10.152  -6.709
  277    HG1  THR  35           HG1      THR  35  90.575  11.505  -8.807
  278   HG21  THR  35          HG21      THR  35  90.680   9.030  -8.649
  279   HG22  THR  35          HG22      THR  35  89.463   9.803  -9.664
  280   HG23  THR  35          HG23      THR  35  88.987   8.557  -8.510
  281    H    ARG  36           HN       ARG  36  89.087   8.441  -6.679
  282    HA   ARG  36           HA       ARG  36  87.284   7.867  -4.421
  283    HE   ARG  36           HE       ARG  36  86.805   7.675  -8.747
  284    HB2  ARG  36           HB2      ARG  36  86.698   5.616  -5.289
  285    HB3  ARG  36           HB1      ARG  36  86.060   6.900  -6.315
  286    HG2  ARG  36           HG2      ARG  36  88.469   6.549  -7.493
  287    HG3  ARG  36           HG1      ARG  36  88.203   4.916  -6.880
  288    HD2  ARG  36           HD2      ARG  36  87.239   4.988  -9.078
  289    HD3  ARG  36           HD1      ARG  36  85.895   5.014  -7.936
  290   HH11  ARG  36          HH21      ARG  36  84.786   4.953  -9.380
  291   HH12  ARG  36          HH22      ARG  36  83.627   5.857 -10.296
  292   HH21  ARG  36          HH11      ARG  36  85.303   8.872  -9.940
  293   HH22  ARG  36          HH12      ARG  36  83.920   8.076 -10.613
  294    H    GLN  37           HN       GLN  37  89.357   8.154  -3.319
  295    HA   GLN  37           HA       GLN  37  91.643   6.514  -3.916
  296    HB2  GLN  37           HB2      GLN  37  91.446   8.674  -2.443
  297    HB3  GLN  37           HB1      GLN  37  91.057   7.543  -1.147
  298    HG2  GLN  37           HG2      GLN  37  93.179   6.260  -1.926
  299    HG3  GLN  37           HG1      GLN  37  93.600   7.761  -2.750
  300   HE21  GLN  37          HE21      GLN  37  94.420   9.479  -1.474
  301   HE22  GLN  37          HE22      GLN  37  94.563   9.411   0.216
  302    H1U  RCY  38           H1U      RCY  38  85.858   0.805   4.449
  303    H1S  RCY  38           H1S      RCY  38  88.057   0.387   0.482
  304    HB1  RCY  38           HB1      RCY  38  88.848   4.474  -0.874
  305    HB2  RCY  38           HB2      RCY  38  89.184   3.853   0.739
  306    HA   RCY  38           HA       RCY  38  91.414   3.834   0.359
  307    HN1  RCY  38           HN1      RCY  38  91.813   5.744  -0.931
  308    H    LYS  39           HN       LYS  39  90.606   3.418  -3.091
  309    HA   LYS  39           HA       LYS  39  91.146   1.686  -4.574
  310    HB2  LYS  39           HB2      LYS  39  93.467   1.201  -2.687
  311    HB3  LYS  39           HB1      LYS  39  93.391   0.838  -4.411
  312    HG2  LYS  39           HG2      LYS  39  93.087   3.302  -4.840
  313    HG3  LYS  39           HG1      LYS  39  93.396   3.581  -3.126
  314    HD2  LYS  39           HD2      LYS  39  95.508   3.864  -4.178
  315    HD3  LYS  39           HD1      LYS  39  95.568   2.250  -3.469
  316    HE2  LYS  39           HE2      LYS  39  95.354   1.187  -5.533
  317    HE3  LYS  39           HE1      LYS  39  94.578   2.582  -6.284
  318    HZ1  LYS  39           HZ1      LYS  39  97.436   2.293  -5.546
  319    HZ2  LYS  39           HZ2      LYS  39  96.735   3.765  -6.026
  320    HZ3  LYS  39           HZ3      LYS  39  96.785   2.453  -7.105
  321    H    SER  40           HN       SER  40  92.551   0.076  -1.746
  322    HA   SER  40           HA       SER  40  90.231  -1.793  -1.675
  323    HG   SER  40           HG       SER  40  92.935  -4.275  -1.148
  324    HB2  SER  40           HB2      SER  40  91.664  -3.071  -3.027
  325    HB3  SER  40           HB1      SER  40  93.113  -2.470  -2.225
  326    H    LYS  41           HN       LYS  41  92.676  -0.008  -0.095
  327    HA   LYS  41           HA       LYS  41  93.038  -1.463   2.305
  328    HB2  LYS  41           HB2      LYS  41  93.015   1.503   1.717
  329    HB3  LYS  41           HB1      LYS  41  93.367   0.873   3.326
  330    HG2  LYS  41           HG2      LYS  41  95.246  -0.412   2.466
  331    HG3  LYS  41           HG1      LYS  41  94.855   0.061   0.812
  332    HD2  LYS  41           HD2      LYS  41  95.405   2.352   1.240
  333    HD3  LYS  41           HD1      LYS  41  95.489   2.074   2.980
  334    HE2  LYS  41           HE2      LYS  41  97.735   2.202   1.784
  335    HE3  LYS  41           HE1      LYS  41  97.479   0.759   2.765
  336    HZ1  LYS  41           HZ1      LYS  41  97.483  -0.553   0.975
  337    HZ2  LYS  41           HZ2      LYS  41  98.225   0.752   0.179
  338    HZ3  LYS  41           HZ3      LYS  41  96.547   0.518   0.050
  339    HA   PRO  42           HA       PRO  42  89.022  -1.208   4.164
  340    HB2  PRO  42           HB2      PRO  42  89.656  -1.473   6.803
  341    HB3  PRO  42           HB1      PRO  42  89.779  -2.815   5.648
  342    HG2  PRO  42           HG2      PRO  42  91.926  -1.052   6.719
  343    HG3  PRO  42           HG1      PRO  42  91.942  -2.799   6.423
  344    HD2  PRO  42           HD2      PRO  42  93.073  -0.978   4.706
  345    HD3  PRO  42           HD1      PRO  42  92.433  -2.550   4.176
  346    HA   PRO  43           HA       PRO  43  88.392   2.988   5.496
  347    HB2  PRO  43           HB2      PRO  43  86.030   2.775   6.838
  348    HB3  PRO  43           HB1      PRO  43  86.145   2.618   5.074
  349    HG2  PRO  43           HG2      PRO  43  85.930   0.490   7.144
  350    HG3  PRO  43           HG1      PRO  43  85.157   0.601   5.554
  351    HD2  PRO  43           HD2      PRO  43  87.378  -0.943   6.043
  352    HD3  PRO  43           HD1      PRO  43  86.999  -0.251   4.450
  353    H    LYS  44           HN       LYS  44  88.707   4.354   7.312
  354    HA   LYS  44           HA       LYS  44  90.085   3.285   9.559
  355    HB2  LYS  44           HB2      LYS  44  88.882   5.932   8.859
  356    HB3  LYS  44           HB1      LYS  44  89.289   5.649  10.551
  357    HG2  LYS  44           HG2      LYS  44  91.589   5.167   9.991
  358    HG3  LYS  44           HG1      LYS  44  91.224   5.193   8.265
  359    HD2  LYS  44           HD2      LYS  44  92.173   7.322   8.703
  360    HD3  LYS  44           HD1      LYS  44  90.435   7.615   8.648
  361    HE2  LYS  44           HE2      LYS  44  91.587   8.704  10.605
  362    HE3  LYS  44           HE1      LYS  44  90.291   7.599  11.064
  363    HZ1  LYS  44           HZ1      LYS  44  93.140   6.792  10.910
  364    HZ2  LYS  44           HZ2      LYS  44  91.850   5.923  11.594
  365    HZ3  LYS  44           HZ3      LYS  44  92.408   7.345  12.337
  366    H    LYS  45           HN       LYS  45  88.978   4.321  11.854
  367    HA   LYS  45           HA       LYS  45  86.989   2.354  12.515
  368    HB2  LYS  45           HB2      LYS  45  87.983   4.830  13.943
  369    HB3  LYS  45           HB1      LYS  45  86.769   3.758  14.638
  370    HG2  LYS  45           HG2      LYS  45  88.942   3.070  15.464
  371    HG3  LYS  45           HG1      LYS  45  88.372   1.847  14.328
  372    HD2  LYS  45           HD2      LYS  45  89.859   2.525  12.648
  373    HD3  LYS  45           HD1      LYS  45  90.078   4.126  13.356
  374    HE2  LYS  45           HE2      LYS  45  91.967   2.313  13.631
  375    HE3  LYS  45           HE1      LYS  45  91.546   3.350  14.994
  376    HZ1  LYS  45           HZ1      LYS  45  91.684   0.914  15.490
  377    HZ2  LYS  45           HZ2      LYS  45  90.295   0.704  14.534
  378    HZ3  LYS  45           HZ3      LYS  45  90.227   1.658  15.938
  379    H    GLY  46           HN       GLY  46  85.233   2.684  11.027
  380    HA2  GLY  46           HA2      GLY  46  83.923   5.098  10.456
  381    HA3  GLY  46           HA1      GLY  46  83.104   3.536  10.503
  382    H    VAL  47           HN       VAL  47  82.877   2.753  12.958
  383    HA   VAL  47           HA       VAL  47  81.507   3.109  14.840
  384    HB   VAL  47           HB       VAL  47  83.485   5.394  15.031
  385   HG11  VAL  47          HG11      VAL  47  82.904   5.008  17.557
  386   HG12  VAL  47          HG12      VAL  47  81.408   4.323  16.924
  387   HG13  VAL  47          HG13      VAL  47  81.828   5.999  16.571
  388   HG21  VAL  47          HG21      VAL  47  84.733   3.867  16.459
  389   HG22  VAL  47          HG22      VAL  47  84.412   3.064  14.922
  390   HG23  VAL  47          HG23      VAL  47  83.453   2.660  16.346
  391    H    GLN  48           HN       GLN  48  79.649   3.644  13.500
  392    HA   GLN  48           HA       GLN  48  78.081   5.187  12.517
  393    HB2  GLN  48           HB2      GLN  48  77.011   6.408  14.545
  394    HB3  GLN  48           HB1      GLN  48  77.015   4.645  14.544
  395    HG2  GLN  48           HG2      GLN  48  78.992   4.605  15.972
  396    HG3  GLN  48           HG1      GLN  48  79.112   6.364  15.903
  397   HE21  GLN  48          HE21      GLN  48  77.796   7.581  17.338
  398   HE22  GLN  48          HE22      GLN  48  76.692   6.880  18.419
  399    H    GLY  49           HN       GLY  49  79.630   6.535  11.287
  400    HA2  GLY  49           HA2      GLY  49  79.515   9.046  10.899
  401    HA3  GLY  49           HA1      GLY  49  80.069   9.207  12.567
  402    H1U  RCY  50           H1U      RCY  50  82.625   3.687   5.125
  403    H1S  RCY  50           H1S      RCY  50  80.522   7.214   6.220
  404    HB1  RCY  50           HB1      RCY  50  82.968   6.800   7.764
  405    HB2  RCY  50           HB2      RCY  50  84.089   8.133   7.488
  406    HA   RCY  50           HA       RCY  50  83.688   7.330   9.939
  407    HN1  RCY  50           HN1      RCY  50  81.024   8.103   9.342
  408    H    GLY  51           HN       GLY  51  83.209  10.260   8.021
  409    HA2  GLY  51           HA2      GLY  51  85.267  11.595   9.714
  410    HA3  GLY  51           HA1      GLY  51  84.862  12.053   8.059
  411    H    ASP  52           HN       ASP  52  82.968  13.316   7.691
  412    HA   ASP  52           HA       ASP  52  81.297  14.111   9.969
  413    HB2  ASP  52           HB2      ASP  52  83.194  16.061   8.630
  414    HB3  ASP  52           HB1      ASP  52  81.836  16.554   9.643
  415    H    ASP  53           HN       ASP  53  81.735  13.484   6.749
  416    HA   ASP  53           HA       ASP  53  79.556  15.287   5.826
  417    HB2  ASP  53           HB2      ASP  53  81.440  13.425   4.354
  418    HB3  ASP  53           HB1      ASP  53  80.132  14.310   3.567
  419    H    ILE  54           HN       ILE  54  77.833  14.195   6.977
  420    HA   ILE  54           HA       ILE  54  77.004  11.646   5.653
  421    HB   ILE  54           HB       ILE  54  76.530  12.199   8.589
  422   HG12  ILE  54          HG12      ILE  54  78.427  10.296   8.653
  423   HG13  ILE  54          HG11      ILE  54  78.944  11.140   7.192
  424   HG21  ILE  54          HG21      ILE  54  75.173  10.500   7.208
  425   HG22  ILE  54          HG22      ILE  54  75.925   9.904   8.688
  426   HG23  ILE  54          HG23      ILE  54  76.663   9.560   7.124
  427   HD11  ILE  54          HD11      ILE  54  78.581  13.291   8.688
  428   HD12  ILE  54          HD12      ILE  54  80.075  12.362   8.813
  429   HD13  ILE  54          HD13      ILE  54  78.799  12.147  10.012
  430    HA   PRO  55           HA       PRO  55  73.566  14.709   5.671
  431    HB2  PRO  55           HB2      PRO  55  73.260  14.978   2.998
  432    HB3  PRO  55           HB1      PRO  55  74.519  15.848   3.896
  433    HG2  PRO  55           HG2      PRO  55  74.754  13.514   2.106
  434    HG3  PRO  55           HG1      PRO  55  75.925  14.790   2.464
  435    HD2  PRO  55           HD2      PRO  55  75.862  12.167   3.578
  436    HD3  PRO  55           HD1      PRO  55  76.922  13.508   4.060
  437    H    GLY  56           HN       GLY  56  73.389  12.635   2.776
  438    HA2  GLY  56           HA2      GLY  56  70.629  11.954   3.350
  439    HA3  GLY  56           HA1      GLY  56  71.589  11.325   2.014
  440    H    MET  57           HN       MET  57  73.596  10.614   4.397
  441    HA   MET  57           HA       MET  57  72.570   7.870   4.611
  442    HB2  MET  57           HB2      MET  57  74.875   8.391   6.299
  443    HB3  MET  57           HB1      MET  57  74.745   7.334   4.898
  444    HG2  MET  57           HG2      MET  57  75.027   9.311   3.411
  445    HG3  MET  57           HG1      MET  57  75.244  10.325   4.838
  446    HE1  MET  57           HE1      MET  57  77.532  10.686   2.961
  447    HE2  MET  57           HE2      MET  57  76.924   9.259   2.127
  448    HE3  MET  57           HE3      MET  57  78.605   9.316   2.651
  449    H    GLU  58           HN       GLU  58  70.788   7.863   5.971
  450    HA   GLU  58           HA       GLU  58  71.275   7.972   8.811
  451    HB2  GLU  58           HB2      GLU  58  71.107  10.445   8.133
  452    HB3  GLU  58           HB1      GLU  58  69.405  10.122   7.799
  453    HG2  GLU  58           HG2      GLU  58  69.523  10.928  10.059
  454    HG3  GLU  58           HG1      GLU  58  69.230   9.190  10.154
  455    H    GLY  59           HN       GLY  59  69.036   7.863   6.108
  456    HA2  GLY  59           HA2      GLY  59  66.805   6.851   7.685
  457    HA3  GLY  59           HA1      GLY  59  66.901   6.870   5.923
  458    H1U  RCY  60           H1U      RCY  60  69.043   9.452   5.175
  459    H1S  RCY  60           H1S      RCY  60  71.131   5.617   6.309
  460    HB1  RCY  60           HB1      RCY  60  71.172   2.437   7.828
  461    HB2  RCY  60           HB2      RCY  60  70.300   2.839   9.307
  462    HA   RCY  60           HA       RCY  60  69.404   2.978   6.489
  463    HN1  RCY  60           HN1      RCY  60  69.406   5.436   7.918
  464    H    GLY  61           HN       GLY  61  67.551   1.765   6.402
  465    HA2  GLY  61           HA2      GLY  61  66.676   0.034   8.327
  466    HA3  GLY  61           HA1      GLY  61  65.800   1.508   8.742
  467    H    THR  62           HN       THR  62  66.428   1.401   5.437
  468    HA   THR  62           HA       THR  62  63.730   0.218   4.881
  469    HB   THR  62           HB       THR  62  63.572   1.865   3.008
  470    HG1  THR  62           HG1      THR  62  65.308   3.647   3.863
  471   HG21  THR  62          HG21      THR  62  62.413   2.461   5.003
  472   HG22  THR  62          HG22      THR  62  63.318   3.901   4.534
  473   HG23  THR  62          HG23      THR  62  63.913   2.871   5.837
  474    H    ASP  63           HN       ASP  63  65.034  -1.785   4.552
  475    HA   ASP  63           HA       ASP  63  67.034  -1.996   2.519
  476    HB2  ASP  63           HB2      ASP  63  65.120  -4.157   3.438
  477    HB3  ASP  63           HB1      ASP  63  66.701  -4.390   2.690
  478    H    ILE  64           HN       ILE  64  65.044  -0.424   1.364
  479    HA   ILE  64           HA       ILE  64  64.286  -2.102  -0.944
  480    HB   ILE  64           HB       ILE  64  62.278  -0.563   0.736
  481   HG12  ILE  64          HG12      ILE  64  62.387  -3.456  -0.177
  482   HG13  ILE  64          HG11      ILE  64  62.789  -2.890   1.444
  483   HG21  ILE  64          HG21      ILE  64  61.728  -0.032  -1.521
  484   HG22  ILE  64          HG22      ILE  64  60.671  -1.377  -1.092
  485   HG23  ILE  64          HG23      ILE  64  62.107  -1.662  -2.075
  486   HD11  ILE  64          HD11      ILE  64  60.096  -2.627   0.074
  487   HD12  ILE  64          HD12      ILE  64  60.489  -1.964   1.661
  488   HD13  ILE  64          HD13      ILE  64  60.484  -3.710   1.411
  489    H    THR  65           HN       THR  65  65.213   0.850   0.464
  490    HA   THR  65           HA       THR  65  65.023   2.203  -2.204
  491    HB   THR  65           HB       THR  65  64.621   4.335  -1.022
  492    HG1  THR  65           HG1      THR  65  63.973   3.106   1.343
  493   HG21  THR  65          HG21      THR  65  62.718   2.855  -1.753
  494   HG22  THR  65          HG22      THR  65  62.320   3.928  -0.411
  495   HG23  THR  65          HG23      THR  65  62.653   2.223  -0.108
  496    H    VAL  66           HN       VAL  66  66.331   4.282   0.034
  497    HA   VAL  66           HA       VAL  66  68.905   4.385  -1.027
  498    HB   VAL  66           HB       VAL  66  68.570   4.702   1.945
  499   HG11  VAL  66          HG11      VAL  66  70.700   5.220   0.632
  500   HG12  VAL  66          HG12      VAL  66  70.076   6.532   1.632
  501   HG13  VAL  66          HG13      VAL  66  69.805   6.547  -0.110
  502   HG21  VAL  66          HG21      VAL  66  66.506   5.640   1.215
  503   HG22  VAL  66          HG22      VAL  66  67.247   6.344  -0.223
  504   HG23  VAL  66          HG23      VAL  66  67.602   7.014   1.370
  505    H    ILE  67           HN       ILE  67  67.499   2.002   1.012
  506    HA   ILE  67           HA       ILE  67  70.117   0.556   1.123
  507    HB   ILE  67           HB       ILE  67  67.885   0.350   3.170
  508   HG12  ILE  67          HG12      ILE  67  69.946   1.472   4.517
  509   HG13  ILE  67          HG11      ILE  67  70.206   2.194   2.929
  510   HG21  ILE  67          HG21      ILE  67  69.661  -0.799   4.485
  511   HG22  ILE  67          HG22      ILE  67  70.746  -0.656   3.102
  512   HG23  ILE  67          HG23      ILE  67  69.291  -1.646   2.983
  513   HD11  ILE  67          HD11      ILE  67  67.700   2.766   2.963
  514   HD12  ILE  67          HD12      ILE  67  68.738   3.694   4.045
  515   HD13  ILE  67          HD13      ILE  67  67.752   2.378   4.682
  516    H1U  RCY  68           H1U      RCY  68  71.464   3.336   0.386
  517    H1S  RCY  68           H1S      RCY  68  69.522  -0.152  -0.485
  518    HB1  RCY  68           HB1      RCY  68  67.685  -2.705  -2.726
  519    HB2  RCY  68           HB2      RCY  68  69.409  -2.994  -2.523
  520    HA   RCY  68           HA       RCY  68  67.313  -2.530  -0.475
  521    HN1  RCY  68           HN1      RCY  68  70.001  -1.276  -0.066
  522    HA   PRO  69           HA       PRO  69  68.531  -6.452   1.084
  523    HB2  PRO  69           HB2      PRO  69  68.628  -7.796  -1.507
  524    HB3  PRO  69           HB1      PRO  69  67.460  -7.997  -0.192
  525    HG2  PRO  69           HG2      PRO  69  67.227  -6.446  -2.629
  526    HG3  PRO  69           HG1      PRO  69  65.978  -6.906  -1.466
  527    HD2  PRO  69           HD2      PRO  69  66.851  -4.323  -1.795
  528    HD3  PRO  69           HD1      PRO  69  66.188  -4.939  -0.263
  529    H    TRP  70           HN       TRP  70  70.303  -5.126  -1.645
  530    HA   TRP  70           HA       TRP  70  72.567  -6.924  -1.410
  531    HD1  TRP  70           HD1      TRP  70  74.934  -5.693  -4.347
  532    HE1  TRP  70           HE1      TRP  70  74.639  -7.692  -5.946
  533    HE3  TRP  70           HE3      TRP  70  70.203  -7.141  -3.083
  534    HZ2  TRP  70           HZ2      TRP  70  72.655  -9.651  -6.604
  535    HZ3  TRP  70           HZ3      TRP  70  69.137  -9.071  -4.208
  536    HH2  TRP  70           HH2      TRP  70  70.352 -10.328  -5.964
  537    HB2  TRP  70           HB2      TRP  70  71.843  -4.556  -2.994
  538    HB3  TRP  70           HB1      TRP  70  73.548  -4.578  -2.549
  539    H    GLU  71           HN       GLU  71  71.472  -5.329   0.985
  540    HA   GLU  71           HA       GLU  71  74.140  -4.368   1.932
  541    HB2  GLU  71           HB2      GLU  71  71.441  -3.022   2.198
  542    HB3  GLU  71           HB1      GLU  71  72.778  -2.654   3.288
  543    HG2  GLU  71           HG2      GLU  71  74.040  -2.471   0.880
  544    HG3  GLU  71           HG1      GLU  71  72.419  -1.937   0.435
  545    H    ALA  72           HN       ALA  72  71.595  -6.479   2.340
  546    HA   ALA  72           HA       ALA  72  71.346  -6.506   5.211
  547    HB1  ALA  72           HB1      ALA  72  70.799  -8.599   3.092
  548    HB2  ALA  72           HB2      ALA  72  69.625  -7.575   3.919
  549    HB3  ALA  72           HB3      ALA  72  70.459  -8.853   4.804
  550    H1U  RCY  73           H1U      RCY  73  81.963  -5.587   2.374
  551    H1S  RCY  73           H1S      RCY  73  77.199  -5.047   1.569
  552    HB1  RCY  73           HB1      RCY  73  77.039  -8.505   3.487
  553    HB2  RCY  73           HB2      RCY  73  77.180  -7.175   4.634
  554    HA   RCY  73           HA       RCY  73  75.193  -9.292   4.525
  555    HN1  RCY  73           HN1      RCY  73  74.128  -6.728   3.775
  556    H    ASN  74           HN       ASN  74  75.119  -6.133   6.174
  557    HA   ASN  74           HA       ASN  74  75.519  -5.585   8.419
  558    HB2  ASN  74           HB2      ASN  74  74.198  -8.233   8.415
  559    HB3  ASN  74           HB1      ASN  74  75.089  -7.874   9.891
  560   HD21  ASN  74          HD21      ASN  74  73.614  -7.061  11.388
  561   HD22  ASN  74          HD22      ASN  74  72.424  -5.899  11.047
  562    H    HIS  75           HN       HIS  75  77.781  -6.401   6.844
  563    HA   HIS  75           HA       HIS  75  79.613  -7.074   9.031
  564    HD1  HIS  75           HD1      HIS  75  81.559  -7.510   9.247
  565    HD2  HIS  75           HD2      HIS  75  81.361 -11.106   7.142
  566    HE1  HIS  75           HE1      HIS  75  83.782  -8.671   9.602
  567    HE2  HIS  75           HE2      HIS  75  83.674 -10.861   8.325
  568    HB2  HIS  75           HB2      HIS  75  78.859  -9.310   8.224
  569    HB3  HIS  75           HB1      HIS  75  79.439  -8.894   6.611
  570    H1U  RCY  76           H1U      RCY  76  78.312  -1.356   5.212
  571    H1S  RCY  76           H1S      RCY  76  80.967  -4.669   7.589
  572    HB1  RCY  76           HB1      RCY  76  84.053  -3.902   7.274
  573    HB2  RCY  76           HB2      RCY  76  84.061  -5.294   8.354
  574    HA   RCY  76           HA       RCY  76  82.004  -4.654   6.222
  575    HN1  RCY  76           HN1      RCY  76  81.764  -6.474   8.533
  576    H    GLU  77           HN       GLU  77  81.789  -6.858   4.933
  577    HA   GLU  77           HA       GLU  77  84.144  -8.538   4.804
  578    HB2  GLU  77           HB2      GLU  77  82.088  -8.174   2.614
  579    HB3  GLU  77           HB1      GLU  77  83.079  -9.596   2.944
  580    HG2  GLU  77           HG2      GLU  77  81.921  -9.751   5.197
  581    HG3  GLU  77           HG1      GLU  77  80.807  -8.508   4.625
  582    H    LEU  78           HN       LEU  78  85.259  -8.750   2.528
  583    HA   LEU  78           HA       LEU  78  85.499  -6.321   0.974
  584    HG   LEU  78           HG       LEU  78  88.739  -6.868   3.677
  585    HB2  LEU  78           HB2      LEU  78  87.751  -5.681   1.566
  586    HB3  LEU  78           HB1      LEU  78  86.786  -5.711   3.032
  587   HD11  LEU  78          HD11      LEU  78  88.051  -9.149   4.015
  588   HD12  LEU  78          HD12      LEU  78  86.997  -9.100   2.602
  589   HD13  LEU  78          HD13      LEU  78  86.589  -8.164   4.040
  590   HD21  LEU  78          HD21      LEU  78  88.794  -8.743   1.368
  591   HD22  LEU  78          HD22      LEU  78  90.132  -8.009   2.251
  592   HD23  LEU  78          HD23      LEU  78  89.263  -7.076   1.032
  593    H    HIS  79           HN       HIS  79  85.324  -9.424   0.983
  594    HA   HIS  79           HA       HIS  79  87.056  -9.743  -1.405
  595    HD1  HIS  79           HD1      HIS  79  89.375 -10.909  -2.018
  596    HD2  HIS  79           HD2      HIS  79  87.176 -14.112  -0.499
  597    HE1  HIS  79           HE1      HIS  79  89.946 -12.915  -3.456
  598    HE2  HIS  79           HE2      HIS  79  88.614 -14.871  -2.542
  599    HB2  HIS  79           HB2      HIS  79  88.379 -10.620   0.518
  600    HB3  HIS  79           HB1      HIS  79  87.058 -11.722   0.899
  601    H    GLU  80           HN       GLU  80  84.643 -11.264   0.740
  602    HA   GLU  80           HA       GLU  80  83.660 -13.201  -1.067
  603    HB2  GLU  80           HB2      GLU  80  83.020 -13.005   1.350
  604    HB3  GLU  80           HB1      GLU  80  82.019 -11.616   0.929
  605    HG2  GLU  80           HG2      GLU  80  80.583 -12.941  -0.443
  606    HG3  GLU  80           HG1      GLU  80  81.699 -14.307  -0.413
  607    H    LEU  81           HN       LEU  81  82.555  -9.838  -0.575
  608    HA   LEU  81           HA       LEU  81  80.602  -9.969  -2.702
  609    HG   LEU  81           HG       LEU  81  79.680  -7.442  -0.238
  610    HB2  LEU  81           HB2      LEU  81  81.898  -7.693  -1.192
  611    HB3  LEU  81           HB1      LEU  81  80.763  -7.401  -2.508
  612   HD11  LEU  81          HD11      LEU  81  77.765  -8.415  -1.081
  613   HD12  LEU  81          HD12      LEU  81  78.626  -9.825  -1.697
  614   HD13  LEU  81          HD13      LEU  81  78.697  -8.297  -2.574
  615   HD21  LEU  81          HD21      LEU  81  80.170 -10.422  -0.318
  616   HD22  LEU  81          HD22      LEU  81  79.578  -9.447   1.027
  617   HD23  LEU  81          HD23      LEU  81  81.266  -9.332   0.531
  618    H    ALA  82           HN       ALA  82  84.025  -9.394  -2.584
  619    HA   ALA  82           HA       ALA  82  84.265  -7.976  -5.081
  620    HB1  ALA  82           HB1      ALA  82  86.622  -8.473  -4.934
  621    HB2  ALA  82           HB2      ALA  82  86.323  -9.796  -3.807
  622    HB3  ALA  82           HB3      ALA  82  86.051  -8.128  -3.302
  623    H    GLN  83           HN       GLN  83  82.588 -10.508  -5.044
  624    HA   GLN  83           HA       GLN  83  84.062 -12.399  -6.708
  625    HB2  GLN  83           HB2      GLN  83  81.384 -12.227  -5.481
  626    HB3  GLN  83           HB1      GLN  83  81.388 -13.010  -7.060
  627    HG2  GLN  83           HG2      GLN  83  81.756 -14.665  -5.274
  628    HG3  GLN  83           HG1      GLN  83  83.187 -14.529  -6.296
  629   HE21  GLN  83          HE21      GLN  83  82.956 -15.309  -3.363
  630   HE22  GLN  83          HE22      GLN  83  83.992 -14.239  -2.549
  631    H    TYR  84           HN       TYR  84  81.555  -9.915  -7.266
  632    HA   TYR  84           HA       TYR  84  82.548  -9.417  -9.939
  633    HD1  TYR  84           HD2      TYR  84  79.772 -10.968  -7.727
  634    HD2  TYR  84           HD1      TYR  84  78.613 -10.071 -11.765
  635    HE1  TYR  84           HE2      TYR  84  77.401 -10.822  -7.014
  636    HE2  TYR  84           HE1      TYR  84  76.242  -9.925 -11.052
  637    HH   TYR  84           HH       TYR  84  74.966 -11.161  -8.652
  638    HB2  TYR  84           HB2      TYR  84  80.869 -10.367 -11.275
  639    HB3  TYR  84           HB1      TYR  84  81.152 -11.622 -10.070
  640    H    GLY  85           HN       GLY  85  81.858  -7.940  -7.507
  641    HA2  GLY  85           HA2      GLY  85  79.374  -6.551  -7.792
  642    HA3  GLY  85           HA1      GLY  85  80.777  -5.943  -6.912
  643    H    ILE  86           HN       ILE  86  82.645  -5.847  -9.021
  644    HA   ILE  86           HA       ILE  86  83.357  -4.300 -10.639
  645    HB   ILE  86           HB       ILE  86  80.562  -4.883 -11.663
  646   HG12  ILE  86          HG12      ILE  86  83.199  -5.989 -12.644
  647   HG13  ILE  86          HG11      ILE  86  82.273  -6.785 -11.371
  648   HG21  ILE  86          HG21      ILE  86  81.273  -2.886 -12.747
  649   HG22  ILE  86          HG22      ILE  86  81.666  -4.185 -13.874
  650   HG23  ILE  86          HG23      ILE  86  82.934  -3.462 -12.884
  651   HD11  ILE  86          HD11      ILE  86  80.469  -7.255 -12.801
  652   HD12  ILE  86          HD12      ILE  86  81.870  -7.517 -13.841
  653   HD13  ILE  86          HD13      ILE  86  80.948  -6.018 -13.964
  654    H1U  RCY  87           H1U      RCY  87  76.662  -3.228  -6.054
  655    H1S  RCY  87           H1S      RCY  87  80.146  -0.251  -6.926
  656    HB1  RCY  87           HB1      RCY  87  83.101   0.823  -8.047
  657    HB2  RCY  87           HB2      RCY  87  83.994  -0.697  -8.034
  658    HA   RCY  87           HA       RCY  87  81.093  -0.831  -8.724
  659    HN1  RCY  87           HN1      RCY  87  83.449  -2.480  -9.178
  Start of MODEL   52
    1    HA   MET   1           HA       MET   1  79.205 -28.682   8.773
    2    HB2  MET   1           HB2      MET   1  77.228 -28.259   6.511
    3    HB3  MET   1           HB1      MET   1  78.980 -28.402   6.358
    4    HG2  MET   1           HG2      MET   1  78.156 -30.565   5.832
    5    HG3  MET   1           HG1      MET   1  78.721 -30.695   7.497
    6    HE1  MET   1           HE1      MET   1  75.757 -29.699   5.287
    7    HE2  MET   1           HE2      MET   1  74.474 -30.767   5.852
    8    HE3  MET   1           HE3      MET   1  75.925 -31.452   5.123
    9    H    ASN   2           HN       ASN   2  79.212 -26.798  10.230
   10    HA   ASN   2           HA       ASN   2  79.234 -24.489  10.663
   11    HB2  ASN   2           HB2      ASN   2  79.601 -24.559   7.656
   12    HB3  ASN   2           HB1      ASN   2  79.740 -23.083   8.612
   13   HD21  ASN   2          HD21      ASN   2  81.937 -22.655   8.882
   14   HD22  ASN   2          HD22      ASN   2  83.109 -23.812   9.295
   15    H    LEU   3           HN       LEU   3  78.109 -22.326   9.881
   16    HA   LEU   3           HA       LEU   3  75.370 -22.885   8.851
   17    HG   LEU   3           HG       LEU   3  75.364 -24.127  11.016
   18    HB2  LEU   3           HB2      LEU   3  76.103 -21.629  11.498
   19    HB3  LEU   3           HB1      LEU   3  74.573 -21.250  10.708
   20   HD11  LEU   3          HD11      LEU   3  75.714 -23.317  13.256
   21   HD12  LEU   3          HD12      LEU   3  74.129 -24.089  13.230
   22   HD13  LEU   3          HD13      LEU   3  74.254 -22.331  13.188
   23   HD21  LEU   3          HD21      LEU   3  73.369 -23.535   9.713
   24   HD22  LEU   3          HD22      LEU   3  72.737 -22.607  11.074
   25   HD23  LEU   3          HD23      LEU   3  72.894 -24.359  11.198
   26    H    GLU   4           HN       GLU   4  77.500 -21.689   7.450
   27    HA   GLU   4           HA       GLU   4  77.801 -18.920   7.582
   28    HB2  GLU   4           HB2      GLU   4  77.704 -20.852   5.275
   29    HB3  GLU   4           HB1      GLU   4  77.860 -19.124   4.960
   30    HG2  GLU   4           HG2      GLU   4  79.674 -20.604   6.877
   31    HG3  GLU   4           HG1      GLU   4  80.056 -20.401   5.167
   32    HA   PRO   5           HA       PRO   5  73.813 -17.189   6.840
   33    HB2  PRO   5           HB2      PRO   5  74.475 -14.940   5.384
   34    HB3  PRO   5           HB1      PRO   5  74.676 -15.082   7.141
   35    HG2  PRO   5           HG2      PRO   5  76.698 -15.380   4.981
   36    HG3  PRO   5           HG1      PRO   5  76.850 -14.624   6.576
   37    HD2  PRO   5           HD2      PRO   5  77.822 -17.115   6.048
   38    HD3  PRO   5           HD1      PRO   5  77.215 -16.650   7.653
   39    HA   PRO   6           HA       PRO   6  73.067 -18.795   2.667
   40    HB2  PRO   6           HB2      PRO   6  70.384 -19.132   2.888
   41    HB3  PRO   6           HB1      PRO   6  71.543 -20.228   3.667
   42    HG2  PRO   6           HG2      PRO   6  69.957 -18.010   4.856
   43    HG3  PRO   6           HG1      PRO   6  70.359 -19.599   5.528
   44    HD2  PRO   6           HD2      PRO   6  71.683 -17.253   6.186
   45    HD3  PRO   6           HD1      PRO   6  72.386 -18.878   6.348
   46    H    LYS   7           HN       LYS   7  72.136 -17.950   0.720
   47    HA   LYS   7           HA       LYS   7  71.892 -15.125   0.548
   48    HB2  LYS   7           HB2      LYS   7  70.672 -15.768  -1.700
   49    HB3  LYS   7           HB1      LYS   7  72.391 -16.100  -1.508
   50    HG2  LYS   7           HG2      LYS   7  70.599 -18.229  -0.503
   51    HG3  LYS   7           HG1      LYS   7  70.554 -17.984  -2.249
   52    HD2  LYS   7           HD2      LYS   7  72.967 -18.257  -2.399
   53    HD3  LYS   7           HD1      LYS   7  73.098 -18.356  -0.643
   54    HE2  LYS   7           HE2      LYS   7  71.520 -20.299  -2.354
   55    HE3  LYS   7           HE1      LYS   7  73.147 -20.600  -1.744
   56    HZ1  LYS   7           HZ1      LYS   7  71.404 -21.556  -0.327
   57    HZ2  LYS   7           HZ2      LYS   7  70.788 -19.998  -0.045
   58    HZ3  LYS   7           HZ3      LYS   7  72.345 -20.409   0.496
   59    H    ALA   8           HN       ALA   8  69.198 -17.090  -0.560
   60    HA   ALA   8           HA       ALA   8  67.337 -16.310   1.479
   61    HB1  ALA   8           HB1      ALA   8  67.507 -14.070   0.667
   62    HB2  ALA   8           HB2      ALA   8  66.012 -14.710  -0.013
   63    HB3  ALA   8           HB3      ALA   8  67.459 -14.601  -1.014
   64    H    GLU   9           HN       GLU   9  65.791 -17.859   1.348
   65    HA   GLU   9           HA       GLU   9  65.576 -19.559  -0.995
   66    HB2  GLU   9           HB2      GLU   9  63.621 -20.544   0.296
   67    HB3  GLU   9           HB1      GLU   9  65.164 -20.566   1.151
   68    HG2  GLU   9           HG2      GLU   9  64.559 -18.697   2.501
   69    HG3  GLU   9           HG1      GLU   9  63.179 -18.308   1.474
   70    H1U  RCY  10           H1U      RCY  10  63.627  -9.987  -0.275
   71    H1S  RCY  10           H1S      RCY  10  60.140 -13.137  -1.481
   72    HB1  RCY  10           HB1      RCY  10  63.072 -14.432  -2.476
   73    HB2  RCY  10           HB2      RCY  10  63.312 -15.256  -0.937
   74    HA   RCY  10           HA       RCY  10  62.251 -17.196  -2.707
   75    HN1  RCY  10           HN1      RCY  10  65.125 -17.070  -1.964
   76    H    ARG  11           HN       ARG  11  61.852 -16.394  -4.821
   77    HA   ARG  11           HA       ARG  11  64.203 -16.377  -6.565
   78    HE   ARG  11           HE       ARG  11  61.274 -20.449  -8.824
   79    HB2  ARG  11           HB2      ARG  11  61.271 -15.927  -7.202
   80    HB3  ARG  11           HB1      ARG  11  62.550 -16.187  -8.388
   81    HG2  ARG  11           HG2      ARG  11  62.994 -18.410  -7.475
   82    HG3  ARG  11           HG1      ARG  11  61.794 -18.154  -6.207
   83    HD2  ARG  11           HD2      ARG  11  60.012 -18.004  -7.861
   84    HD3  ARG  11           HD1      ARG  11  61.182 -18.114  -9.176
   85   HH11  ARG  11          HH21      ARG  11  59.853 -18.776  -6.165
   86   HH12  ARG  11          HH22      ARG  11  59.367 -20.221  -5.344
   87   HH21  ARG  11          HH11      ARG  11  60.647 -22.346  -7.767
   88   HH22  ARG  11          HH12      ARG  11  59.816 -22.242  -6.251
   89    H    SER  12           HN       SER  12  64.499 -14.596  -8.182
   90    HA   SER  12           HA       SER  12  63.615 -11.931  -7.151
   91    HG   SER  12           HG       SER  12  66.488 -13.448  -6.245
   92    HB2  SER  12           HB2      SER  12  66.407 -12.543  -8.156
   93    HB3  SER  12           HB1      SER  12  65.836 -11.030  -7.459
   94    H    ALA  13           HN       ALA  13  65.508 -13.317  -9.862
   95    HA   ALA  13           HA       ALA  13  65.370 -12.890 -12.165
   96    HB1  ALA  13           HB1      ALA  13  62.960 -12.663 -13.000
   97    HB2  ALA  13           HB2      ALA  13  62.470 -12.808 -11.312
   98    HB3  ALA  13           HB3      ALA  13  63.334 -14.131 -12.096
   99    H    THR  14           HN       THR  14  66.343 -10.970 -12.685
  100    HA   THR  14           HA       THR  14  64.632  -8.596 -12.960
  101    HB   THR  14           HB       THR  14  67.155  -8.399 -11.296
  102    HG1  THR  14           HG1      THR  14  65.815  -8.334  -9.532
  103   HG21  THR  14          HG21      THR  14  64.850  -6.461 -11.557
  104   HG22  THR  14          HG22      THR  14  66.265  -6.399 -12.609
  105   HG23  THR  14          HG23      THR  14  66.447  -6.160 -10.871
  106    H    ARG  15           HN       ARG  15  65.089  -8.192 -15.085
  107    HA   ARG  15           HA       ARG  15  67.591  -8.847 -16.336
  108    HE   ARG  15           HE       ARG  15  67.045 -10.413 -17.271
  109    HB2  ARG  15           HB2      ARG  15  65.355  -8.540 -17.504
  110    HB3  ARG  15           HB1      ARG  15  65.570  -6.804 -17.296
  111    HG2  ARG  15           HG2      ARG  15  66.363  -7.503 -19.518
  112    HG3  ARG  15           HG1      ARG  15  67.711  -6.927 -18.536
  113    HD2  ARG  15           HD2      ARG  15  67.797  -9.265 -19.871
  114    HD3  ARG  15           HD1      ARG  15  68.645  -9.016 -18.344
  115   HH11  ARG  15          HH21      ARG  15  66.180  -9.580 -20.503
  116   HH12  ARG  15          HH22      ARG  15  64.885 -10.727 -20.593
  117   HH21  ARG  15          HH11      ARG  15  65.359 -11.915 -17.370
  118   HH22  ARG  15          HH12      ARG  15  64.420 -12.048 -18.820
  119    H    VAL  16           HN       VAL  16  68.744  -7.684 -14.391
  120    HA   VAL  16           HA       VAL  16  69.890  -5.815 -13.524
  121    HB   VAL  16           HB       VAL  16  71.412  -4.841 -15.172
  122   HG11  VAL  16          HG11      VAL  16  70.815  -7.773 -15.669
  123   HG12  VAL  16          HG12      VAL  16  71.895  -7.121 -14.437
  124   HG13  VAL  16          HG13      VAL  16  72.305  -6.958 -16.144
  125   HG21  VAL  16          HG21      VAL  16  71.114  -5.137 -17.537
  126   HG22  VAL  16          HG22      VAL  16  69.571  -4.553 -16.913
  127   HG23  VAL  16          HG23      VAL  16  69.779  -6.263 -17.291
  128    H    MET  17           HN       MET  17  67.010  -5.320 -14.484
  129    HA   MET  17           HA       MET  17  66.795  -2.608 -13.769
  130    HB2  MET  17           HB2      MET  17  67.763  -2.936 -16.461
  131    HB3  MET  17           HB1      MET  17  66.134  -2.271 -16.535
  132    HG2  MET  17           HG2      MET  17  68.398  -1.162 -14.849
  133    HG3  MET  17           HG1      MET  17  67.835  -0.479 -16.374
  134    HE1  MET  17           HE1      MET  17  67.073   1.871 -15.660
  135    HE2  MET  17           HE2      MET  17  65.322   1.915 -15.469
  136    HE3  MET  17           HE3      MET  17  66.038   0.938 -16.749
  137    H    GLY  18           HN       GLY  18  64.560  -1.696 -14.732
  138    HA2  GLY  18           HA2      GLY  18  62.656  -3.793 -15.471
  139    HA3  GLY  18           HA1      GLY  18  62.451  -3.195 -13.824
  140    H    GLY  19           HN       GLY  19  60.698  -2.898 -16.245
  141    HA2  GLY  19           HA2      GLY  19  60.841  -0.110 -17.047
  142    HA3  GLY  19           HA1      GLY  19  59.496  -1.207 -17.365
  143    HA   PRO  20           HA       PRO  20  57.110   0.149 -13.893
  144    HB2  PRO  20           HB2      PRO  20  57.791  -2.055 -12.030
  145    HB3  PRO  20           HB1      PRO  20  56.224  -1.624 -12.738
  146    HG2  PRO  20           HG2      PRO  20  57.591  -3.798 -13.499
  147    HG3  PRO  20           HG1      PRO  20  56.584  -2.869 -14.623
  148    HD2  PRO  20           HD2      PRO  20  59.572  -2.893 -14.350
  149    HD3  PRO  20           HD1      PRO  20  58.574  -2.756 -15.816
  150    H1U  RCY  21           H1U      RCY  21  62.468   3.200  -7.783
  151    H1S  RCY  21           H1S      RCY  21  64.046   1.381 -10.455
  152    HB1  RCY  21           HB1      RCY  21  62.650   1.962 -12.079
  153    HB2  RCY  21           HB2      RCY  21  61.986   0.479 -12.761
  154    HA   RCY  21           HA       RCY  21  60.080   1.762 -10.969
  155    HN1  RCY  21           HN1      RCY  21  59.745   1.218 -13.883
  156    H    THR  22           HN       THR  22  60.035   3.932 -10.606
  157    HA   THR  22           HA       THR  22  60.109   5.754 -12.914
  158    HB   THR  22           HB       THR  22  59.575   7.490 -11.157
  159    HG1  THR  22           HG1      THR  22  58.940   6.510  -9.117
  160   HG21  THR  22          HG21      THR  22  57.831   5.015 -11.290
  161   HG22  THR  22          HG22      THR  22  57.780   6.391 -12.391
  162   HG23  THR  22          HG23      THR  22  57.294   6.590 -10.707
  163    HA   PRO  23           HA       PRO  23  64.412   6.714 -12.169
  164    HB2  PRO  23           HB2      PRO  23  64.647   8.899 -13.777
  165    HB3  PRO  23           HB1      PRO  23  64.498   7.252 -14.423
  166    HG2  PRO  23           HG2      PRO  23  62.424   9.373 -14.175
  167    HG3  PRO  23           HG1      PRO  23  62.708   8.218 -15.488
  168    HD2  PRO  23           HD2      PRO  23  60.751   7.892 -13.575
  169    HD3  PRO  23           HD1      PRO  23  61.506   6.541 -14.450
  170    H    ARG  24           HN       ARG  24  65.566   8.054 -10.771
  171    HA   ARG  24           HA       ARG  24  64.874   9.338  -8.633
  172    HE   ARG  24           HE       ARG  24  67.122   9.224 -13.490
  173    HB2  ARG  24           HB2      ARG  24  66.312  11.491  -9.638
  174    HB3  ARG  24           HB1      ARG  24  67.008  10.054  -8.896
  175    HG2  ARG  24           HG2      ARG  24  68.073  10.351 -11.045
  176    HG3  ARG  24           HG1      ARG  24  66.989   8.965 -11.175
  177    HD2  ARG  24           HD2      ARG  24  65.228  10.614 -12.038
  178    HD3  ARG  24           HD1      ARG  24  66.547  11.774 -12.201
  179   HH11  ARG  24          HH21      ARG  24  65.591  12.304 -13.722
  180   HH12  ARG  24          HH22      ARG  24  65.665  12.359 -15.452
  181   HH21  ARG  24          HH11      ARG  24  67.228   9.278 -15.747
  182   HH22  ARG  24          HH12      ARG  24  66.592  10.646 -16.598
  183    H    LYS  25           HN       LYS  25  62.599   9.825  -8.741
  184    HA   LYS  25           HA       LYS  25  61.601  11.970 -10.421
  185    HB2  LYS  25           HB2      LYS  25  60.385   9.945  -9.120
  186    HB3  LYS  25           HB1      LYS  25  60.152  11.213  -7.921
  187    HG2  LYS  25           HG2      LYS  25  58.261  11.494  -9.263
  188    HG3  LYS  25           HG1      LYS  25  59.383  12.642  -9.994
  189    HD2  LYS  25           HD2      LYS  25  59.936  11.114 -11.757
  190    HD3  LYS  25           HD1      LYS  25  59.108   9.783 -10.948
  191    HE2  LYS  25           HE2      LYS  25  57.841  10.913 -12.873
  192    HE3  LYS  25           HE1      LYS  25  56.964  10.733 -11.354
  193    HZ1  LYS  25           HZ1      LYS  25  58.457  13.145 -11.384
  194    HZ2  LYS  25           HZ2      LYS  25  56.788  12.918 -11.165
  195    HZ3  LYS  25           HZ3      LYS  25  57.429  13.071 -12.731
  196    H    GLY  26           HN       GLY  26  62.842  11.737  -7.126
  197    HA2  GLY  26           HA2      GLY  26  62.004  14.377  -6.308
  198    HA3  GLY  26           HA1      GLY  26  63.252  13.409  -5.522
  199    HA   PRO  27           HA       PRO  27  65.120  17.246  -7.560
  200    HB2  PRO  27           HB2      PRO  27  66.824  16.841  -5.135
  201    HB3  PRO  27           HB1      PRO  27  66.170  18.344  -5.813
  202    HG2  PRO  27           HG2      PRO  27  65.132  17.222  -3.629
  203    HG3  PRO  27           HG1      PRO  27  64.125  18.064  -4.819
  204    HD2  PRO  27           HD2      PRO  27  64.382  15.138  -4.307
  205    HD3  PRO  27           HD1      PRO  27  62.994  16.059  -4.925
  206    HA   PRO  28           HA       PRO  28  68.425  15.297  -9.763
  207    HB2  PRO  28           HB2      PRO  28  70.268  17.273  -8.455
  208    HB3  PRO  28           HB1      PRO  28  70.133  16.823 -10.166
  209    HG2  PRO  28           HG2      PRO  28  69.085  19.091  -9.204
  210    HG3  PRO  28           HG1      PRO  28  68.326  18.182 -10.520
  211    HD2  PRO  28           HD2      PRO  28  67.425  18.507  -7.721
  212    HD3  PRO  28           HD1      PRO  28  66.490  18.043  -9.159
  213    H    LYS  29           HN       LYS  29  69.507  13.427  -9.234
  214    HA   LYS  29           HA       LYS  29  69.803  12.439  -6.645
  215    HB2  LYS  29           HB2      LYS  29  71.931  11.735  -8.635
  216    HB3  LYS  29           HB1      LYS  29  70.995  10.684  -7.573
  217    HG2  LYS  29           HG2      LYS  29  69.929  10.199  -9.556
  218    HG3  LYS  29           HG1      LYS  29  68.983  11.612  -9.087
  219    HD2  LYS  29           HD2      LYS  29  69.573  12.183 -11.264
  220    HD3  LYS  29           HD1      LYS  29  70.888  12.929 -10.356
  221    HE2  LYS  29           HE2      LYS  29  71.955  11.728 -12.112
  222    HE3  LYS  29           HE1      LYS  29  72.154  10.719 -10.679
  223    HZ1  LYS  29           HZ1      LYS  29  70.052  10.402 -12.754
  224    HZ2  LYS  29           HZ2      LYS  29  70.216   9.441 -11.362
  225    HZ3  LYS  29           HZ3      LYS  29  71.417   9.413 -12.563
  226    H1U  RCY  30           H1U      RCY  30  76.780   9.025  -1.981
  227    H1S  RCY  30           H1S      RCY  30  77.120  10.892  -6.456
  228    HB1  RCY  30           HB1      RCY  30  73.934  13.179  -5.283
  229    HB2  RCY  30           HB2      RCY  30  75.436  14.052  -5.581
  230    HA   RCY  30           HA       RCY  30  73.567  15.337  -6.481
  231    HN1  RCY  30           HN1      RCY  30  72.664  13.515  -8.518
  232    H    LYS  31           HN       LYS  31  73.839  13.700  -9.441
  233    HA   LYS  31           HA       LYS  31  75.301  13.937 -11.275
  234    HB2  LYS  31           HB2      LYS  31  73.962  16.191 -10.870
  235    HB3  LYS  31           HB1      LYS  31  75.563  16.824 -10.501
  236    HG2  LYS  31           HG2      LYS  31  75.454  17.184 -12.804
  237    HG3  LYS  31           HG1      LYS  31  76.242  15.607 -12.739
  238    HD2  LYS  31           HD2      LYS  31  74.186  14.463 -13.203
  239    HD3  LYS  31           HD1      LYS  31  73.242  15.934 -12.969
  240    HE2  LYS  31           HE2      LYS  31  75.393  15.843 -15.071
  241    HE3  LYS  31           HE1      LYS  31  73.798  15.171 -15.407
  242    HZ1  LYS  31           HZ1      LYS  31  72.840  17.317 -14.722
  243    HZ2  LYS  31           HZ2      LYS  31  73.852  17.454 -16.080
  244    HZ3  LYS  31           HZ3      LYS  31  74.406  17.948 -14.551
  245    H    GLN  32           HN       GLN  32  77.200  12.829 -10.673
  246    HA   GLN  32           HA       GLN  32  79.561  14.441 -10.365
  247    HB2  GLN  32           HB2      GLN  32  80.256  13.782  -8.134
  248    HB3  GLN  32           HB1      GLN  32  78.665  14.534  -8.021
  249    HG2  GLN  32           HG2      GLN  32  77.652  12.228  -8.124
  250    HG3  GLN  32           HG1      GLN  32  79.284  11.568  -8.007
  251   HE21  GLN  32          HE21      GLN  32  78.515  14.550  -6.306
  252   HE22  GLN  32          HE22      GLN  32  78.514  13.880  -4.746
  253    H    ARG  33           HN       ARG  33  77.979  11.347 -10.264
  254    HA   ARG  33           HA       ARG  33  78.888   9.154 -10.498
  255    HE   ARG  33           HE       ARG  33  81.399  11.137 -16.098
  256    HB2  ARG  33           HB2      ARG  33  79.269   8.771 -12.802
  257    HB3  ARG  33           HB1      ARG  33  78.188  10.160 -12.743
  258    HG2  ARG  33           HG2      ARG  33  80.292  11.620 -12.827
  259    HG3  ARG  33           HG1      ARG  33  81.172  10.151 -13.250
  260    HD2  ARG  33           HD2      ARG  33  79.670   9.814 -15.186
  261    HD3  ARG  33           HD1      ARG  33  78.812  11.298 -14.772
  262   HH11  ARG  33          HH21      ARG  33  79.328  12.946 -14.019
  263   HH12  ARG  33          HH22      ARG  33  80.051  14.472 -14.405
  264   HH21  ARG  33          HH11      ARG  33  82.356  13.119 -16.614
  265   HH22  ARG  33          HH12      ARG  33  81.766  14.569 -15.875
  266    H    GLN  34           HN       GLN  34  80.561   8.279  -9.438
  267    HA   GLN  34           HA       GLN  34  82.747   7.851  -8.723
  268    HB2  GLN  34           HB2      GLN  34  83.170   8.733 -11.582
  269    HB3  GLN  34           HB1      GLN  34  84.514   8.234 -10.558
  270    HG2  GLN  34           HG2      GLN  34  82.059   6.508 -10.888
  271    HG3  GLN  34           HG1      GLN  34  83.413   6.413 -12.015
  272   HE21  GLN  34          HE21      GLN  34  84.599   7.304  -8.976
  273   HE22  GLN  34          HE22      GLN  34  85.064   5.767  -8.426
  274    H    THR  35           HN       THR  35  82.834   9.457  -7.094
  275    HA   THR  35           HA       THR  35  83.600  12.202  -7.733
  276    HB   THR  35           HB       THR  35  83.696  12.498  -5.290
  277    HG1  THR  35           HG1      THR  35  83.582   9.687  -5.385
  278   HG21  THR  35          HG21      THR  35  81.492  12.544  -6.370
  279   HG22  THR  35          HG22      THR  35  81.372  11.826  -4.764
  280   HG23  THR  35          HG23      THR  35  81.357  10.794  -6.194
  281    H    ARG  36           HN       ARG  36  85.353  11.139  -5.050
  282    HA   ARG  36           HA       ARG  36  87.887  11.777  -6.193
  283    HE   ARG  36           HE       ARG  36  86.976  15.238  -3.764
  284    HB2  ARG  36           HB2      ARG  36  86.973  10.403  -3.690
  285    HB3  ARG  36           HB1      ARG  36  88.677  10.293  -4.130
  286    HG2  ARG  36           HG2      ARG  36  88.292  12.235  -2.669
  287    HG3  ARG  36           HG1      ARG  36  88.788  12.763  -4.277
  288    HD2  ARG  36           HD2      ARG  36  86.477  13.230  -4.887
  289    HD3  ARG  36           HD1      ARG  36  85.907  12.579  -3.350
  290   HH11  ARG  36          HH21      ARG  36  86.749  12.571  -1.590
  291   HH12  ARG  36          HH22      ARG  36  86.928  13.544  -0.168
  292   HH21  ARG  36          HH11      ARG  36  87.210  16.523  -1.920
  293   HH22  ARG  36          HH12      ARG  36  87.189  15.782  -0.355
  294    H    GLN  37           HN       GLN  37  86.944   8.547  -5.030
  295    HA   GLN  37           HA       GLN  37  87.634   7.281  -7.557
  296    HB2  GLN  37           HB2      GLN  37  89.445   5.860  -6.161
  297    HB3  GLN  37           HB1      GLN  37  89.887   7.308  -7.065
  298    HG2  GLN  37           HG2      GLN  37  89.957   8.647  -5.137
  299    HG3  GLN  37           HG1      GLN  37  88.961   7.526  -4.208
  300   HE21  GLN  37          HE21      GLN  37  92.108   7.410  -5.995
  301   HE22  GLN  37          HE22      GLN  37  92.912   6.511  -4.801
  302    H1U  RCY  38           H1U      RCY  38  86.472  -0.687  -0.367
  303    H1S  RCY  38           H1S      RCY  38  84.853   2.373  -3.396
  304    HB1  RCY  38           HB1      RCY  38  84.277   5.221  -4.981
  305    HB2  RCY  38           HB2      RCY  38  84.550   6.353  -3.656
  306    HA   RCY  38           HA       RCY  38  86.447   4.808  -2.912
  307    HN1  RCY  38           HN1      RCY  38  87.486   6.600  -4.037
  308    H    LYS  39           HN       LYS  39  88.258   3.956  -4.955
  309    HA   LYS  39           HA       LYS  39  87.347   2.135  -6.847
  310    HB2  LYS  39           HB2      LYS  39  89.797   2.788  -5.957
  311    HB3  LYS  39           HB1      LYS  39  89.629   1.239  -5.134
  312    HG2  LYS  39           HG2      LYS  39  90.528   0.553  -7.168
  313    HG3  LYS  39           HG1      LYS  39  88.802   0.416  -7.506
  314    HD2  LYS  39           HD2      LYS  39  88.963   2.862  -8.323
  315    HD3  LYS  39           HD1      LYS  39  90.707   2.599  -8.348
  316    HE2  LYS  39           HE2      LYS  39  90.193   0.489  -9.733
  317    HE3  LYS  39           HE1      LYS  39  88.580   1.170  -9.946
  318    HZ1  LYS  39           HZ1      LYS  39  91.062   1.940 -11.157
  319    HZ2  LYS  39           HZ2      LYS  39  90.232   3.257 -10.476
  320    HZ3  LYS  39           HZ3      LYS  39  89.472   2.280 -11.639
  321    H    SER  40           HN       SER  40  88.434   1.019  -3.619
  322    HA   SER  40           HA       SER  40  86.014  -0.399  -3.026
  323    HG   SER  40           HG       SER  40  88.478  -2.073  -5.463
  324    HB2  SER  40           HB2      SER  40  87.059  -2.730  -3.337
  325    HB3  SER  40           HB1      SER  40  86.503  -1.908  -4.792
  326    H    LYS  41           HN       LYS  41  89.568  -0.514  -2.692
  327    HA   LYS  41           HA       LYS  41  89.820  -1.791  -0.243
  328    HB2  LYS  41           HB2      LYS  41  91.727  -0.034   0.151
  329    HB3  LYS  41           HB1      LYS  41  91.852  -1.151  -1.208
  330    HG2  LYS  41           HG2      LYS  41  91.219   0.490  -2.775
  331    HG3  LYS  41           HG1      LYS  41  90.514   1.530  -1.538
  332    HD2  LYS  41           HD2      LYS  41  92.683   2.422  -2.313
  333    HD3  LYS  41           HD1      LYS  41  92.757   1.962  -0.612
  334    HE2  LYS  41           HE2      LYS  41  94.724   1.195  -2.040
  335    HE3  LYS  41           HE1      LYS  41  93.915  -0.072  -1.117
  336    HZ1  LYS  41           HZ1      LYS  41  94.381  -0.150  -3.771
  337    HZ2  LYS  41           HZ2      LYS  41  92.772   0.395  -3.718
  338    HZ3  LYS  41           HZ3      LYS  41  93.201  -1.067  -2.967
  339    HA   PRO  42           HA       PRO  42  87.388   1.041   2.288
  340    HB2  PRO  42           HB2      PRO  42  87.457  -0.382   4.602
  341    HB3  PRO  42           HB1      PRO  42  86.453  -0.865   3.221
  342    HG2  PRO  42           HG2      PRO  42  89.080  -1.942   4.107
  343    HG3  PRO  42           HG1      PRO  42  87.669  -2.794   3.459
  344    HD2  PRO  42           HD2      PRO  42  89.910  -2.157   1.965
  345    HD3  PRO  42           HD1      PRO  42  88.297  -2.432   1.272
  346    HA   PRO  43           HA       PRO  43  90.421   3.419   4.472
  347    HB2  PRO  43           HB2      PRO  43  88.934   4.473   6.529
  348    HB3  PRO  43           HB1      PRO  43  88.816   5.030   4.848
  349    HG2  PRO  43           HG2      PRO  43  87.032   3.189   6.355
  350    HG3  PRO  43           HG1      PRO  43  86.622   4.451   5.181
  351    HD2  PRO  43           HD2      PRO  43  86.664   1.791   4.540
  352    HD3  PRO  43           HD1      PRO  43  87.014   3.073   3.360
  353    H    LYS  44           HN       LYS  44  91.949   3.084   6.079
  354    HA   LYS  44           HA       LYS  44  92.086   0.701   7.535
  355    HB2  LYS  44           HB2      LYS  44  93.247   3.315   8.527
  356    HB3  LYS  44           HB1      LYS  44  93.879   1.688   8.782
  357    HG2  LYS  44           HG2      LYS  44  93.733   3.187   6.151
  358    HG3  LYS  44           HG1      LYS  44  95.193   2.743   7.037
  359    HD2  LYS  44           HD2      LYS  44  94.339   0.307   6.816
  360    HD3  LYS  44           HD1      LYS  44  93.270   0.944   5.567
  361    HE2  LYS  44           HE2      LYS  44  95.193   1.815   4.325
  362    HE3  LYS  44           HE1      LYS  44  96.286   1.261   5.593
  363    HZ1  LYS  44           HZ1      LYS  44  94.911  -0.972   5.028
  364    HZ2  LYS  44           HZ2      LYS  44  96.414  -0.572   4.343
  365    HZ3  LYS  44           HZ3      LYS  44  94.977  -0.238   3.500
  366    H    LYS  45           HN       LYS  45  90.853   3.860   8.662
  367    HA   LYS  45           HA       LYS  45  90.147   2.855  11.285
  368    HB2  LYS  45           HB2      LYS  45  89.673   5.362   9.731
  369    HB3  LYS  45           HB1      LYS  45  88.576   5.028  11.069
  370    HG2  LYS  45           HG2      LYS  45  91.547   4.775  11.466
  371    HG3  LYS  45           HG1      LYS  45  90.779   6.361  11.543
  372    HD2  LYS  45           HD2      LYS  45  89.479   4.162  13.075
  373    HD3  LYS  45           HD1      LYS  45  91.008   4.778  13.704
  374    HE2  LYS  45           HE2      LYS  45  88.833   5.939  14.496
  375    HE3  LYS  45           HE1      LYS  45  90.160   6.967  13.957
  376    HZ1  LYS  45           HZ1      LYS  45  87.753   6.176  12.416
  377    HZ2  LYS  45           HZ2      LYS  45  89.099   6.945  11.720
  378    HZ3  LYS  45           HZ3      LYS  45  88.191   7.737  12.918
  379    H    GLY  46           HN       GLY  46  87.634   3.287  11.888
  380    HA2  GLY  46           HA2      GLY  46  85.427   2.975  10.400
  381    HA3  GLY  46           HA1      GLY  46  86.146   1.378  10.186
  382    H    VAL  47           HN       VAL  47  87.231   2.074  13.113
  383    HA   VAL  47           HA       VAL  47  85.012   0.644  14.437
  384    HB   VAL  47           HB       VAL  47  87.234  -0.196  14.888
  385   HG11  VAL  47          HG11      VAL  47  87.841   2.677  15.635
  386   HG12  VAL  47          HG12      VAL  47  88.571   1.734  14.336
  387   HG13  VAL  47          HG13      VAL  47  88.909   1.327  16.018
  388   HG21  VAL  47          HG21      VAL  47  87.218  -0.157  17.276
  389   HG22  VAL  47          HG22      VAL  47  85.534   0.046  16.794
  390   HG23  VAL  47          HG23      VAL  47  86.476   1.443  17.316
  391    H    GLN  48           HN       GLN  48  86.473   3.825  14.327
  392    HA   GLN  48           HA       GLN  48  84.286   4.825  16.067
  393    HB2  GLN  48           HB2      GLN  48  87.224   4.986  16.652
  394    HB3  GLN  48           HB1      GLN  48  86.210   6.363  17.083
  395    HG2  GLN  48           HG2      GLN  48  85.566   3.515  17.889
  396    HG3  GLN  48           HG1      GLN  48  86.475   4.628  18.913
  397   HE21  GLN  48          HE21      GLN  48  83.612   3.435  19.120
  398   HE22  GLN  48          HE22      GLN  48  82.636   4.795  19.402
  399    H    GLY  49           HN       GLY  49  83.326   6.367  14.854
  400    HA2  GLY  49           HA2      GLY  49  84.820   8.598  13.779
  401    HA3  GLY  49           HA1      GLY  49  84.289   7.511  12.494
  402    H1U  RCY  50           H1U      RCY  50  81.936   7.515   6.847
  403    H1S  RCY  50           H1S      RCY  50  80.779  10.332   9.794
  404    HB1  RCY  50           HB1      RCY  50  78.703   8.352  12.546
  405    HB2  RCY  50           HB2      RCY  50  80.213   7.727  11.884
  406    HA   RCY  50           HA       RCY  50  80.319   9.196  14.491
  407    HN1  RCY  50           HN1      RCY  50  81.864   6.774  14.128
  408    H    GLY  51           HN       GLY  51  77.921   8.542  14.763
  409    HA2  GLY  51           HA2      GLY  51  76.934   5.970  15.053
  410    HA3  GLY  51           HA1      GLY  51  77.825   6.252  16.549
  411    H    ASP  52           HN       ASP  52  76.968   9.257  15.864
  412    HA   ASP  52           HA       ASP  52  74.124   9.283  16.370
  413    HB2  ASP  52           HB2      ASP  52  74.866   8.499  18.586
  414    HB3  ASP  52           HB1      ASP  52  75.952   9.882  18.716
  415    H    ASP  53           HN       ASP  53  73.864  10.985  14.969
  416    HA   ASP  53           HA       ASP  53  74.570  13.641  15.828
  417    HB2  ASP  53           HB2      ASP  53  76.035  14.126  13.781
  418    HB3  ASP  53           HB1      ASP  53  76.791  13.191  15.073
  419    H    ILE  54           HN       ILE  54  74.140  15.210  13.823
  420    HA   ILE  54           HA       ILE  54  71.786  14.092  12.351
  421    HB   ILE  54           HB       ILE  54  71.423  15.908  14.163
  422   HG12  ILE  54          HG12      ILE  54  69.709  15.293  12.520
  423   HG13  ILE  54          HG11      ILE  54  69.722  17.043  12.736
  424   HG21  ILE  54          HG21      ILE  54  73.442  17.210  13.055
  425   HG22  ILE  54          HG22      ILE  54  72.074  18.097  13.729
  426   HG23  ILE  54          HG23      ILE  54  72.181  17.829  11.989
  427   HD11  ILE  54          HD11      ILE  54  70.768  15.424  10.423
  428   HD12  ILE  54          HD12      ILE  54  71.391  17.044  10.736
  429   HD13  ILE  54          HD13      ILE  54  69.676  16.808  10.398
  430    HA   PRO  55           HA       PRO  55  74.704  15.347   9.076
  431    HB2  PRO  55           HB2      PRO  55  74.311  13.244   7.433
  432    HB3  PRO  55           HB1      PRO  55  75.306  13.107   8.896
  433    HG2  PRO  55           HG2      PRO  55  72.538  12.164   8.405
  434    HG3  PRO  55           HG1      PRO  55  73.823  11.443   9.387
  435    HD2  PRO  55           HD2      PRO  55  71.678  12.989  10.362
  436    HD3  PRO  55           HD1      PRO  55  73.153  12.569  11.260
  437    H    GLY  56           HN       GLY  56  71.320  14.447   8.883
  438    HA2  GLY  56           HA2      GLY  56  70.646  16.635   7.179
  439    HA3  GLY  56           HA1      GLY  56  70.762  15.171   6.201
  440    H    MET  57           HN       MET  57  69.029  16.707   8.854
  441    HA   MET  57           HA       MET  57  67.235  14.546   9.426
  442    HB2  MET  57           HB2      MET  57  65.755  16.377  10.349
  443    HB3  MET  57           HB1      MET  57  67.398  16.377  10.988
  444    HG2  MET  57           HG2      MET  57  68.048  18.205   9.602
  445    HG3  MET  57           HG1      MET  57  66.604  18.053   8.601
  446    HE1  MET  57           HE1      MET  57  66.901  19.505  12.925
  447    HE2  MET  57           HE2      MET  57  68.035  18.520  12.005
  448    HE3  MET  57           HE3      MET  57  66.562  17.793  12.642
  449    H    GLU  58           HN       GLU  58  67.228  14.263   6.804
  450    HA   GLU  58           HA       GLU  58  64.492  15.015   6.021
  451    HB2  GLU  58           HB2      GLU  58  66.926  15.873   4.427
  452    HB3  GLU  58           HB1      GLU  58  65.273  15.917   3.814
  453    HG2  GLU  58           HG2      GLU  58  64.701  17.344   5.857
  454    HG3  GLU  58           HG1      GLU  58  66.439  17.494   6.117
  455    H    GLY  59           HN       GLY  59  64.791  12.542   6.484
  456    HA2  GLY  59           HA2      GLY  59  64.218  10.648   4.984
  457    HA3  GLY  59           HA1      GLY  59  65.480  11.218   3.891
  458    H1U  RCY  60           H1U      RCY  60  70.960   8.598   0.629
  459    H1S  RCY  60           H1S      RCY  60  71.263  11.212   3.768
  460    HB1  RCY  60           HB1      RCY  60  68.788   8.941   5.543
  461    HB2  RCY  60           HB2      RCY  60  69.954   9.151   6.849
  462    HA   RCY  60           HA       RCY  60  67.563   9.107   7.630
  463    HN1  RCY  60           HN1      RCY  60  66.928  11.771   6.681
  464    H    GLY  61           HN       GLY  61  67.415   9.902   9.719
  465    HA2  GLY  61           HA2      GLY  61  69.676  11.493  10.682
  466    HA3  GLY  61           HA1      GLY  61  68.118  12.309  10.820
  467    H    THR  62           HN       THR  62  66.501  10.065  11.406
  468    HA   THR  62           HA       THR  62  67.583   9.231  14.076
  469    HB   THR  62           HB       THR  62  65.794  10.502  14.771
  470    HG1  THR  62           HG1      THR  62  64.949   8.694  15.491
  471   HG21  THR  62          HG21      THR  62  65.249  11.408  12.594
  472   HG22  THR  62          HG22      THR  62  63.754  10.851  13.344
  473   HG23  THR  62          HG23      THR  62  64.527   9.880  12.091
  474    H    ASP  63           HN       ASP  63  65.152   8.300  11.611
  475    HA   ASP  63           HA       ASP  63  65.110   5.537  12.460
  476    HB2  ASP  63           HB2      ASP  63  64.335   6.515   9.709
  477    HB3  ASP  63           HB1      ASP  63  63.662   5.163  10.620
  478    H    ILE  64           HN       ILE  64  67.738   5.946  12.320
  479    HA   ILE  64           HA       ILE  64  68.634   4.053  10.354
  480    HB   ILE  64           HB       ILE  64  68.671   5.621   8.640
  481   HG12  ILE  64          HG12      ILE  64  70.966   6.608   8.480
  482   HG13  ILE  64          HG11      ILE  64  71.239   6.164  10.165
  483   HG21  ILE  64          HG21      ILE  64  69.332   8.078   9.192
  484   HG22  ILE  64          HG22      ILE  64  69.024   7.620  10.867
  485   HG23  ILE  64          HG23      ILE  64  67.731   7.515   9.673
  486   HD11  ILE  64          HD11      ILE  64  72.130   4.304   9.107
  487   HD12  ILE  64          HD12      ILE  64  71.000   4.403   7.756
  488   HD13  ILE  64          HD13      ILE  64  70.460   3.775   9.313
  489    H    THR  65           HN       THR  65  68.992   5.977  13.083
  490    HA   THR  65           HA       THR  65  71.619   6.327  13.711
  491    HB   THR  65           HB       THR  65  71.074   5.438  16.033
  492    HG1  THR  65           HG1      THR  65  68.658   4.866  14.671
  493   HG21  THR  65          HG21      THR  65  70.663   7.765  15.504
  494   HG22  THR  65          HG22      THR  65  69.282   7.156  16.416
  495   HG23  THR  65          HG23      THR  65  69.166   7.353  14.667
  496    H    VAL  66           HN       VAL  66  70.002   3.190  13.435
  497    HA   VAL  66           HA       VAL  66  72.643   1.906  13.087
  498    HB   VAL  66           HB       VAL  66  70.636   0.820  15.081
  499   HG11  VAL  66          HG11      VAL  66  72.576  -0.598  15.732
  500   HG12  VAL  66          HG12      VAL  66  73.515   0.124  14.425
  501   HG13  VAL  66          HG13      VAL  66  72.096  -0.857  14.054
  502   HG21  VAL  66          HG21      VAL  66  72.361   1.544  16.784
  503   HG22  VAL  66          HG22      VAL  66  71.504   2.876  16.010
  504   HG23  VAL  66          HG23      VAL  66  73.144   2.470  15.504
  505    H    ILE  67           HN       ILE  67  69.116   1.709  13.006
  506    HA   ILE  67           HA       ILE  67  69.368  -0.193  10.718
  507    HB   ILE  67           HB       ILE  67  67.461  -0.449  13.063
  508   HG12  ILE  67          HG12      ILE  67  69.517  -2.393  11.973
  509   HG13  ILE  67          HG11      ILE  67  69.825  -1.306  13.328
  510   HG21  ILE  67          HG21      ILE  67  67.592  -1.891  10.403
  511   HG22  ILE  67          HG22      ILE  67  66.233  -0.982  11.064
  512   HG23  ILE  67          HG23      ILE  67  66.709  -2.514  11.797
  513   HD11  ILE  67          HD11      ILE  67  69.093  -3.610  14.027
  514   HD12  ILE  67          HD12      ILE  67  67.542  -3.297  13.248
  515   HD13  ILE  67          HD13      ILE  67  68.049  -2.320  14.625
  516    H1U  RCY  68           H1U      RCY  68  71.060   5.376   2.084
  517    H1S  RCY  68           H1S      RCY  68  69.238   3.752   6.117
  518    HB1  RCY  68           HB1      RCY  68  68.637   3.139   8.061
  519    HB2  RCY  68           HB2      RCY  68  67.183   4.100   7.811
  520    HA   RCY  68           HA       RCY  68  66.323   2.845   9.510
  521    HN1  RCY  68           HN1      RCY  68  68.573   0.957   9.032
  522    HA   PRO  69           HA       PRO  69  63.251   0.259   7.702
  523    HB2  PRO  69           HB2      PRO  69  62.160   2.027   5.789
  524    HB3  PRO  69           HB1      PRO  69  61.647   1.873   7.478
  525    HG2  PRO  69           HG2      PRO  69  63.418   3.880   6.221
  526    HG3  PRO  69           HG1      PRO  69  62.303   4.046   7.587
  527    HD2  PRO  69           HD2      PRO  69  64.995   3.918   7.935
  528    HD3  PRO  69           HD1      PRO  69  63.858   3.248   9.128
  529    H    TRP  70           HN       TRP  70  64.772   2.291   5.173
  530    HA   TRP  70           HA       TRP  70  64.639   0.094   3.237
  531    HD1  TRP  70           HD1      TRP  70  62.636   1.782   3.397
  532    HE1  TRP  70           HE1      TRP  70  61.451   4.034   3.802
  533    HE3  TRP  70           HE3      TRP  70  66.499   4.990   2.468
  534    HZ2  TRP  70           HZ2      TRP  70  62.062   6.833   3.741
  535    HZ3  TRP  70           HZ3      TRP  70  66.172   7.437   2.648
  536    HH2  TRP  70           HH2      TRP  70  63.963   8.363   3.282
  537    HB2  TRP  70           HB2      TRP  70  66.367   2.478   2.732
  538    HB3  TRP  70           HB1      TRP  70  65.236   1.662   1.654
  539    H    GLU  71           HN       GLU  71  66.008  -0.817   5.433
  540    HA   GLU  71           HA       GLU  71  68.688  -1.296   4.290
  541    HB2  GLU  71           HB2      GLU  71  69.262   0.566   5.663
  542    HB3  GLU  71           HB1      GLU  71  68.219   0.024   6.971
  543    HG2  GLU  71           HG2      GLU  71  70.707  -0.399   7.316
  544    HG3  GLU  71           HG1      GLU  71  69.667  -1.814   7.489
  545    H    ALA  72           HN       ALA  72  65.968  -2.200   6.128
  546    HA   ALA  72           HA       ALA  72  67.176  -4.451   7.524
  547    HB1  ALA  72           HB1      ALA  72  65.150  -3.571   8.455
  548    HB2  ALA  72           HB2      ALA  72  64.734  -5.149   7.787
  549    HB3  ALA  72           HB3      ALA  72  64.313  -3.680   6.907
  550    H1U  RCY  73           H1U      RCY  73  69.754  -1.393  -1.716
  551    H1S  RCY  73           H1S      RCY  73  68.248  -2.021   2.333
  552    HB1  RCY  73           HB1      RCY  73  65.258  -5.205   1.480
  553    HB2  RCY  73           HB2      RCY  73  67.013  -5.355   1.415
  554    HA   RCY  73           HA       RCY  73  65.255  -6.356   3.421
  555    HN1  RCY  73           HN1      RCY  73  66.162  -3.845   4.309
  556    H    ASN  74           HN       ASN  74  68.636  -5.186   3.568
  557    HA   ASN  74           HA       ASN  74  69.573  -7.880   4.225
  558    HB2  ASN  74           HB2      ASN  74  69.276  -7.821   1.681
  559    HB3  ASN  74           HB1      ASN  74  70.587  -6.642   1.658
  560   HD21  ASN  74          HD21      ASN  74  69.843  -9.962   2.845
  561   HD22  ASN  74          HD22      ASN  74  71.435 -10.530   2.700
  562    H    HIS  75           HN       HIS  75  72.202  -6.837   2.832
  563    HA   HIS  75           HA       HIS  75  72.910  -4.537   4.503
  564    HD1  HIS  75           HD1      HIS  75  72.545  -4.300   6.862
  565    HD2  HIS  75           HD2      HIS  75  72.472  -8.471   6.856
  566    HE1  HIS  75           HE1      HIS  75  70.911  -4.989   8.670
  567    HE2  HIS  75           HE2      HIS  75  70.858  -7.526   8.677
  568    HB2  HIS  75           HB2      HIS  75  74.144  -7.259   5.033
  569    HB3  HIS  75           HB1      HIS  75  74.741  -5.738   5.696
  570    H1U  RCY  76           H1U      RCY  76  68.996  -3.137   0.576
  571    H1S  RCY  76           H1S      RCY  76  72.895  -4.434  -1.534
  572    HB1  RCY  76           HB1      RCY  76  74.441  -6.928   0.100
  573    HB2  RCY  76           HB2      RCY  76  75.954  -6.357  -0.599
  574    HA   RCY  76           HA       RCY  76  76.501  -7.243   1.557
  575    HN1  RCY  76           HN1      RCY  76  74.620  -7.289   2.985
  576    H    GLU  77           HN       GLU  77  78.018  -6.178   3.007
  577    HA   GLU  77           HA       GLU  77  78.210  -3.309   3.184
  578    HB2  GLU  77           HB2      GLU  77  79.279  -4.664   4.878
  579    HB3  GLU  77           HB1      GLU  77  80.252  -5.499   3.669
  580    HG2  GLU  77           HG2      GLU  77  80.422  -2.508   3.875
  581    HG3  GLU  77           HG1      GLU  77  81.301  -3.505   5.035
  582    H    LEU  78           HN       LEU  78  79.445  -5.710   0.955
  583    HA   LEU  78           HA       LEU  78  79.894  -3.799  -1.124
  584    HG   LEU  78           HG       LEU  78  82.227  -4.106  -2.441
  585    HB2  LEU  78           HB2      LEU  78  81.884  -3.379   0.478
  586    HB3  LEU  78           HB1      LEU  78  82.473  -4.953  -0.053
  587   HD11  LEU  78          HD11      LEU  78  82.438  -1.466  -2.384
  588   HD12  LEU  78          HD12      LEU  78  81.553  -1.645  -0.869
  589   HD13  LEU  78          HD13      LEU  78  80.851  -2.235  -2.375
  590   HD21  LEU  78          HD21      LEU  78  84.385  -3.131  -2.421
  591   HD22  LEU  78          HD22      LEU  78  84.369  -4.154  -0.985
  592   HD23  LEU  78          HD23      LEU  78  84.138  -2.413  -0.830
  593    H    HIS  79           HN       HIS  79  81.780  -6.683  -0.174
  594    HA   HIS  79           HA       HIS  79  80.295  -8.583  -1.665
  595    HD1  HIS  79           HD1      HIS  79  84.034  -7.779  -1.631
  596    HD2  HIS  79           HD2      HIS  79  82.547  -5.531  -4.815
  597    HE1  HIS  79           HE1      HIS  79  85.772  -6.005  -2.127
  598    HE2  HIS  79           HE2      HIS  79  84.879  -4.629  -4.063
  599    HB2  HIS  79           HB2      HIS  79  81.931  -8.838  -3.610
  600    HB3  HIS  79           HB1      HIS  79  80.857  -7.444  -3.696
  601    H    GLU  80           HN       GLU  80  81.785  -8.431   0.799
  602    HA   GLU  80           HA       GLU  80  83.236 -10.916   0.607
  603    HB2  GLU  80           HB2      GLU  80  84.836  -9.113  -0.361
  604    HB3  GLU  80           HB1      GLU  80  85.007  -8.580   1.312
  605    HG2  GLU  80           HG2      GLU  80  86.770 -10.153   0.942
  606    HG3  GLU  80           HG1      GLU  80  85.551 -11.004   1.892
  607    H    LEU  81           HN       LEU  81  83.435  -7.928   2.605
  608    HA   LEU  81           HA       LEU  81  83.291  -9.609   5.034
  609    HG   LEU  81           HG       LEU  81  82.600  -6.301   3.963
  610    HB2  LEU  81           HB2      LEU  81  83.633  -7.446   6.233
  611    HB3  LEU  81           HB1      LEU  81  84.903  -7.789   5.062
  612   HD11  LEU  81          HD11      LEU  81  82.585  -5.133   6.032
  613   HD12  LEU  81          HD12      LEU  81  83.577  -4.140   4.964
  614   HD13  LEU  81          HD13      LEU  81  84.343  -5.182   6.163
  615   HD21  LEU  81          HD21      LEU  81  84.674  -6.744   2.703
  616   HD22  LEU  81          HD22      LEU  81  85.608  -5.887   3.929
  617   HD23  LEU  81          HD23      LEU  81  84.446  -5.010   2.933
  618    H    ALA  82           HN       ALA  82  80.948  -9.062   3.116
  619    HA   ALA  82           HA       ALA  82  79.056  -7.403   4.479
  620    HB1  ALA  82           HB1      ALA  82  77.355  -8.801   3.190
  621    HB2  ALA  82           HB2      ALA  82  78.722  -9.731   2.574
  622    HB3  ALA  82           HB3      ALA  82  78.590  -8.011   2.210
  623    H    GLN  83           HN       GLN  83  77.638 -10.454   4.153
  624    HA   GLN  83           HA       GLN  83  76.841 -12.018   5.707
  625    HB2  GLN  83           HB2      GLN  83  78.891 -11.038   7.694
  626    HB3  GLN  83           HB1      GLN  83  78.227 -12.659   7.498
  627    HG2  GLN  83           HG2      GLN  83  79.316 -12.436   5.080
  628    HG3  GLN  83           HG1      GLN  83  80.357 -11.280   5.913
  629   HE21  GLN  83          HE21      GLN  83  79.117 -14.649   6.265
  630   HE22  GLN  83          HE22      GLN  83  80.513 -15.238   7.030
  631    H    TYR  84           HN       TYR  84  77.662  -8.836   7.072
  632    HA   TYR  84           HA       TYR  84  74.914  -8.628   8.132
  633    HD1  TYR  84           HD2      TYR  84  73.787  -9.564   9.956
  634    HD2  TYR  84           HD1      TYR  84  77.894 -10.721  10.451
  635    HE1  TYR  84           HE2      TYR  84  73.065 -11.840  10.625
  636    HE2  TYR  84           HE1      TYR  84  77.172 -12.998  11.120
  637    HH   TYR  84           HH       TYR  84  74.461 -13.814  12.225
  638    HB2  TYR  84           HB2      TYR  84  77.398  -8.523   9.869
  639    HB3  TYR  84           HB1      TYR  84  75.837  -7.879  10.380
  640    H    GLY  85           HN       GLY  85  78.073  -7.200   7.506
  641    HA2  GLY  85           HA2      GLY  85  78.716  -4.966   7.138
  642    HA3  GLY  85           HA1      GLY  85  77.213  -4.899   6.222
  643    H    ILE  86           HN       ILE  86  78.810  -3.915   9.117
  644    HA   ILE  86           HA       ILE  86  76.347  -2.978  10.438
  645    HB   ILE  86           HB       ILE  86  78.213  -1.860  11.940
  646   HG12  ILE  86          HG12      ILE  86  79.806  -4.088  10.657
  647   HG13  ILE  86          HG11      ILE  86  79.949  -2.412  10.127
  648   HG21  ILE  86          HG21      ILE  86  78.575  -4.183  13.006
  649   HG22  ILE  86          HG22      ILE  86  77.559  -4.799  11.703
  650   HG23  ILE  86          HG23      ILE  86  76.911  -3.623  12.846
  651   HD11  ILE  86          HD11      ILE  86  81.612  -3.228  11.928
  652   HD12  ILE  86          HD12      ILE  86  80.239  -3.170  13.034
  653   HD13  ILE  86          HD13      ILE  86  80.783  -1.700  12.226
  654    H1U  RCY  87           H1U      RCY  87  78.524  -0.638   1.597
  655    H1S  RCY  87           H1S      RCY  87  75.416   0.776   4.308
  656    HB1  RCY  87           HB1      RCY  87  75.053   1.694   7.170
  657    HB2  RCY  87           HB2      RCY  87  74.161   0.464   8.063
  658    HA   RCY  87           HA       RCY  87  77.180   0.765   8.029
  659    HN1  RCY  87           HN1      RCY  87  75.478  -1.381   9.073
  Start of MODEL   53
    1    HA   MET   1           HA       MET   1  60.518 -15.154   4.551
    2    HB2  MET   1           HB2      MET   1  62.607 -13.928   5.099
    3    HB3  MET   1           HB1      MET   1  63.547 -15.245   4.395
    4    HG2  MET   1           HG2      MET   1  62.697 -14.825   2.212
    5    HG3  MET   1           HG1      MET   1  61.408 -13.792   2.830
    6    HE1  MET   1           HE1      MET   1  62.038 -11.741   4.457
    7    HE2  MET   1           HE2      MET   1  61.503 -11.350   2.825
    8    HE3  MET   1           HE3      MET   1  62.852 -10.469   3.538
    9    H    ASN   2           HN       ASN   2  62.257 -18.081   4.938
   10    HA   ASN   2           HA       ASN   2  61.636 -18.842   2.104
   11    HB2  ASN   2           HB2      ASN   2  63.529 -20.380   2.195
   12    HB3  ASN   2           HB1      ASN   2  64.081 -18.758   2.615
   13   HD21  ASN   2          HD21      ASN   2  62.461 -19.341   5.304
   14   HD22  ASN   2          HD22      ASN   2  63.608 -20.185   6.228
   15    H    LEU   3           HN       LEU   3  62.252 -21.637   2.652
   16    HA   LEU   3           HA       LEU   3  61.251 -23.573   3.531
   17    HG   LEU   3           HG       LEU   3  61.396 -24.477   5.679
   18    HB2  LEU   3           HB2      LEU   3  61.390 -22.005   5.699
   19    HB3  LEU   3           HB1      LEU   3  59.637 -22.010   5.510
   20   HD11  LEU   3          HD11      LEU   3  59.414 -23.284   7.644
   21   HD12  LEU   3          HD12      LEU   3  61.168 -23.293   7.832
   22   HD13  LEU   3          HD13      LEU   3  60.271 -24.812   7.854
   23   HD21  LEU   3          HD21      LEU   3  59.520 -25.020   4.317
   24   HD22  LEU   3          HD22      LEU   3  58.426 -24.051   5.303
   25   HD23  LEU   3          HD23      LEU   3  59.077 -25.563   5.935
   26    H    GLU   4           HN       GLU   4  58.917 -20.849   3.696
   27    HA   GLU   4           HA       GLU   4  56.809 -22.587   2.609
   28    HB2  GLU   4           HB2      GLU   4  55.371 -20.594   2.869
   29    HB3  GLU   4           HB1      GLU   4  56.262 -20.929   4.353
   30    HG2  GLU   4           HG2      GLU   4  57.999 -19.269   3.597
   31    HG3  GLU   4           HG1      GLU   4  56.931 -18.845   2.258
   32    HA   PRO   5           HA       PRO   5  57.244 -21.890  -1.733
   33    HB2  PRO   5           HB2      PRO   5  54.474 -20.750  -1.546
   34    HB3  PRO   5           HB1      PRO   5  55.129 -21.929  -2.700
   35    HG2  PRO   5           HG2      PRO   5  53.611 -22.658  -0.612
   36    HG3  PRO   5           HG1      PRO   5  54.913 -23.677  -1.243
   37    HD2  PRO   5           HD2      PRO   5  54.786 -22.202   1.308
   38    HD3  PRO   5           HD1      PRO   5  55.850 -23.545   0.838
   39    HA   PRO   6           HA       PRO   6  58.173 -17.445  -1.474
   40    HB2  PRO   6           HB2      PRO   6  60.008 -17.352  -3.469
   41    HB3  PRO   6           HB1      PRO   6  60.379 -18.039  -1.875
   42    HG2  PRO   6           HG2      PRO   6  59.746 -19.429  -4.426
   43    HG3  PRO   6           HG1      PRO   6  60.905 -19.862  -3.160
   44    HD2  PRO   6           HD2      PRO   6  58.392 -21.013  -3.445
   45    HD3  PRO   6           HD1      PRO   6  59.326 -20.996  -1.933
   46    H    LYS   7           HN       LYS   7  57.473 -15.628  -2.662
   47    HA   LYS   7           HA       LYS   7  56.379 -16.108  -5.398
   48    HB2  LYS   7           HB2      LYS   7  54.909 -14.565  -3.243
   49    HB3  LYS   7           HB1      LYS   7  54.329 -14.937  -4.864
   50    HG2  LYS   7           HG2      LYS   7  53.317 -16.692  -3.794
   51    HG3  LYS   7           HG1      LYS   7  54.902 -17.440  -3.993
   52    HD2  LYS   7           HD2      LYS   7  54.279 -17.700  -1.680
   53    HD3  LYS   7           HD1      LYS   7  55.539 -16.468  -1.745
   54    HE2  LYS   7           HE2      LYS   7  54.117 -14.791  -1.124
   55    HE3  LYS   7           HE1      LYS   7  52.761 -15.471  -2.024
   56    HZ1  LYS   7           HZ1      LYS   7  53.008 -17.318  -0.174
   57    HZ2  LYS   7           HZ2      LYS   7  52.070 -15.923   0.068
   58    HZ3  LYS   7           HZ3      LYS   7  53.643 -16.013   0.705
   59    H    ALA   8           HN       ALA   8  55.198 -13.291  -5.047
   60    HA   ALA   8           HA       ALA   8  57.446 -11.873  -6.180
   61    HB1  ALA   8           HB1      ALA   8  55.902  -9.873  -5.957
   62    HB2  ALA   8           HB2      ALA   8  54.733 -10.952  -5.196
   63    HB3  ALA   8           HB3      ALA   8  55.231 -11.228  -6.866
   64    H    GLU   9           HN       GLU   9  56.847 -12.746  -3.050
   65    HA   GLU   9           HA       GLU   9  57.329 -11.753  -0.939
   66    HB2  GLU   9           HB2      GLU   9  59.804 -11.261  -0.841
   67    HB3  GLU   9           HB1      GLU   9  59.397 -12.833  -1.526
   68    HG2  GLU   9           HG2      GLU   9  59.708 -12.011  -3.778
   69    HG3  GLU   9           HG1      GLU   9  59.894 -10.355  -3.199
   70    H1U  RCY  10           H1U      RCY  10  59.729  -8.957   2.067
   71    H1S  RCY  10           H1S      RCY  10  58.279  -8.808  -2.127
   72    HB1  RCY  10           HB1      RCY  10  56.145  -6.256  -3.285
   73    HB2  RCY  10           HB2      RCY  10  56.125  -7.892  -3.942
   74    HA   RCY  10           HA       RCY  10  57.165  -7.371  -1.162
   75    HN1  RCY  10           HN1      RCY  10  55.801  -9.858  -1.966
   76    H    ARG  11           HN       ARG  11  54.331  -9.263  -1.743
   77    HA   ARG  11           HA       ARG  11  52.318  -7.269  -1.425
   78    HE   ARG  11           HE       ARG  11  49.238  -9.958  -1.379
   79    HB2  ARG  11           HB2      ARG  11  52.410 -10.231  -0.850
   80    HB3  ARG  11           HB1      ARG  11  50.970  -9.280  -0.490
   81    HG2  ARG  11           HG2      ARG  11  52.221  -9.005  -3.198
   82    HG3  ARG  11           HG1      ARG  11  51.258 -10.443  -2.857
   83    HD2  ARG  11           HD2      ARG  11  50.310  -7.589  -2.467
   84    HD3  ARG  11           HD1      ARG  11  49.883  -8.618  -3.834
   85   HH11  ARG  11          HH21      ARG  11  48.321  -7.354  -3.442
   86   HH12  ARG  11          HH22      ARG  11  46.650  -7.407  -2.988
   87   HH21  ARG  11          HH11      ARG  11  47.062 -10.043  -0.774
   88   HH22  ARG  11          HH12      ARG  11  45.937  -8.929  -1.478
   89    H    SER  12           HN       SER  12  51.339  -6.414   0.424
   90    HA   SER  12           HA       SER  12  52.850  -5.953   2.727
   91    HG   SER  12           HG       SER  12  51.011  -3.689   2.934
   92    HB2  SER  12           HB2      SER  12  49.849  -6.049   2.356
   93    HB3  SER  12           HB1      SER  12  50.605  -5.523   3.858
   94    H    ALA  13           HN       ALA  13  53.819  -7.707   3.715
   95    HA   ALA  13           HA       ALA  13  51.976  -9.706   4.965
   96    HB1  ALA  13           HB1      ALA  13  53.267 -10.616   2.955
   97    HB2  ALA  13           HB2      ALA  13  53.482 -11.498   4.466
   98    HB3  ALA  13           HB3      ALA  13  54.731 -10.385   3.910
   99    H    THR  14           HN       THR  14  54.095  -7.259   5.468
  100    HA   THR  14           HA       THR  14  54.498  -7.985   8.257
  101    HB   THR  14           HB       THR  14  57.151  -7.391   7.433
  102    HG1  THR  14           HG1      THR  14  57.396  -8.407   5.631
  103   HG21  THR  14          HG21      THR  14  57.575  -9.700   8.275
  104   HG22  THR  14          HG22      THR  14  55.833  -9.979   8.304
  105   HG23  THR  14          HG23      THR  14  56.550  -8.761   9.359
  106    H    ARG  15           HN       ARG  15  56.500  -6.154   8.898
  107    HA   ARG  15           HA       ARG  15  55.793  -3.597   7.585
  108    HE   ARG  15           HE       ARG  15  52.364  -3.986  11.102
  109    HB2  ARG  15           HB2      ARG  15  55.196  -2.533   9.733
  110    HB3  ARG  15           HB1      ARG  15  54.090  -3.853   9.351
  111    HG2  ARG  15           HG2      ARG  15  55.602  -5.350  10.763
  112    HG3  ARG  15           HG1      ARG  15  56.383  -3.871  11.323
  113    HD2  ARG  15           HD2      ARG  15  54.579  -4.600  12.865
  114    HD3  ARG  15           HD1      ARG  15  54.237  -3.023  12.154
  115   HH11  ARG  15          HH21      ARG  15  54.670  -6.366  12.054
  116   HH12  ARG  15          HH22      ARG  15  53.671  -7.707  11.604
  117   HH21  ARG  15          HH11      ARG  15  51.046  -5.724  10.508
  118   HH22  ARG  15          HH12      ARG  15  51.619  -7.343  10.729
  119    H    VAL  16           HN       VAL  16  57.438  -2.064   7.792
  120    HA   VAL  16           HA       VAL  16  59.653  -2.582   9.684
  121    HB   VAL  16           HB       VAL  16  60.279  -3.864   7.672
  122   HG11  VAL  16          HG11      VAL  16  58.873  -2.327   6.158
  123   HG12  VAL  16          HG12      VAL  16  60.421  -2.876   5.516
  124   HG13  VAL  16          HG13      VAL  16  60.265  -1.244   6.166
  125   HG21  VAL  16          HG21      VAL  16  62.462  -2.902   7.365
  126   HG22  VAL  16          HG22      VAL  16  61.978  -2.534   9.021
  127   HG23  VAL  16          HG23      VAL  16  61.875  -1.290   7.775
  128    H    MET  17           HN       MET  17  58.409  -0.547   7.032
  129    HA   MET  17           HA       MET  17  59.820   1.796   8.185
  130    HB2  MET  17           HB2      MET  17  58.963   2.970   6.153
  131    HB3  MET  17           HB1      MET  17  59.942   1.557   5.764
  132    HG2  MET  17           HG2      MET  17  58.217   0.679   4.614
  133    HG3  MET  17           HG1      MET  17  57.241   0.683   6.082
  134    HE1  MET  17           HE1      MET  17  57.878   4.253   3.336
  135    HE2  MET  17           HE2      MET  17  57.810   2.675   2.555
  136    HE3  MET  17           HE3      MET  17  59.003   2.977   3.816
  137    H    GLY  18           HN       GLY  18  58.718   3.521   9.129
  138    HA2  GLY  18           HA2      GLY  18  56.074   4.278   8.961
  139    HA3  GLY  18           HA1      GLY  18  56.035   2.953  10.124
  140    H    GLY  19           HN       GLY  19  56.594   3.396  12.221
  141    HA2  GLY  19           HA2      GLY  19  57.285   6.190  12.872
  142    HA3  GLY  19           HA1      GLY  19  56.816   4.945  14.029
  143    HA   PRO  20           HA       PRO  20  60.862   3.644  15.171
  144    HB2  PRO  20           HB2      PRO  20  60.822   1.370  13.219
  145    HB3  PRO  20           HB1      PRO  20  61.217   1.362  14.949
  146    HG2  PRO  20           HG2      PRO  20  58.871   0.479  14.051
  147    HG3  PRO  20           HG1      PRO  20  59.011   1.348  15.588
  148    HD2  PRO  20           HD2      PRO  20  57.870   2.282  13.002
  149    HD3  PRO  20           HD1      PRO  20  57.483   2.796  14.658
  150    H1U  RCY  21           H1U      RCY  21  60.383  -0.498   6.235
  151    H1S  RCY  21           H1S      RCY  21  62.125   3.463   6.958
  152    HB1  RCY  21           HB1      RCY  21  61.350   3.288   9.085
  153    HB2  RCY  21           HB2      RCY  21  62.250   2.072   9.991
  154    HA   RCY  21           HA       RCY  21  63.319   4.046  11.249
  155    HN1  RCY  21           HN1      RCY  21  60.545   3.099  11.639
  156    H    THR  22           HN       THR  22  63.261   6.277  11.632
  157    HA   THR  22           HA       THR  22  61.239   8.085  10.883
  158    HB   THR  22           HB       THR  22  63.168   8.694  12.316
  159    HG1  THR  22           HG1      THR  22  62.925  10.674  11.685
  160   HG21  THR  22          HG21      THR  22  64.809   7.406  10.830
  161   HG22  THR  22          HG22      THR  22  65.366   8.965  11.440
  162   HG23  THR  22          HG23      THR  22  64.800   8.820   9.776
  163    HA   PRO  23           HA       PRO  23  61.390   8.047   6.450
  164    HB2  PRO  23           HB2      PRO  23  60.613  10.653   5.931
  165    HB3  PRO  23           HB1      PRO  23  59.498   9.342   6.358
  166    HG2  PRO  23           HG2      PRO  23  60.617  11.499   8.067
  167    HG3  PRO  23           HG1      PRO  23  58.999  10.778   8.069
  168    HD2  PRO  23           HD2      PRO  23  60.884  10.133   9.930
  169    HD3  PRO  23           HD1      PRO  23  59.654   8.974   9.378
  170    H    ARG  24           HN       ARG  24  62.491   9.127   4.587
  171    HA   ARG  24           HA       ARG  24  65.211   9.538   4.909
  172    HE   ARG  24           HE       ARG  24  64.833   9.056  -0.337
  173    HB2  ARG  24           HB2      ARG  24  63.338  10.796   2.889
  174    HB3  ARG  24           HB1      ARG  24  65.094  10.885   2.769
  175    HG2  ARG  24           HG2      ARG  24  64.280   8.157   3.274
  176    HG3  ARG  24           HG1      ARG  24  63.433   8.787   1.861
  177    HD2  ARG  24           HD2      ARG  24  66.402   9.193   2.197
  178    HD3  ARG  24           HD1      ARG  24  65.762   7.709   1.490
  179   HH11  ARG  24          HH21      ARG  24  66.853  10.660   1.950
  180   HH12  ARG  24          HH22      ARG  24  67.191  12.003   0.910
  181   HH21  ARG  24          HH11      ARG  24  65.262  10.801  -1.709
  182   HH22  ARG  24          HH12      ARG  24  66.290  12.083  -1.162
  183    H    LYS  25           HN       LYS  25  63.065  12.316   4.256
  184    HA   LYS  25           HA       LYS  25  64.843  14.315   5.102
  185    HB2  LYS  25           HB2      LYS  25  61.819  14.283   5.368
  186    HB3  LYS  25           HB1      LYS  25  62.830  15.725   5.462
  187    HG2  LYS  25           HG2      LYS  25  63.082  13.933   3.070
  188    HG3  LYS  25           HG1      LYS  25  61.713  15.041   3.167
  189    HD2  LYS  25           HD2      LYS  25  63.044  16.922   3.026
  190    HD3  LYS  25           HD1      LYS  25  64.428  16.128   3.778
  191    HE2  LYS  25           HE2      LYS  25  63.437  15.293   1.053
  192    HE3  LYS  25           HE1      LYS  25  64.575  16.627   1.245
  193    HZ1  LYS  25           HZ1      LYS  25  64.945  13.770   1.815
  194    HZ2  LYS  25           HZ2      LYS  25  65.830  14.910   2.712
  195    HZ3  LYS  25           HZ3      LYS  25  65.982  14.852   1.021
  196    H    GLY  26           HN       GLY  26  65.952  13.676   7.001
  197    HA2  GLY  26           HA2      GLY  26  64.597  14.339   9.492
  198    HA3  GLY  26           HA1      GLY  26  64.983  12.621   9.366
  199    HA   PRO  27           HA       PRO  27  68.680  14.221  11.531
  200    HB2  PRO  27           HB2      PRO  27  69.359  11.335  11.077
  201    HB3  PRO  27           HB1      PRO  27  69.547  12.316  12.543
  202    HG2  PRO  27           HG2      PRO  27  67.562  10.562  12.294
  203    HG3  PRO  27           HG1      PRO  27  67.328  12.111  13.122
  204    HD2  PRO  27           HD2      PRO  27  66.342  11.246  10.446
  205    HD3  PRO  27           HD1      PRO  27  65.646  12.425  11.579
  206    HA   PRO  28           HA       PRO  28  71.614  15.150   8.357
  207    HB2  PRO  28           HB2      PRO  28  73.560  13.494   9.937
  208    HB3  PRO  28           HB1      PRO  28  73.772  15.109   9.232
  209    HG2  PRO  28           HG2      PRO  28  73.275  14.744  11.840
  210    HG3  PRO  28           HG1      PRO  28  72.675  16.150  10.949
  211    HD2  PRO  28           HD2      PRO  28  71.163  13.860  12.038
  212    HD3  PRO  28           HD1      PRO  28  70.576  15.463  11.545
  213    H    LYS  29           HN       LYS  29  72.277  14.184   6.420
  214    HA   LYS  29           HA       LYS  29  72.776  11.293   6.294
  215    HB2  LYS  29           HB2      LYS  29  70.200  11.789   6.170
  216    HB3  LYS  29           HB1      LYS  29  70.565  12.330   4.532
  217    HG2  LYS  29           HG2      LYS  29  71.781  10.094   4.225
  218    HG3  LYS  29           HG1      LYS  29  71.002   9.585   5.723
  219    HD2  LYS  29           HD2      LYS  29  68.802  10.386   4.593
  220    HD3  LYS  29           HD1      LYS  29  69.724  10.306   3.091
  221    HE2  LYS  29           HE2      LYS  29  68.928   8.085   4.945
  222    HE3  LYS  29           HE1      LYS  29  68.844   8.153   3.184
  223    HZ1  LYS  29           HZ1      LYS  29  71.426   8.332   3.433
  224    HZ2  LYS  29           HZ2      LYS  29  70.652   6.820   3.468
  225    HZ3  LYS  29           HZ3      LYS  29  71.133   7.566   4.917
  226    H1U  RCY  30           H1U      RCY  30  71.467  17.926  -2.781
  227    H1S  RCY  30           H1S      RCY  30  71.384  14.597   0.755
  228    HB1  RCY  30           HB1      RCY  30  73.103  13.526   1.835
  229    HB2  RCY  30           HB2      RCY  30  74.031  14.966   1.416
  230    HA   RCY  30           HA       RCY  30  75.122  13.478   3.151
  231    HN1  RCY  30           HN1      RCY  30  73.388  14.376   5.304
  232    H    LYS  31           HN       LYS  31  73.951  16.599   2.556
  233    HA   LYS  31           HA       LYS  31  74.837  18.724   2.981
  234    HB2  LYS  31           HB2      LYS  31  74.299  17.942   5.382
  235    HB3  LYS  31           HB1      LYS  31  76.021  17.593   5.518
  236    HG2  LYS  31           HG2      LYS  31  76.014  19.782   6.267
  237    HG3  LYS  31           HG1      LYS  31  76.238  20.062   4.539
  238    HD2  LYS  31           HD2      LYS  31  73.788  20.333   4.278
  239    HD3  LYS  31           HD1      LYS  31  73.589  20.103   6.016
  240    HE2  LYS  31           HE2      LYS  31  75.293  22.283   4.780
  241    HE3  LYS  31           HE1      LYS  31  73.633  22.518   5.328
  242    HZ1  LYS  31           HZ1      LYS  31  75.401  21.251   7.240
  243    HZ2  LYS  31           HZ2      LYS  31  74.240  22.469   7.471
  244    HZ3  LYS  31           HZ3      LYS  31  75.782  22.864   6.876
  245    H    GLN  32           HN       GLN  32  76.812  15.920   2.966
  246    HA   GLN  32           HA       GLN  32  79.275  17.559   2.577
  247    HB2  GLN  32           HB2      GLN  32  78.983  15.419   4.176
  248    HB3  GLN  32           HB1      GLN  32  79.377  14.571   2.681
  249    HG2  GLN  32           HG2      GLN  32  81.323  16.296   2.490
  250    HG3  GLN  32           HG1      GLN  32  81.041  16.563   4.210
  251   HE21  GLN  32          HE21      GLN  32  81.303  14.658   5.667
  252   HE22  GLN  32          HE22      GLN  32  82.271  13.351   5.182
  253    H    ARG  33           HN       ARG  33  80.637  15.503   1.055
  254    HA   ARG  33           HA       ARG  33  79.115  14.783  -1.281
  255    HE   ARG  33           HE       ARG  33  83.248  19.081  -1.695
  256    HB2  ARG  33           HB2      ARG  33  80.132  16.383  -2.874
  257    HB3  ARG  33           HB1      ARG  33  79.142  17.210  -1.672
  258    HG2  ARG  33           HG2      ARG  33  81.303  17.506  -0.320
  259    HG3  ARG  33           HG1      ARG  33  82.156  17.021  -1.786
  260    HD2  ARG  33           HD2      ARG  33  80.819  18.847  -2.988
  261    HD3  ARG  33           HD1      ARG  33  80.371  19.428  -1.384
  262   HH11  ARG  33          HH21      ARG  33  80.506  21.107  -2.205
  263   HH12  ARG  33          HH22      ARG  33  81.424  22.576  -2.206
  264   HH21  ARG  33          HH11      ARG  33  84.463  20.987  -1.693
  265   HH22  ARG  33          HH12      ARG  33  83.665  22.508  -1.915
  266    H    GLN  34           HN       GLN  34  82.002  14.951   0.534
  267    HA   GLN  34           HA       GLN  34  83.125  12.666  -0.801
  268    HB2  GLN  34           HB2      GLN  34  83.728  14.173  -2.576
  269    HB3  GLN  34           HB1      GLN  34  84.331  15.373  -1.433
  270    HG2  GLN  34           HG2      GLN  34  86.176  13.971  -0.803
  271    HG3  GLN  34           HG1      GLN  34  85.500  12.590  -1.667
  272   HE21  GLN  34          HE21      GLN  34  85.308  15.785  -3.127
  273   HE22  GLN  34          HE22      GLN  34  86.477  15.513  -4.327
  274    H    THR  35           HN       THR  35  83.880  11.694   1.019
  275    HA   THR  35           HA       THR  35  85.022  13.320   3.202
  276    HB   THR  35           HB       THR  35  84.681  10.310   2.996
  277    HG1  THR  35           HG1      THR  35  83.057  11.784   4.646
  278   HG21  THR  35          HG21      THR  35  86.167  10.580   4.748
  279   HG22  THR  35          HG22      THR  35  84.641  10.788   5.608
  280   HG23  THR  35          HG23      THR  35  85.584  12.200   5.130
  281    H    ARG  36           HN       ARG  36  86.466  10.245   2.966
  282    HA   ARG  36           HA       ARG  36  88.657  10.904   1.211
  283    HE   ARG  36           HE       ARG  36  91.002  12.986   5.218
  284    HB2  ARG  36           HB2      ARG  36  89.095  12.441   3.177
  285    HB3  ARG  36           HB1      ARG  36  89.318  10.997   4.166
  286    HG2  ARG  36           HG2      ARG  36  91.245  10.337   2.994
  287    HG3  ARG  36           HG1      ARG  36  90.848  11.332   1.593
  288    HD2  ARG  36           HD2      ARG  36  92.691  12.324   2.923
  289    HD3  ARG  36           HD1      ARG  36  91.272  13.370   2.896
  290   HH11  ARG  36          HH21      ARG  36  93.211  10.783   3.751
  291   HH12  ARG  36          HH22      ARG  36  93.753  10.117   5.256
  292   HH21  ARG  36          HH11      ARG  36  91.696  12.128   7.191
  293   HH22  ARG  36          HH12      ARG  36  92.895  10.878   7.203
  294    H    GLN  37           HN       GLN  37  87.323   8.658   1.060
  295    HA   GLN  37           HA       GLN  37  89.265   6.621   1.789
  296    HB2  GLN  37           HB2      GLN  37  87.841   6.962   3.897
  297    HB3  GLN  37           HB1      GLN  37  86.504   6.275   2.972
  298    HG2  GLN  37           HG2      GLN  37  87.776   4.228   2.582
  299    HG3  GLN  37           HG1      GLN  37  89.180   4.914   3.401
  300   HE21  GLN  37          HE21      GLN  37  89.248   3.517   5.234
  301   HE22  GLN  37          HE22      GLN  37  87.988   3.408   6.367
  302    H1U  RCY  38           H1U      RCY  38  85.983  -0.838  -2.175
  303    H1S  RCY  38           H1S      RCY  38  86.464   1.634   1.095
  304    HB1  RCY  38           HB1      RCY  38  85.670   3.217  -1.345
  305    HB2  RCY  38           HB2      RCY  38  85.466   4.947  -1.073
  306    HA   RCY  38           HA       RCY  38  87.985   3.306  -1.055
  307    HN1  RCY  38           HN1      RCY  38  88.846   4.631   0.677
  308    H    LYS  39           HN       LYS  39  89.652   5.349  -1.821
  309    HA   LYS  39           HA       LYS  39  88.320   6.811  -4.028
  310    HB2  LYS  39           HB2      LYS  39  90.820   7.607  -4.328
  311    HB3  LYS  39           HB1      LYS  39  89.849   8.243  -3.002
  312    HG2  LYS  39           HG2      LYS  39  92.107   7.498  -2.251
  313    HG3  LYS  39           HG1      LYS  39  90.807   6.603  -1.463
  314    HD2  LYS  39           HD2      LYS  39  91.164   4.683  -2.796
  315    HD3  LYS  39           HD1      LYS  39  92.103   5.580  -3.989
  316    HE2  LYS  39           HE2      LYS  39  93.896   5.923  -2.336
  317    HE3  LYS  39           HE1      LYS  39  92.957   5.047  -1.127
  318    HZ1  LYS  39           HZ1      LYS  39  92.996   3.361  -3.254
  319    HZ2  LYS  39           HZ2      LYS  39  93.996   3.249  -1.884
  320    HZ3  LYS  39           HZ3      LYS  39  94.552   4.035  -3.283
  321    H    SER  40           HN       SER  40  88.911   3.787  -3.879
  322    HA   SER  40           HA       SER  40  89.750   3.549  -6.676
  323    HG   SER  40           HG       SER  40  92.063   3.874  -6.840
  324    HB2  SER  40           HB2      SER  40  91.475   2.569  -4.399
  325    HB3  SER  40           HB1      SER  40  91.550   1.833  -5.998
  326    H    LYS  41           HN       LYS  41  90.018   1.156  -4.060
  327    HA   LYS  41           HA       LYS  41  87.760  -0.335  -5.341
  328    HB2  LYS  41           HB2      LYS  41  89.084  -2.174  -3.738
  329    HB3  LYS  41           HB1      LYS  41  89.302  -1.998  -5.476
  330    HG2  LYS  41           HG2      LYS  41  91.494  -1.882  -4.502
  331    HG3  LYS  41           HG1      LYS  41  91.065  -0.235  -4.965
  332    HD2  LYS  41           HD2      LYS  41  90.296   0.186  -2.632
  333    HD3  LYS  41           HD1      LYS  41  90.843  -1.432  -2.188
  334    HE2  LYS  41           HE2      LYS  41  92.489   0.948  -3.022
  335    HE3  LYS  41           HE1      LYS  41  92.676  -0.081  -1.602
  336    HZ1  LYS  41           HZ1      LYS  41  94.358  -0.581  -3.244
  337    HZ2  LYS  41           HZ2      LYS  41  93.169  -0.885  -4.419
  338    HZ3  LYS  41           HZ3      LYS  41  93.312  -1.905  -3.068
  339    HA   PRO  42           HA       PRO  42  85.385   0.024  -1.662
  340    HB2  PRO  42           HB2      PRO  42  84.312  -2.534  -1.458
  341    HB3  PRO  42           HB1      PRO  42  83.696  -1.260  -2.523
  342    HG2  PRO  42           HG2      PRO  42  85.418  -3.587  -3.155
  343    HG3  PRO  42           HG1      PRO  42  84.166  -2.806  -4.133
  344    HD2  PRO  42           HD2      PRO  42  86.841  -2.436  -4.574
  345    HD3  PRO  42           HD1      PRO  42  85.619  -1.204  -4.957
  346    HA   PRO  43           HA       PRO  43  87.665  -1.621   1.770
  347    HB2  PRO  43           HB2      PRO  43  85.831  -1.528   3.767
  348    HB3  PRO  43           HB1      PRO  43  86.498  -0.057   3.029
  349    HG2  PRO  43           HG2      PRO  43  83.882  -1.391   2.530
  350    HG3  PRO  43           HG1      PRO  43  84.259   0.333   2.682
  351    HD2  PRO  43           HD2      PRO  43  83.922  -0.933   0.261
  352    HD3  PRO  43           HD1      PRO  43  84.927   0.517   0.478
  353    H    LYS  44           HN       LYS  44  87.714  -3.415   3.406
  354    HA   LYS  44           HA       LYS  44  87.236  -5.601   4.149
  355    HB2  LYS  44           HB2      LYS  44  84.762  -4.754   3.487
  356    HB3  LYS  44           HB1      LYS  44  84.974  -5.977   2.235
  357    HG2  LYS  44           HG2      LYS  44  85.586  -7.632   3.991
  358    HG3  LYS  44           HG1      LYS  44  85.277  -6.407   5.223
  359    HD2  LYS  44           HD2      LYS  44  82.950  -6.271   4.612
  360    HD3  LYS  44           HD1      LYS  44  83.209  -7.282   3.190
  361    HE2  LYS  44           HE2      LYS  44  82.204  -8.492   5.175
  362    HE3  LYS  44           HE1      LYS  44  83.688  -9.209   4.550
  363    HZ1  LYS  44           HZ1      LYS  44  83.222  -8.425   7.130
  364    HZ2  LYS  44           HZ2      LYS  44  84.221  -7.202   6.501
  365    HZ3  LYS  44           HZ3      LYS  44  84.727  -8.823   6.456
  366    H    LYS  45           HN       LYS  45  86.160  -7.665   2.305
  367    HA   LYS  45           HA       LYS  45  88.653  -8.170   0.863
  368    HB2  LYS  45           HB2      LYS  45  87.309  -9.957   2.038
  369    HB3  LYS  45           HB1      LYS  45  86.080  -9.768   0.789
  370    HG2  LYS  45           HG2      LYS  45  87.476 -11.590   0.091
  371    HG3  LYS  45           HG1      LYS  45  87.912 -10.212  -0.920
  372    HD2  LYS  45           HD2      LYS  45  89.470 -10.173   1.510
  373    HD3  LYS  45           HD1      LYS  45  89.635 -11.740   0.717
  374    HE2  LYS  45           HE2      LYS  45  90.396 -10.747  -1.313
  375    HE3  LYS  45           HE1      LYS  45  89.899  -9.136  -0.795
  376    HZ1  LYS  45           HZ1      LYS  45  92.358  -9.767  -0.615
  377    HZ2  LYS  45           HZ2      LYS  45  91.891 -10.672   0.745
  378    HZ3  LYS  45           HZ3      LYS  45  91.634  -8.993   0.710
  379    H    GLY  46           HN       GLY  46  88.246  -6.125  -0.497
  380    HA2  GLY  46           HA2      GLY  46  86.576  -6.844  -2.876
  381    HA3  GLY  46           HA1      GLY  46  86.739  -5.184  -2.301
  382    H    VAL  47           HN       VAL  47  89.345  -4.795  -1.897
  383    HA   VAL  47           HA       VAL  47  91.048  -3.956  -3.348
  384    HB   VAL  47           HB       VAL  47  91.712  -6.055  -1.973
  385   HG11  VAL  47          HG11      VAL  47  90.561  -7.431  -3.974
  386   HG12  VAL  47          HG12      VAL  47  91.906  -8.085  -3.038
  387   HG13  VAL  47          HG13      VAL  47  92.203  -7.348  -4.613
  388   HG21  VAL  47          HG21      VAL  47  93.931  -6.125  -3.150
  389   HG22  VAL  47          HG22      VAL  47  93.360  -4.486  -2.836
  390   HG23  VAL  47          HG23      VAL  47  93.221  -5.174  -4.454
  391    H    GLN  48           HN       GLN  48  88.788  -4.119  -4.981
  392    HA   GLN  48           HA       GLN  48  89.822  -5.429  -7.464
  393    HB2  GLN  48           HB2      GLN  48  87.555  -6.131  -6.668
  394    HB3  GLN  48           HB1      GLN  48  87.010  -4.466  -6.867
  395    HG2  GLN  48           HG2      GLN  48  87.153  -4.550  -9.189
  396    HG3  GLN  48           HG1      GLN  48  88.357  -5.839  -9.169
  397   HE21  GLN  48          HE21      GLN  48  86.599  -6.691 -10.832
  398   HE22  GLN  48          HE22      GLN  48  85.376  -7.664 -10.169
  399    H    GLY  49           HN       GLY  49  87.493  -2.765  -7.138
  400    HA2  GLY  49           HA2      GLY  49  88.997  -0.517  -7.600
  401    HA3  GLY  49           HA1      GLY  49  88.930  -1.263  -9.197
  402    H1U  RCY  50           H1U      RCY  50  79.198   3.611  -4.466
  403    H1S  RCY  50           H1S      RCY  50  81.541   2.024  -7.363
  404    HB1  RCY  50           HB1      RCY  50  85.748   2.228  -7.002
  405    HB2  RCY  50           HB2      RCY  50  84.683   0.826  -7.095
  406    HA   RCY  50           HA       RCY  50  84.979   0.648  -9.467
  407    HN1  RCY  50           HN1      RCY  50  87.775   1.234  -8.770
  408    H    GLY  51           HN       GLY  51  86.301   3.684  -8.214
  409    HA2  GLY  51           HA2      GLY  51  86.574   5.761  -9.269
  410    HA3  GLY  51           HA1      GLY  51  87.196   4.832 -10.633
  411    H    ASP  52           HN       ASP  52  85.887   4.536 -12.421
  412    HA   ASP  52           HA       ASP  52  84.102   4.922 -13.878
  413    HB2  ASP  52           HB2      ASP  52  82.051   4.174 -13.146
  414    HB3  ASP  52           HB1      ASP  52  83.036   3.572 -11.815
  415    H    ASP  53           HN       ASP  53  83.497   6.800 -14.842
  416    HA   ASP  53           HA       ASP  53  83.178   9.110 -15.113
  417    HB2  ASP  53           HB2      ASP  53  81.060   8.320 -13.884
  418    HB3  ASP  53           HB1      ASP  53  81.794   8.994 -12.428
  419    H    ILE  54           HN       ILE  54  82.831  10.819 -12.581
  420    HA   ILE  54           HA       ILE  54  85.752  11.133 -12.047
  421    HB   ILE  54           HB       ILE  54  83.438  13.081 -11.901
  422   HG12  ILE  54          HG12      ILE  54  84.759  12.377 -14.089
  423   HG13  ILE  54          HG11      ILE  54  84.364  14.070 -13.792
  424   HG21  ILE  54          HG21      ILE  54  86.280  13.280 -10.904
  425   HG22  ILE  54          HG22      ILE  54  84.789  13.698 -10.059
  426   HG23  ILE  54          HG23      ILE  54  85.373  14.718 -11.374
  427   HD11  ILE  54          HD11      ILE  54  86.555  14.575 -13.060
  428   HD12  ILE  54          HD12      ILE  54  86.803  13.517 -14.449
  429   HD13  ILE  54          HD13      ILE  54  86.956  12.876 -12.813
  430    HA   PRO  55           HA       PRO  55  84.270   9.725  -7.969
  431    HB2  PRO  55           HB2      PRO  55  86.598   8.639  -7.119
  432    HB3  PRO  55           HB1      PRO  55  85.555   7.819  -8.298
  433    HG2  PRO  55           HG2      PRO  55  88.066   9.344  -8.743
  434    HG3  PRO  55           HG1      PRO  55  87.476   7.879  -9.543
  435    HD2  PRO  55           HD2      PRO  55  87.290  10.453 -10.602
  436    HD3  PRO  55           HD1      PRO  55  86.297   9.070 -11.110
  437    H    GLY  56           HN       GLY  56  84.052  11.950  -7.202
  438    HA2  GLY  56           HA2      GLY  56  85.664  12.690  -5.042
  439    HA3  GLY  56           HA1      GLY  56  86.353  13.524  -6.435
  440    H    MET  57           HN       MET  57  84.014  14.097  -7.875
  441    HA   MET  57           HA       MET  57  83.052  16.405  -6.411
  442    HB2  MET  57           HB2      MET  57  82.188  15.149  -9.030
  443    HB3  MET  57           HB1      MET  57  81.524  16.659  -8.404
  444    HG2  MET  57           HG2      MET  57  83.850  17.585  -8.316
  445    HG3  MET  57           HG1      MET  57  84.425  16.108  -9.091
  446    HE1  MET  57           HE1      MET  57  84.130  19.451  -9.701
  447    HE2  MET  57           HE2      MET  57  84.155  19.461 -11.463
  448    HE3  MET  57           HE3      MET  57  85.319  18.478 -10.577
  449    H    GLU  58           HN       GLU  58  82.342  13.263  -5.935
  450    HA   GLU  58           HA       GLU  58  79.907  13.840  -4.496
  451    HB2  GLU  58           HB2      GLU  58  79.061  13.779  -6.865
  452    HB3  GLU  58           HB1      GLU  58  79.601  12.102  -6.961
  453    HG2  GLU  58           HG2      GLU  58  78.087  11.422  -5.231
  454    HG3  GLU  58           HG1      GLU  58  77.709  13.095  -4.817
  455    H    GLY  59           HN       GLY  59  80.428  12.624  -2.742
  456    HA2  GLY  59           HA2      GLY  59  80.609   9.726  -2.999
  457    HA3  GLY  59           HA1      GLY  59  82.138  10.466  -2.519
  458    H1U  RCY  60           H1U      RCY  60  74.133   8.260  -1.287
  459    H1S  RCY  60           H1S      RCY  60  76.687  11.327  -1.867
  460    HB1  RCY  60           HB1      RCY  60  78.427  12.164   1.952
  461    HB2  RCY  60           HB2      RCY  60  78.632  10.639   1.091
  462    HA   RCY  60           HA       RCY  60  80.547  12.950   1.317
  463    HN1  RCY  60           HN1      RCY  60  81.244  12.526  -0.882
  464    H    GLY  61           HN       GLY  61  79.413  10.572   2.924
  465    HA2  GLY  61           HA2      GLY  61  81.865   8.932   3.230
  466    HA3  GLY  61           HA1      GLY  61  81.323   9.861   4.629
  467    H    THR  62           HN       THR  62  80.512   8.316   5.986
  468    HA   THR  62           HA       THR  62  78.124   6.844   5.055
  469    HB   THR  62           HB       THR  62  79.243   4.891   4.817
  470    HG1  THR  62           HG1      THR  62  79.576   5.378   7.574
  471   HG21  THR  62          HG21      THR  62  81.560   6.344   6.117
  472   HG22  THR  62          HG22      THR  62  81.320   6.044   4.396
  473   HG23  THR  62          HG23      THR  62  81.669   4.701   5.485
  474    H    ASP  63           HN       ASP  63  76.610   6.955   6.610
  475    HA   ASP  63           HA       ASP  63  76.854   8.398   8.982
  476    HB2  ASP  63           HB2      ASP  63  75.004   6.101   8.298
  477    HB3  ASP  63           HB1      ASP  63  74.835   7.069   9.764
  478    H    ILE  64           HN       ILE  64  77.066   4.816   8.679
  479    HA   ILE  64           HA       ILE  64  77.916   4.620  11.466
  480    HB   ILE  64           HB       ILE  64  76.603   2.868   9.959
  481   HG12  ILE  64          HG12      ILE  64  77.017   2.580  12.344
  482   HG13  ILE  64          HG11      ILE  64  77.430   1.081  11.512
  483   HG21  ILE  64          HG21      ILE  64  79.498   2.012   9.657
  484   HG22  ILE  64          HG22      ILE  64  78.504   2.661   8.352
  485   HG23  ILE  64          HG23      ILE  64  78.080   1.123   9.103
  486   HD11  ILE  64          HD11      ILE  64  79.267   1.439  12.949
  487   HD12  ILE  64          HD12      ILE  64  79.284   3.175  12.638
  488   HD13  ILE  64          HD13      ILE  64  79.831   2.051  11.394
  489    H    THR  65           HN       THR  65  79.452   3.983   8.321
  490    HA   THR  65           HA       THR  65  81.815   5.163   8.308
  491    HB   THR  65           HB       THR  65  81.988   3.066  10.488
  492    HG1  THR  65           HG1      THR  65  82.118   4.805  11.622
  493   HG21  THR  65          HG21      THR  65  83.837   2.484   9.134
  494   HG22  THR  65          HG22      THR  65  84.512   3.589  10.332
  495   HG23  THR  65          HG23      THR  65  84.158   4.164   8.702
  496    H    VAL  66           HN       VAL  66  80.183   2.135   8.124
  497    HA   VAL  66           HA       VAL  66  81.630   1.489   5.638
  498    HB   VAL  66           HB       VAL  66  81.668  -0.997   6.674
  499   HG11  VAL  66          HG11      VAL  66  83.785   1.103   7.234
  500   HG12  VAL  66          HG12      VAL  66  83.584   0.251   5.703
  501   HG13  VAL  66          HG13      VAL  66  84.048  -0.639   7.153
  502   HG21  VAL  66          HG21      VAL  66  80.764   0.105   8.860
  503   HG22  VAL  66          HG22      VAL  66  82.424   0.661   9.075
  504   HG23  VAL  66          HG23      VAL  66  82.075  -1.066   8.992
  505    H    ILE  67           HN       ILE  67  79.533  -0.423   7.826
  506    HA   ILE  67           HA       ILE  67  77.377  -0.263   5.762
  507    HB   ILE  67           HB       ILE  67  78.409  -2.752   7.155
  508   HG12  ILE  67          HG12      ILE  67  79.650  -2.043   5.134
  509   HG13  ILE  67          HG11      ILE  67  78.757  -3.535   4.840
  510   HG21  ILE  67          HG21      ILE  67  76.046  -2.981   7.179
  511   HG22  ILE  67          HG22      ILE  67  76.560  -3.838   5.726
  512   HG23  ILE  67          HG23      ILE  67  75.875  -2.218   5.599
  513   HD11  ILE  67          HD11      ILE  67  76.863  -1.773   4.110
  514   HD12  ILE  67          HD12      ILE  67  78.076  -2.372   2.978
  515   HD13  ILE  67          HD13      ILE  67  78.291  -0.802   3.751
  516    H1U  RCY  68           H1U      RCY  68  77.625   1.352   3.726
  517    H1S  RCY  68           H1S      RCY  68  75.086   0.669   6.774
  518    HB1  RCY  68           HB1      RCY  68  75.050   2.820   8.365
  519    HB2  RCY  68           HB2      RCY  68  73.791   2.338   9.496
  520    HA   RCY  68           HA       RCY  68  75.630   0.818   9.816
  521    HN1  RCY  68           HN1      RCY  68  76.070   1.091   7.014
  522    HA   PRO  69           HA       PRO  69  72.937  -2.690   9.935
  523    HB2  PRO  69           HB2      PRO  69  71.593  -2.255  12.252
  524    HB3  PRO  69           HB1      PRO  69  73.320  -2.662  12.212
  525    HG2  PRO  69           HG2      PRO  69  72.022  -0.005  12.563
  526    HG3  PRO  69           HG1      PRO  69  73.437  -0.688  13.383
  527    HD2  PRO  69           HD2      PRO  69  73.611   1.105  11.299
  528    HD3  PRO  69           HD1      PRO  69  74.879  -0.077  11.686
  529    H    TRP  70           HN       TRP  70  71.280   0.464  10.361
  530    HA   TRP  70           HA       TRP  70  68.643  -0.588  10.007
  531    HD1  TRP  70           HD1      TRP  70  70.454   2.915   7.805
  532    HE1  TRP  70           HE1      TRP  70  72.523   4.161   8.703
  533    HE3  TRP  70           HE3      TRP  70  70.098   1.753  12.764
  534    HZ2  TRP  70           HZ2      TRP  70  73.856   4.606  11.199
  535    HZ3  TRP  70           HZ3      TRP  70  71.776   2.598  14.376
  536    HH2  TRP  70           HH2      TRP  70  73.652   4.021  13.604
  537    HB2  TRP  70           HB2      TRP  70  68.314   1.907   9.039
  538    HB3  TRP  70           HB1      TRP  70  68.445   1.566  10.760
  539    H    GLU  71           HN       GLU  71  70.869  -1.317   7.987
  540    HA   GLU  71           HA       GLU  71  69.072  -1.419   5.689
  541    HB2  GLU  71           HB2      GLU  71  71.537   0.324   5.688
  542    HB3  GLU  71           HB1      GLU  71  70.927  -0.385   4.194
  543    HG2  GLU  71           HG2      GLU  71  68.620   0.606   5.056
  544    HG3  GLU  71           HG1      GLU  71  69.678   1.696   5.951
  545    H    ALA  72           HN       ALA  72  70.677  -3.156   7.552
  546    HA   ALA  72           HA       ALA  72  72.871  -4.310   6.111
  547    HB1  ALA  72           HB1      ALA  72  71.059  -5.369   8.289
  548    HB2  ALA  72           HB2      ALA  72  72.719  -4.793   8.444
  549    HB3  ALA  72           HB3      ALA  72  72.388  -6.318   7.623
  550    H1U  RCY  73           H1U      RCY  73  73.602  -1.836  -2.147
  551    H1S  RCY  73           H1S      RCY  73  71.846  -5.980  -1.214
  552    HB1  RCY  73           HB1      RCY  73  72.595  -6.762   1.731
  553    HB2  RCY  73           HB2      RCY  73  72.027  -5.098   1.826
  554    HA   RCY  73           HA       RCY  73  70.033  -6.213   3.187
  555    HN1  RCY  73           HN1      RCY  73  72.545  -5.069   4.060
  556    H    ASN  74           HN       ASN  74  70.213  -7.727   5.246
  557    HA   ASN  74           HA       ASN  74  70.530  -9.896   6.095
  558    HB2  ASN  74           HB2      ASN  74  69.078 -10.458   4.217
  559    HB3  ASN  74           HB1      ASN  74  70.456 -10.464   3.116
  560   HD21  ASN  74          HD21      ASN  74  68.688 -12.367   5.435
  561   HD22  ASN  74          HD22      ASN  74  69.682 -13.741   5.373
  562    H    HIS  75           HN       HIS  75  72.290 -10.677   3.150
  563    HA   HIS  75           HA       HIS  75  74.906 -10.273   4.424
  564    HD1  HIS  75           HD1      HIS  75  75.770 -14.854   3.922
  565    HD2  HIS  75           HD2      HIS  75  77.164 -10.958   4.451
  566    HE1  HIS  75           HE1      HIS  75  78.297 -14.974   3.789
  567    HE2  HIS  75           HE2      HIS  75  79.158 -12.609   4.110
  568    HB2  HIS  75           HB2      HIS  75  74.213 -12.428   5.392
  569    HB3  HIS  75           HB1      HIS  75  73.906 -13.064   3.776
  570    H1U  RCY  76           H1U      RCY  76  77.817  -7.284   6.628
  571    H1S  RCY  76           H1S      RCY  76  76.317  -8.676   3.164
  572    HB1  RCY  76           HB1      RCY  76  76.647  -9.337  -0.847
  573    HB2  RCY  76           HB2      RCY  76  76.881 -10.264   0.634
  574    HA   RCY  76           HA       RCY  76  74.314  -8.873  -0.193
  575    HN1  RCY  76           HN1      RCY  76  73.918  -9.107   2.117
  576    H    GLU  77           HN       GLU  77  72.596 -10.497  -0.648
  577    HA   GLU  77           HA       GLU  77  73.037 -13.272  -0.928
  578    HB2  GLU  77           HB2      GLU  77  71.252 -11.431  -2.548
  579    HB3  GLU  77           HB1      GLU  77  71.168 -13.192  -2.598
  580    HG2  GLU  77           HG2      GLU  77  70.942 -11.641  -0.013
  581    HG3  GLU  77           HG1      GLU  77  69.535 -12.035  -1.002
  582    H    LEU  78           HN       LEU  78  74.037 -14.510  -2.485
  583    HA   LEU  78           HA       LEU  78  75.284 -15.036  -4.397
  584    HG   LEU  78           HG       LEU  78  74.085 -15.449  -6.244
  585    HB2  LEU  78           HB2      LEU  78  73.343 -13.224  -5.281
  586    HB3  LEU  78           HB1      LEU  78  74.854 -12.542  -5.876
  587   HD11  LEU  78          HD11      LEU  78  73.709 -14.664  -8.661
  588   HD12  LEU  78          HD12      LEU  78  73.639 -13.030  -8.001
  589   HD13  LEU  78          HD13      LEU  78  72.459 -14.238  -7.492
  590   HD21  LEU  78          HD21      LEU  78  76.082 -13.768  -7.774
  591   HD22  LEU  78          HD22      LEU  78  75.930 -15.524  -7.759
  592   HD23  LEU  78          HD23      LEU  78  76.530 -14.679  -6.332
  593    H    HIS  79           HN       HIS  79  75.543 -11.471  -4.076
  594    HA   HIS  79           HA       HIS  79  77.446 -10.114  -3.873
  595    HD1  HIS  79           HD1      HIS  79  80.941 -11.903  -3.202
  596    HD2  HIS  79           HD2      HIS  79  78.939  -8.889  -1.125
  597    HE1  HIS  79           HE1      HIS  79  82.690 -10.180  -2.579
  598    HE2  HIS  79           HE2      HIS  79  81.485  -8.340  -1.314
  599    HB2  HIS  79           HB2      HIS  79  77.542 -11.283  -1.685
  600    HB3  HIS  79           HB1      HIS  79  78.516 -12.554  -2.421
  601    H    GLU  80           HN       GLU  80  77.410 -12.791  -5.806
  602    HA   GLU  80           HA       GLU  80  80.269 -12.566  -6.599
  603    HB2  GLU  80           HB2      GLU  80  78.928 -14.807  -6.300
  604    HB3  GLU  80           HB1      GLU  80  78.311 -14.435  -7.910
  605    HG2  GLU  80           HG2      GLU  80  80.773 -14.083  -8.581
  606    HG3  GLU  80           HG1      GLU  80  81.172 -14.899  -7.069
  607    H    LEU  81           HN       LEU  81  77.187 -11.377  -7.496
  608    HA   LEU  81           HA       LEU  81  77.971 -10.944 -10.319
  609    HG   LEU  81           HG       LEU  81  75.474 -11.524  -7.847
  610    HB2  LEU  81           HB2      LEU  81  75.675  -9.613 -10.198
  611    HB3  LEU  81           HB1      LEU  81  75.687 -11.373 -10.277
  612   HD11  LEU  81          HD11      LEU  81  74.975  -9.252  -6.670
  613   HD12  LEU  81          HD12      LEU  81  75.820  -8.538  -8.044
  614   HD13  LEU  81          HD13      LEU  81  76.656  -9.680  -6.992
  615   HD21  LEU  81          HD21      LEU  81  73.215 -10.761  -7.648
  616   HD22  LEU  81          HD22      LEU  81  73.441 -11.143  -9.355
  617   HD23  LEU  81          HD23      LEU  81  73.477  -9.465  -8.814
  618    H    ALA  82           HN       ALA  82  78.512  -9.473  -7.377
  619    HA   ALA  82           HA       ALA  82  78.194  -6.696  -8.066
  620    HB1  ALA  82           HB1      ALA  82  79.847  -8.137  -5.984
  621    HB2  ALA  82           HB2      ALA  82  78.358  -7.223  -5.746
  622    HB3  ALA  82           HB3      ALA  82  79.855  -6.381  -6.142
  623    H    GLN  83           HN       GLN  83  81.400  -7.802  -7.165
  624    HA   GLN  83           HA       GLN  83  83.477  -7.384  -8.175
  625    HB2  GLN  83           HB2      GLN  83  82.034  -7.685 -10.813
  626    HB3  GLN  83           HB1      GLN  83  83.699  -8.108 -10.427
  627    HG2  GLN  83           HG2      GLN  83  82.834  -9.837  -8.833
  628    HG3  GLN  83           HG1      GLN  83  81.201  -9.476  -9.394
  629   HE21  GLN  83          HE21      GLN  83  83.141 -11.919  -9.753
  630   HE22  GLN  83          HE22      GLN  83  83.048 -12.233 -11.419
  631    H    TYR  84           HN       TYR  84  81.558  -6.067 -10.844
  632    HA   TYR  84           HA       TYR  84  82.475  -3.320 -10.077
  633    HD1  TYR  84           HD1      TYR  84  83.964  -6.289 -11.958
  634    HD2  TYR  84           HD2      TYR  84  80.981  -4.136 -14.175
  635    HE1  TYR  84           HE1      TYR  84  83.526  -8.308 -13.330
  636    HE2  TYR  84           HE2      TYR  84  80.543  -6.155 -15.546
  637    HH   TYR  84           HH       TYR  84  82.181  -8.361 -16.144
  638    HB2  TYR  84           HB2      TYR  84  82.435  -2.975 -12.677
  639    HB3  TYR  84           HB1      TYR  84  83.828  -3.774 -11.949
  640    H    GLY  85           HN       GLY  85  80.026  -4.407  -9.299
  641    HA2  GLY  85           HA2      GLY  85  77.760  -4.300 -10.789
  642    HA3  GLY  85           HA1      GLY  85  77.820  -3.547  -9.197
  643    H    ILE  86           HN       ILE  86  77.038  -2.932 -12.334
  644    HA   ILE  86           HA       ILE  86  78.065  -0.178 -12.475
  645    HB   ILE  86           HB       ILE  86  77.764  -1.585 -14.531
  646   HG12  ILE  86          HG12      ILE  86  76.048   0.916 -14.379
  647   HG13  ILE  86          HG11      ILE  86  77.786   0.878 -14.680
  648   HG21  ILE  86          HG21      ILE  86  74.809  -1.087 -14.273
  649   HG22  ILE  86          HG22      ILE  86  75.528  -2.516 -13.530
  650   HG23  ILE  86          HG23      ILE  86  75.651  -2.271 -15.272
  651   HD11  ILE  86          HD11      ILE  86  77.289  -0.600 -16.689
  652   HD12  ILE  86          HD12      ILE  86  76.733   1.068 -16.826
  653   HD13  ILE  86          HD13      ILE  86  75.585  -0.215 -16.446
  654    H1U  RCY  87           H1U      RCY  87  76.808   2.891  -4.247
  655    H1S  RCY  87           H1S      RCY  87  75.793   2.151  -8.161
  656    HB1  RCY  87           HB1      RCY  87  74.820   3.370  -9.551
  657    HB2  RCY  87           HB2      RCY  87  75.436   3.967 -11.093
  658    HA   RCY  87           HA       RCY  87  74.455   1.238 -10.366
  659    HN1  RCY  87           HN1      RCY  87  76.925   1.623 -11.884
  Start of MODEL   54
    1    HA   MET   1           HA       MET   1  63.852   9.687  27.649
    2    HB2  MET   1           HB2      MET   1  62.755  10.170  25.460
    3    HB3  MET   1           HB1      MET   1  62.611  11.510  26.597
    4    HG2  MET   1           HG2      MET   1  63.278  12.586  24.618
    5    HG3  MET   1           HG1      MET   1  64.802  12.382  25.482
    6    HE1  MET   1           HE1      MET   1  66.728  11.335  24.704
    7    HE2  MET   1           HE2      MET   1  66.379  12.532  23.459
    8    HE3  MET   1           HE3      MET   1  66.956  10.933  22.997
    9    H    ASN   2           HN       ASN   2  63.718   8.632  25.056
   10    HA   ASN   2           HA       ASN   2  66.512   8.139  24.201
   11    HB2  ASN   2           HB2      ASN   2  66.205   5.683  24.343
   12    HB3  ASN   2           HB1      ASN   2  66.111   6.439  25.934
   13   HD21  ASN   2          HD21      ASN   2  63.901   5.518  23.227
   14   HD22  ASN   2          HD22      ASN   2  62.627   5.039  24.241
   15    H    LEU   3           HN       LEU   3  66.405   6.530  22.234
   16    HA   LEU   3           HA       LEU   3  63.877   6.882  20.700
   17    HG   LEU   3           HG       LEU   3  64.451   9.226  20.801
   18    HB2  LEU   3           HB2      LEU   3  66.603   7.923  19.980
   19    HB3  LEU   3           HB1      LEU   3  65.527   7.384  18.692
   20   HD11  LEU   3          HD11      LEU   3  65.146  11.144  19.310
   21   HD12  LEU   3          HD12      LEU   3  66.197  10.016  18.454
   22   HD13  LEU   3          HD13      LEU   3  66.481  10.366  20.159
   23   HD21  LEU   3          HD21      LEU   3  62.916   9.827  19.087
   24   HD22  LEU   3          HD22      LEU   3  63.112   8.082  18.921
   25   HD23  LEU   3          HD23      LEU   3  63.954   9.173  17.820
   26    H    GLU   4           HN       GLU   4  63.529   4.627  20.875
   27    HA   GLU   4           HA       GLU   4  65.620   2.742  20.073
   28    HB2  GLU   4           HB2      GLU   4  62.827   2.587  21.103
   29    HB3  GLU   4           HB1      GLU   4  63.367   1.230  20.116
   30    HG2  GLU   4           HG2      GLU   4  63.842   0.859  22.523
   31    HG3  GLU   4           HG1      GLU   4  65.324   0.925  21.568
   32    HA   PRO   5           HA       PRO   5  64.957   2.511  15.729
   33    HB2  PRO   5           HB2      PRO   5  64.490  -0.263  15.435
   34    HB3  PRO   5           HB1      PRO   5  66.065   0.548  15.386
   35    HG2  PRO   5           HG2      PRO   5  64.765  -0.921  17.598
   36    HG3  PRO   5           HG1      PRO   5  66.482  -0.756  17.199
   37    HD2  PRO   5           HD2      PRO   5  65.361   0.586  19.273
   38    HD3  PRO   5           HD1      PRO   5  66.685   1.282  18.310
   39    HA   PRO   6           HA       PRO   6  60.645   2.506  14.818
   40    HB2  PRO   6           HB2      PRO   6  60.549   1.453  12.270
   41    HB3  PRO   6           HB1      PRO   6  61.086   3.103  12.642
   42    HG2  PRO   6           HG2      PRO   6  62.705   0.673  12.082
   43    HG3  PRO   6           HG1      PRO   6  62.975   2.352  11.584
   44    HD2  PRO   6           HD2      PRO   6  64.342   1.199  13.646
   45    HD3  PRO   6           HD1      PRO   6  63.962   2.935  13.602
   46    H    LYS   7           HN       LYS   7  58.736   1.136  14.432
   47    HA   LYS   7           HA       LYS   7  59.265  -1.783  14.841
   48    HB2  LYS   7           HB2      LYS   7  57.033  -0.126  16.051
   49    HB3  LYS   7           HB1      LYS   7  57.280  -1.856  16.287
   50    HG2  LYS   7           HG2      LYS   7  59.530  -1.354  17.259
   51    HG3  LYS   7           HG1      LYS   7  59.160   0.366  17.135
   52    HD2  LYS   7           HD2      LYS   7  57.006  -0.240  18.469
   53    HD3  LYS   7           HD1      LYS   7  57.877  -1.714  18.895
   54    HE2  LYS   7           HE2      LYS   7  59.816  -0.146  19.569
   55    HE3  LYS   7           HE1      LYS   7  58.616   1.145  19.520
   56    HZ1  LYS   7           HZ1      LYS   7  57.887  -1.276  20.968
   57    HZ2  LYS   7           HZ2      LYS   7  57.545   0.350  21.323
   58    HZ3  LYS   7           HZ3      LYS   7  59.075  -0.297  21.681
   59    H    ALA   8           HN       ALA   8  56.109  -0.315  14.595
   60    HA   ALA   8           HA       ALA   8  54.390  -0.692  13.040
   61    HB1  ALA   8           HB1      ALA   8  55.983   0.838  11.774
   62    HB2  ALA   8           HB2      ALA   8  54.941  -0.164  10.764
   63    HB3  ALA   8           HB3      ALA   8  56.630  -0.612  11.004
   64    H    GLU   9           HN       GLU   9  53.909  -2.179  10.966
   65    HA   GLU   9           HA       GLU   9  54.649  -4.908  11.821
   66    HB2  GLU   9           HB2      GLU   9  52.271  -4.116  11.182
   67    HB3  GLU   9           HB1      GLU   9  52.833  -4.199   9.513
   68    HG2  GLU   9           HG2      GLU   9  51.863  -6.329   9.945
   69    HG3  GLU   9           HG1      GLU   9  53.605  -6.586  10.055
   70    H1U  RCY  10           H1U      RCY  10  59.274 -11.420   3.400
   71    H1S  RCY  10           H1S      RCY  10  56.944  -8.943   6.715
   72    HB1  RCY  10           HB1      RCY  10  55.793  -7.279   8.439
   73    HB2  RCY  10           HB2      RCY  10  57.189  -6.969   7.418
   74    HA   RCY  10           HA       RCY  10  56.757  -4.767   7.718
   75    HN1  RCY  10           HN1      RCY  10  53.964  -5.229   8.650
   76    H    ARG  11           HN       ARG  11  53.703  -3.953   7.285
   77    HA   ARG  11           HA       ARG  11  53.401  -4.422   4.406
   78    HE   ARG  11           HE       ARG  11  52.796  -6.452   4.561
   79    HB2  ARG  11           HB2      ARG  11  51.812  -3.108   6.573
   80    HB3  ARG  11           HB1      ARG  11  51.509  -2.584   4.917
   81    HG2  ARG  11           HG2      ARG  11  50.011  -4.442   5.507
   82    HG3  ARG  11           HG1      ARG  11  51.141  -4.945   4.250
   83    HD2  ARG  11           HD2      ARG  11  52.179  -5.370   6.959
   84    HD3  ARG  11           HD1      ARG  11  50.705  -6.282   6.633
   85   HH11  ARG  11          HH21      ARG  11  51.251  -7.751   7.356
   86   HH12  ARG  11          HH22      ARG  11  51.825  -9.363   7.088
   87   HH21  ARG  11          HH11      ARG  11  53.555  -8.549   4.195
   88   HH22  ARG  11          HH12      ARG  11  53.130  -9.815   5.298
   89    H    SER  12           HN       SER  12  54.701  -1.939   6.489
   90    HA   SER  12           HA       SER  12  55.861   0.032   5.964
   91    HG   SER  12           HG       SER  12  58.060  -0.003   4.363
   92    HB2  SER  12           HB2      SER  12  56.736  -1.614   4.107
   93    HB3  SER  12           HB1      SER  12  55.720  -0.651   3.038
   94    H    ALA  13           HN       ALA  13  55.444   1.463   3.353
   95    HA   ALA  13           HA       ALA  13  52.576   1.990   3.204
   96    HB1  ALA  13           HB1      ALA  13  54.404   4.099   4.393
   97    HB2  ALA  13           HB2      ALA  13  53.165   3.205   5.275
   98    HB3  ALA  13           HB3      ALA  13  52.701   4.321   3.990
   99    H    THR  14           HN       THR  14  55.413   1.717   1.717
  100    HA   THR  14           HA       THR  14  54.539   3.424  -0.535
  101    HB   THR  14           HB       THR  14  55.981   5.031   0.339
  102    HG1  THR  14           HG1      THR  14  58.153   4.429  -0.705
  103   HG21  THR  14          HG21      THR  14  57.645   2.704   1.326
  104   HG22  THR  14          HG22      THR  14  56.730   3.857   2.297
  105   HG23  THR  14          HG23      THR  14  58.174   4.383   1.430
  106    H    ARG  15           HN       ARG  15  54.756   2.253  -2.377
  107    HA   ARG  15           HA       ARG  15  56.064  -0.340  -2.328
  108    HE   ARG  15           HE       ARG  15  50.754  -0.112  -3.279
  109    HB2  ARG  15           HB2      ARG  15  54.748   1.303  -4.501
  110    HB3  ARG  15           HB1      ARG  15  55.545  -0.228  -4.854
  111    HG2  ARG  15           HG2      ARG  15  53.356  -0.936  -4.457
  112    HG3  ARG  15           HG1      ARG  15  54.077  -1.124  -2.858
  113    HD2  ARG  15           HD2      ARG  15  53.195   1.043  -2.162
  114    HD3  ARG  15           HD1      ARG  15  52.559   1.334  -3.781
  115   HH11  ARG  15          HH21      ARG  15  53.345  -0.395  -1.022
  116   HH12  ARG  15          HH22      ARG  15  52.460  -1.406   0.070
  117   HH21  ARG  15          HH11      ARG  15  49.583  -1.431  -1.866
  118   HH22  ARG  15          HH12      ARG  15  50.330  -1.992  -0.407
  119    H    VAL  16           HN       VAL  16  57.606  -0.820  -4.309
  120    HA   VAL  16           HA       VAL  16  59.811   1.179  -4.137
  121    HB   VAL  16           HB       VAL  16  60.386  -1.118  -3.496
  122   HG11  VAL  16          HG11      VAL  16  59.578  -1.866  -6.322
  123   HG12  VAL  16          HG12      VAL  16  58.610  -2.205  -4.887
  124   HG13  VAL  16          HG13      VAL  16  60.193  -2.957  -5.081
  125   HG21  VAL  16          HG21      VAL  16  62.348  -1.321  -4.813
  126   HG22  VAL  16          HG22      VAL  16  61.956   0.396  -4.888
  127   HG23  VAL  16          HG23      VAL  16  61.556  -0.659  -6.243
  128    H    MET  17           HN       MET  17  57.338   0.222  -6.222
  129    HA   MET  17           HA       MET  17  56.924   0.659  -8.491
  130    HB2  MET  17           HB2      MET  17  57.660   2.962  -7.565
  131    HB3  MET  17           HB1      MET  17  59.204   2.636  -8.353
  132    HG2  MET  17           HG2      MET  17  57.975   3.815  -9.991
  133    HG3  MET  17           HG1      MET  17  57.794   2.125 -10.463
  134    HE1  MET  17           HE1      MET  17  56.569   4.940  -8.389
  135    HE2  MET  17           HE2      MET  17  54.809   4.930  -8.479
  136    HE3  MET  17           HE3      MET  17  55.756   5.383  -9.895
  137    H    GLY  18           HN       GLY  18  58.716  -1.488  -7.891
  138    HA2  GLY  18           HA2      GLY  18  60.489  -1.377 -10.299
  139    HA3  GLY  18           HA1      GLY  18  61.020  -2.137  -8.798
  140    H    GLY  19           HN       GLY  19  59.975  -2.927 -11.759
  141    HA2  GLY  19           HA2      GLY  19  58.197  -5.153 -10.904
  142    HA3  GLY  19           HA1      GLY  19  58.455  -4.633 -12.571
  143    HA   PRO  20           HA       PRO  20  60.812  -8.556 -12.490
  144    HB2  PRO  20           HB2      PRO  20  61.413  -7.439 -15.210
  145    HB3  PRO  20           HB1      PRO  20  60.987  -9.099 -14.744
  146    HG2  PRO  20           HG2      PRO  20  59.202  -7.479 -15.865
  147    HG3  PRO  20           HG1      PRO  20  58.738  -8.612 -14.585
  148    HD2  PRO  20           HD2      PRO  20  59.030  -5.648 -14.452
  149    HD3  PRO  20           HD1      PRO  20  57.987  -6.724 -13.497
  150    H1U  RCY  21           H1U      RCY  21  63.445  -8.440  -4.735
  151    H1S  RCY  21           H1S      RCY  21  63.487  -7.778  -9.395
  152    HB1  RCY  21           HB1      RCY  21  66.443  -8.881 -11.996
  153    HB2  RCY  21           HB2      RCY  21  64.850  -9.455 -11.502
  154    HA   RCY  21           HA       RCY  21  64.829  -6.631 -12.282
  155    HN1  RCY  21           HN1      RCY  21  63.191  -9.015 -13.031
  156    H    THR  22           HN       THR  22  65.697  -5.727 -14.088
  157    HA   THR  22           HA       THR  22  66.747  -7.552 -16.219
  158    HB   THR  22           HB       THR  22  65.175  -6.217 -17.312
  159    HG1  THR  22           HG1      THR  22  66.883  -4.212 -17.733
  160   HG21  THR  22          HG21      THR  22  65.018  -3.719 -16.791
  161   HG22  THR  22          HG22      THR  22  66.041  -4.048 -15.393
  162   HG23  THR  22          HG23      THR  22  64.457  -4.812 -15.525
  163    HA   PRO  23           HA       PRO  23  70.584  -6.057 -14.161
  164    HB2  PRO  23           HB2      PRO  23  71.646  -7.802 -16.350
  165    HB3  PRO  23           HB1      PRO  23  72.111  -7.731 -14.639
  166    HG2  PRO  23           HG2      PRO  23  70.594  -9.702 -15.581
  167    HG3  PRO  23           HG1      PRO  23  70.325  -9.021 -13.967
  168    HD2  PRO  23           HD2      PRO  23  68.713  -8.655 -16.455
  169    HD3  PRO  23           HD1      PRO  23  68.188  -8.645 -14.757
  170    H    ARG  24           HN       ARG  24  72.705  -5.181 -15.263
  171    HA   ARG  24           HA       ARG  24  72.555  -4.177 -17.957
  172    HE   ARG  24           HE       ARG  24  71.035   1.218 -18.525
  173    HB2  ARG  24           HB2      ARG  24  70.811  -2.768 -16.724
  174    HB3  ARG  24           HB1      ARG  24  72.149  -2.076 -15.812
  175    HG2  ARG  24           HG2      ARG  24  72.839  -0.803 -17.565
  176    HG3  ARG  24           HG1      ARG  24  72.599  -2.113 -18.721
  177    HD2  ARG  24           HD2      ARG  24  70.357  -1.575 -19.072
  178    HD3  ARG  24           HD1      ARG  24  70.206  -0.758 -17.516
  179   HH11  ARG  24          HH21      ARG  24  71.518  -1.579 -20.482
  180   HH12  ARG  24          HH22      ARG  24  72.037  -0.681 -21.870
  181   HH21  ARG  24          HH11      ARG  24  71.710   2.406 -20.326
  182   HH22  ARG  24          HH12      ARG  24  72.146   1.574 -21.781
  183    H    LYS  25           HN       LYS  25  74.474  -5.498 -16.279
  184    HA   LYS  25           HA       LYS  25  76.424  -3.955 -15.039
  185    HB2  LYS  25           HB2      LYS  25  77.377  -6.039 -16.967
  186    HB3  LYS  25           HB1      LYS  25  77.855  -5.759 -15.294
  187    HG2  LYS  25           HG2      LYS  25  76.564  -7.654 -15.003
  188    HG3  LYS  25           HG1      LYS  25  75.311  -6.423 -14.837
  189    HD2  LYS  25           HD2      LYS  25  74.337  -7.834 -16.412
  190    HD3  LYS  25           HD1      LYS  25  75.148  -6.669 -17.460
  191    HE2  LYS  25           HE2      LYS  25  77.177  -8.308 -17.294
  192    HE3  LYS  25           HE1      LYS  25  75.967  -9.483 -16.779
  193    HZ1  LYS  25           HZ1      LYS  25  75.086  -8.010 -19.047
  194    HZ2  LYS  25           HZ2      LYS  25  75.239  -9.690 -18.847
  195    HZ3  LYS  25           HZ3      LYS  25  76.570  -8.768 -19.361
  196    H    GLY  26           HN       GLY  26  77.082  -1.998 -15.831
  197    HA2  GLY  26           HA2      GLY  26  77.871  -1.842 -18.709
  198    HA3  GLY  26           HA1      GLY  26  77.439  -0.450 -17.713
  199    HA   PRO  27           HA       PRO  27  82.215  -1.722 -18.004
  200    HB2  PRO  27           HB2      PRO  27  82.067   1.076 -19.087
  201    HB3  PRO  27           HB1      PRO  27  83.197  -0.230 -19.501
  202    HG2  PRO  27           HG2      PRO  27  81.108   0.388 -21.056
  203    HG3  PRO  27           HG1      PRO  27  81.696  -1.273 -20.881
  204    HD2  PRO  27           HD2      PRO  27  79.191  -0.076 -19.875
  205    HD3  PRO  27           HD1      PRO  27  79.603  -1.788 -20.114
  206    HA   PRO  28           HA       PRO  28  82.598   0.030 -13.900
  207    HB2  PRO  28           HB2      PRO  28  85.415   0.506 -14.811
  208    HB3  PRO  28           HB1      PRO  28  84.828  -0.220 -13.302
  209    HG2  PRO  28           HG2      PRO  28  85.782  -1.701 -15.322
  210    HG3  PRO  28           HG1      PRO  28  84.479  -2.267 -14.265
  211    HD2  PRO  28           HD2      PRO  28  84.348  -1.440 -17.103
  212    HD3  PRO  28           HD1      PRO  28  83.221  -2.448 -16.170
  213    H    LYS  29           HN       LYS  29  82.740   2.120 -12.949
  214    HA   LYS  29           HA       LYS  29  83.188   4.372 -14.878
  215    HB2  LYS  29           HB2      LYS  29  80.788   3.799 -13.819
  216    HB3  LYS  29           HB1      LYS  29  81.434   4.752 -12.485
  217    HG2  LYS  29           HG2      LYS  29  81.962   6.586 -14.070
  218    HG3  LYS  29           HG1      LYS  29  81.258   5.638 -15.381
  219    HD2  LYS  29           HD2      LYS  29  79.659   6.218 -12.897
  220    HD3  LYS  29           HD1      LYS  29  79.763   7.412 -14.191
  221    HE2  LYS  29           HE2      LYS  29  78.766   4.560 -14.440
  222    HE3  LYS  29           HE1      LYS  29  77.799   6.029 -14.568
  223    HZ1  LYS  29           HZ1      LYS  29  79.924   5.095 -16.410
  224    HZ2  LYS  29           HZ2      LYS  29  79.279   6.666 -16.461
  225    HZ3  LYS  29           HZ3      LYS  29  78.279   5.325 -16.755
  226    H1U  RCY  30           H1U      RCY  30  81.377  10.036  -8.786
  227    H1S  RCY  30           H1S      RCY  30  85.157   8.686  -9.845
  228    HB1  RCY  30           HB1      RCY  30  85.032   5.666  -9.306
  229    HB2  RCY  30           HB2      RCY  30  83.850   5.807 -10.607
  230    HA   RCY  30           HA       RCY  30  86.313   4.404 -11.403
  231    HN1  RCY  30           HN1      RCY  30  84.034   2.895 -11.913
  232    H    LYS  31           HN       LYS  31  84.400   1.927 -10.821
  233    HA   LYS  31           HA       LYS  31  85.020   1.555  -7.945
  234    HB2  LYS  31           HB2      LYS  31  83.793  -0.646  -9.542
  235    HB3  LYS  31           HB1      LYS  31  83.380  -0.062  -7.931
  236    HG2  LYS  31           HG2      LYS  31  82.746   1.358 -10.536
  237    HG3  LYS  31           HG1      LYS  31  81.589   0.476  -9.539
  238    HD2  LYS  31           HD2      LYS  31  82.469   2.080  -7.635
  239    HD3  LYS  31           HD1      LYS  31  82.947   3.096  -8.996
  240    HE2  LYS  31           HE2      LYS  31  80.741   3.799  -8.445
  241    HE3  LYS  31           HE1      LYS  31  80.555   2.778  -9.871
  242    HZ1  LYS  31           HZ1      LYS  31  78.941   2.215  -8.166
  243    HZ2  LYS  31           HZ2      LYS  31  80.190   1.904  -7.056
  244    HZ3  LYS  31           HZ3      LYS  31  80.007   0.921  -8.430
  245    H    GLN  32           HN       GLN  32  87.236   1.689  -9.779
  246    HA   GLN  32           HA       GLN  32  88.129  -1.036 -10.331
  247    HB2  GLN  32           HB2      GLN  32  88.767   1.162 -11.580
  248    HB3  GLN  32           HB1      GLN  32  89.936   1.377 -10.278
  249    HG2  GLN  32           HG2      GLN  32  91.147   0.198 -11.929
  250    HG3  GLN  32           HG1      GLN  32  90.654  -1.059 -10.794
  251   HE21  GLN  32          HE21      GLN  32  91.206  -1.885 -13.390
  252   HE22  GLN  32          HE22      GLN  32  89.767  -2.270 -14.203
  253    H    ARG  33           HN       ARG  33  87.542  -0.075  -7.467
  254    HA   ARG  33           HA       ARG  33  89.638  -1.566  -6.197
  255    HE   ARG  33           HE       ARG  33  89.335   4.433  -6.321
  256    HB2  ARG  33           HB2      ARG  33  90.618   0.372  -4.891
  257    HB3  ARG  33           HB1      ARG  33  91.067   0.325  -6.595
  258    HG2  ARG  33           HG2      ARG  33  89.611   2.088  -7.157
  259    HG3  ARG  33           HG1      ARG  33  88.659   1.891  -5.685
  260    HD2  ARG  33           HD2      ARG  33  90.588   2.662  -4.342
  261    HD3  ARG  33           HD1      ARG  33  91.522   2.884  -5.821
  262   HH11  ARG  33          HH21      ARG  33  91.407   4.053  -3.592
  263   HH12  ARG  33          HH22      ARG  33  91.219   5.688  -3.054
  264   HH21  ARG  33          HH11      ARG  33  89.077   6.571  -5.634
  265   HH22  ARG  33          HH12      ARG  33  89.899   7.114  -4.210
  266    H    GLN  34           HN       GLN  34  89.274  -1.777  -3.906
  267    HA   GLN  34           HA       GLN  34  86.674  -0.623  -2.965
  268    HB2  GLN  34           HB2      GLN  34  86.589  -2.805  -1.566
  269    HB3  GLN  34           HB1      GLN  34  86.205  -2.919  -3.284
  270    HG2  GLN  34           HG2      GLN  34  88.410  -3.736  -3.803
  271    HG3  GLN  34           HG1      GLN  34  88.979  -3.399  -2.168
  272   HE21  GLN  34          HE21      GLN  34  86.969  -5.597  -4.099
  273   HE22  GLN  34          HE22      GLN  34  86.813  -6.787  -2.898
  274    H    THR  35           HN       THR  35  89.901  -1.770  -2.087
  275    HA   THR  35           HA       THR  35  91.280  -1.228  -0.272
  276    HB   THR  35           HB       THR  35  89.466   1.160   0.119
  277    HG1  THR  35           HG1      THR  35  91.532   1.778  -1.370
  278   HG21  THR  35          HG21      THR  35  92.458   0.855   0.463
  279   HG22  THR  35          HG22      THR  35  91.302   0.643   1.777
  280   HG23  THR  35          HG23      THR  35  91.454   2.209   0.982
  281    H    ARG  36           HN       ARG  36  91.300  -2.064   1.766
  282    HA   ARG  36           HA       ARG  36  88.797  -2.882   2.999
  283    HE   ARG  36           HE       ARG  36  95.044  -3.190   3.933
  284    HB2  ARG  36           HB2      ARG  36  90.276  -3.706   4.838
  285    HB3  ARG  36           HB1      ARG  36  90.782  -4.284   3.251
  286    HG2  ARG  36           HG2      ARG  36  92.375  -2.304   3.163
  287    HG3  ARG  36           HG1      ARG  36  91.998  -2.031   4.865
  288    HD2  ARG  36           HD2      ARG  36  92.752  -4.317   5.403
  289    HD3  ARG  36           HD1      ARG  36  93.128  -4.595   3.703
  290   HH11  ARG  36          HH21      ARG  36  92.987  -3.197   6.700
  291   HH12  ARG  36          HH22      ARG  36  94.136  -2.398   7.721
  292   HH21  ARG  36          HH11      ARG  36  96.556  -2.146   5.250
  293   HH22  ARG  36          HH12      ARG  36  96.156  -1.802   6.900
  294    H    GLN  37           HN       GLN  37  88.917  -0.063   2.650
  295    HA   GLN  37           HA       GLN  37  89.713   1.302   5.053
  296    HB2  GLN  37           HB2      GLN  37  89.168   2.285   2.715
  297    HB3  GLN  37           HB1      GLN  37  87.485   2.225   3.238
  298    HG2  GLN  37           HG2      GLN  37  88.234   4.403   3.835
  299    HG3  GLN  37           HG1      GLN  37  88.260   3.482   5.340
  300   HE21  GLN  37          HE21      GLN  37  90.214   3.521   6.468
  301   HE22  GLN  37          HE22      GLN  37  91.712   3.954   5.798
  302    H1U  RCY  38           H1U      RCY  38  82.660   5.666   5.046
  303    H1S  RCY  38           H1S      RCY  38  83.900   1.345   4.216
  304    HB1  RCY  38           HB1      RCY  38  85.513   2.433   6.229
  305    HB2  RCY  38           HB2      RCY  38  84.687   2.129   7.756
  306    HA   RCY  38           HA       RCY  38  86.801   1.637   8.484
  307    HN1  RCY  38           HN1      RCY  38  88.468   1.888   6.860
  308    H    LYS  39           HN       LYS  39  86.252  -0.071   9.791
  309    HA   LYS  39           HA       LYS  39  85.601  -2.691   8.604
  310    HB2  LYS  39           HB2      LYS  39  87.419  -3.630  10.333
  311    HB3  LYS  39           HB1      LYS  39  87.852  -3.210   8.676
  312    HG2  LYS  39           HG2      LYS  39  88.752  -1.109   9.329
  313    HG3  LYS  39           HG1      LYS  39  87.997  -1.192  10.920
  314    HD2  LYS  39           HD2      LYS  39  90.371  -1.714  11.132
  315    HD3  LYS  39           HD1      LYS  39  89.426  -3.168  11.453
  316    HE2  LYS  39           HE2      LYS  39  89.899  -4.071   9.296
  317    HE3  LYS  39           HE1      LYS  39  90.525  -2.530   8.709
  318    HZ1  LYS  39           HZ1      LYS  39  92.503  -3.358   9.273
  319    HZ2  LYS  39           HZ2      LYS  39  91.834  -4.580  10.246
  320    HZ3  LYS  39           HZ3      LYS  39  92.061  -3.018  10.875
  321    H    SER  40           HN       SER  40  86.892  -2.219  11.852
  322    HA   SER  40           HA       SER  40  84.777  -3.444  13.206
  323    HG   SER  40           HG       SER  40  86.993  -0.886  13.099
  324    HB2  SER  40           HB2      SER  40  85.493  -2.015  15.187
  325    HB3  SER  40           HB1      SER  40  86.784  -2.933  14.417
  326    H    LYS  41           HN       LYS  41  85.026  -0.081  14.094
  327    HA   LYS  41           HA       LYS  41  82.115   0.209  13.585
  328    HB2  LYS  41           HB2      LYS  41  82.214   2.099  15.093
  329    HB3  LYS  41           HB1      LYS  41  83.112   0.775  15.836
  330    HG2  LYS  41           HG2      LYS  41  85.198   1.788  14.727
  331    HG3  LYS  41           HG1      LYS  41  84.209   3.220  14.440
  332    HD2  LYS  41           HD2      LYS  41  83.642   3.073  16.968
  333    HD3  LYS  41           HD1      LYS  41  85.047   2.013  17.072
  334    HE2  LYS  41           HE2      LYS  41  84.922   4.928  16.379
  335    HE3  LYS  41           HE1      LYS  41  86.034   4.085  17.457
  336    HZ1  LYS  41           HZ1      LYS  41  86.574   2.915  15.117
  337    HZ2  LYS  41           HZ2      LYS  41  87.422   4.255  15.725
  338    HZ3  LYS  41           HZ3      LYS  41  86.176   4.478  14.593
  339    HA   PRO  42           HA       PRO  42  82.928   2.767  10.047
  340    HB2  PRO  42           HB2      PRO  42  80.610   4.211   9.941
  341    HB3  PRO  42           HB1      PRO  42  80.697   2.494   9.500
  342    HG2  PRO  42           HG2      PRO  42  79.746   3.743  12.031
  343    HG3  PRO  42           HG1      PRO  42  79.082   2.370  11.129
  344    HD2  PRO  42           HD2      PRO  42  80.636   2.069  13.368
  345    HD3  PRO  42           HD1      PRO  42  80.567   0.861  12.065
  346    HA   PRO  43           HA       PRO  43  84.369   6.647  11.717
  347    HB2  PRO  43           HB2      PRO  43  84.906   8.014   9.440
  348    HB3  PRO  43           HB1      PRO  43  85.863   6.604   9.937
  349    HG2  PRO  43           HG2      PRO  43  83.694   6.782   7.905
  350    HG3  PRO  43           HG1      PRO  43  85.223   5.889   7.849
  351    HD2  PRO  43           HD2      PRO  43  82.792   4.729   8.466
  352    HD3  PRO  43           HD1      PRO  43  84.361   4.085   8.998
  353    H    LYS  44           HN       LYS  44  83.076   8.153  12.652
  354    HA   LYS  44           HA       LYS  44  81.792  10.293  11.473
  355    HB2  LYS  44           HB2      LYS  44  80.367   8.553  10.290
  356    HB3  LYS  44           HB1      LYS  44  79.740   8.091  11.870
  357    HG2  LYS  44           HG2      LYS  44  78.726  10.205  12.210
  358    HG3  LYS  44           HG1      LYS  44  79.655  10.950  10.908
  359    HD2  LYS  44           HD2      LYS  44  77.421  10.575  10.076
  360    HD3  LYS  44           HD1      LYS  44  78.479   9.398   9.298
  361    HE2  LYS  44           HE2      LYS  44  76.336   8.404  10.155
  362    HE3  LYS  44           HE1      LYS  44  77.781   7.663  10.842
  363    HZ1  LYS  44           HZ1      LYS  44  77.077   8.221  12.848
  364    HZ2  LYS  44           HZ2      LYS  44  75.681   8.929  12.185
  365    HZ3  LYS  44           HZ3      LYS  44  77.081   9.863  12.421
  366    H    LYS  45           HN       LYS  45  80.677   7.775  13.763
  367    HA   LYS  45           HA       LYS  45  81.205   9.556  16.033
  368    HB2  LYS  45           HB2      LYS  45  78.784   9.282  16.840
  369    HB3  LYS  45           HB1      LYS  45  79.046  10.430  15.528
  370    HG2  LYS  45           HG2      LYS  45  78.398   8.714  13.883
  371    HG3  LYS  45           HG1      LYS  45  78.146   7.554  15.188
  372    HD2  LYS  45           HD2      LYS  45  75.999   8.527  14.536
  373    HD3  LYS  45           HD1      LYS  45  76.424   9.068  16.161
  374    HE2  LYS  45           HE2      LYS  45  76.693  11.236  15.508
  375    HE3  LYS  45           HE1      LYS  45  77.424  10.784  13.968
  376    HZ1  LYS  45           HZ1      LYS  45  74.759   9.939  13.957
  377    HZ2  LYS  45           HZ2      LYS  45  75.489  11.128  12.987
  378    HZ3  LYS  45           HZ3      LYS  45  74.781  11.556  14.471
  379    H    GLY  46           HN       GLY  46  79.808   6.521  14.825
  380    HA2  GLY  46           HA2      GLY  46  81.126   4.547  15.909
  381    HA3  GLY  46           HA1      GLY  46  80.513   5.222  17.419
  382    H    VAL  47           HN       VAL  47  77.964   5.714  17.144
  383    HA   VAL  47           HA       VAL  47  76.655   3.214  17.086
  384    HB   VAL  47           HB       VAL  47  74.551   4.711  16.684
  385   HG11  VAL  47          HG11      VAL  47  76.429   5.094  19.035
  386   HG12  VAL  47          HG12      VAL  47  75.164   3.874  18.884
  387   HG13  VAL  47          HG13      VAL  47  74.732   5.577  19.030
  388   HG21  VAL  47          HG21      VAL  47  76.537   6.881  17.375
  389   HG22  VAL  47          HG22      VAL  47  74.858   7.059  16.864
  390   HG23  VAL  47          HG23      VAL  47  76.083   6.544  15.705
  391    H    GLN  48           HN       GLN  48  74.999   5.303  14.934
  392    HA   GLN  48           HA       GLN  48  76.014   3.905  12.524
  393    HB2  GLN  48           HB2      GLN  48  73.150   3.765  13.506
  394    HB3  GLN  48           HB1      GLN  48  73.644   3.336  11.868
  395    HG2  GLN  48           HG2      GLN  48  75.250   1.678  12.843
  396    HG3  GLN  48           HG1      GLN  48  74.593   2.040  14.439
  397   HE21  GLN  48          HE21      GLN  48  74.315  -0.182  11.992
  398   HE22  GLN  48          HE22      GLN  48  72.706  -0.667  12.228
  399    H    GLY  49           HN       GLY  49  73.011   5.724  13.161
  400    HA2  GLY  49           HA2      GLY  49  72.336   7.840  12.381
  401    HA3  GLY  49           HA1      GLY  49  74.031   8.194  12.044
  402    H1U  RCY  50           H1U      RCY  50  77.155   6.704   2.199
  403    H1S  RCY  50           H1S      RCY  50  73.487   6.043   4.126
  404    HB1  RCY  50           HB1      RCY  50  73.675   5.591   8.564
  405    HB2  RCY  50           HB2      RCY  50  74.957   6.153   7.493
  406    HA   RCY  50           HA       RCY  50  74.263   8.356   7.590
  407    HN1  RCY  50           HN1      RCY  50  74.467   8.472   9.923
  408    H    GLY  51           HN       GLY  51  71.483   6.298   8.448
  409    HA2  GLY  51           HA2      GLY  51  69.746   7.615   6.585
  410    HA3  GLY  51           HA1      GLY  51  69.227   6.495   7.843
  411    H    ASP  52           HN       ASP  52  70.773   9.732   7.982
  412    HA   ASP  52           HA       ASP  52  68.835  10.485  10.083
  413    HB2  ASP  52           HB2      ASP  52  70.232  12.407  10.455
  414    HB3  ASP  52           HB1      ASP  52  71.311  11.030  10.234
  415    H    ASP  53           HN       ASP  53  68.226  10.144   7.105
  416    HA   ASP  53           HA       ASP  53  66.669  11.124   5.660
  417    HB2  ASP  53           HB2      ASP  53  65.078  12.340   6.702
  418    HB3  ASP  53           HB1      ASP  53  66.079  12.290   8.149
  419    H    ILE  54           HN       ILE  54  69.690  12.116   6.210
  420    HA   ILE  54           HA       ILE  54  69.712  14.689   4.872
  421    HB   ILE  54           HB       ILE  54  71.661  12.871   6.078
  422   HG12  ILE  54          HG12      ILE  54  71.974  15.788   5.331
  423   HG13  ILE  54          HG11      ILE  54  71.009  15.266   6.713
  424   HG21  ILE  54          HG21      ILE  54  73.565  13.592   4.609
  425   HG22  ILE  54          HG22      ILE  54  72.384  14.233   3.467
  426   HG23  ILE  54          HG23      ILE  54  72.434  12.503   3.804
  427   HD11  ILE  54          HD11      ILE  54  73.273  15.807   7.461
  428   HD12  ILE  54          HD12      ILE  54  73.956  14.702   6.268
  429   HD13  ILE  54          HD13      ILE  54  73.003  14.070   7.610
  430    HA   PRO  55           HA       PRO  55  69.276  13.153   0.728
  431    HB2  PRO  55           HB2      PRO  55  70.430  15.226  -0.655
  432    HB3  PRO  55           HB1      PRO  55  68.811  15.312   0.067
  433    HG2  PRO  55           HG2      PRO  55  71.391  16.386   1.091
  434    HG3  PRO  55           HG1      PRO  55  69.772  17.104   1.131
  435    HD2  PRO  55           HD2      PRO  55  70.901  15.890   3.306
  436    HD3  PRO  55           HD1      PRO  55  69.146  15.923   3.025
  437    H    GLY  56           HN       GLY  56  70.947  11.434   1.280
  438    HA2  GLY  56           HA2      GLY  56  72.938  11.222  -0.701
  439    HA3  GLY  56           HA1      GLY  56  73.737  11.847   0.743
  440    H    MET  57           HN       MET  57  71.098  10.015   1.671
  441    HA   MET  57           HA       MET  57  72.686   7.486   1.804
  442    HB2  MET  57           HB2      MET  57  71.094   8.619   4.121
  443    HB3  MET  57           HB1      MET  57  72.137   7.197   4.136
  444    HG2  MET  57           HG2      MET  57  73.066  10.037   3.616
  445    HG3  MET  57           HG1      MET  57  73.269   9.162   5.134
  446    HE1  MET  57           HE1      MET  57  76.875   8.845   4.282
  447    HE2  MET  57           HE2      MET  57  75.615   9.123   5.481
  448    HE3  MET  57           HE3      MET  57  75.841  10.274   4.167
  449    H    GLU  58           HN       GLU  58  69.517   9.063   2.089
  450    HA   GLU  58           HA       GLU  58  68.277   6.515   1.125
  451    HB2  GLU  58           HB2      GLU  58  67.905   7.192   3.638
  452    HB3  GLU  58           HB1      GLU  58  66.796   8.385   2.963
  453    HG2  GLU  58           HG2      GLU  58  65.438   6.484   3.368
  454    HG3  GLU  58           HG1      GLU  58  65.776   6.420   1.638
  455    H    GLY  59           HN       GLY  59  69.034   8.375  -0.694
  456    HA2  GLY  59           HA2      GLY  59  66.952   8.923  -2.340
  457    HA3  GLY  59           HA1      GLY  59  66.828  10.261  -1.196
  458    H1U  RCY  60           H1U      RCY  60  75.928   4.676  -3.249
  459    H1S  RCY  60           H1S      RCY  60  74.200   8.104  -5.396
  460    HB1  RCY  60           HB1      RCY  60  71.644   8.347  -3.934
  461    HB2  RCY  60           HB2      RCY  60  72.343   9.169  -2.540
  462    HA   RCY  60           HA       RCY  60  71.045  11.161  -2.979
  463    HN1  RCY  60           HN1      RCY  60  69.679   8.638  -2.583
  464    H    GLY  61           HN       GLY  61  71.297   9.042  -5.682
  465    HA2  GLY  61           HA2      GLY  61  69.661  10.934  -7.330
  466    HA3  GLY  61           HA1      GLY  61  71.227  10.335  -7.880
  467    H    THR  62           HN       THR  62  71.404   7.930  -8.132
  468    HA   THR  62           HA       THR  62  68.822   6.520  -8.484
  469    HB   THR  62           HB       THR  62  69.276   7.649 -10.656
  470    HG1  THR  62           HG1      THR  62  69.038   5.785 -11.863
  471   HG21  THR  62          HG21      THR  62  71.241   7.197 -11.917
  472   HG22  THR  62          HG22      THR  62  71.718   5.881 -10.844
  473   HG23  THR  62          HG23      THR  62  71.810   7.552 -10.286
  474    H    ASP  63           HN       ASP  63  72.152   6.555  -7.777
  475    HA   ASP  63           HA       ASP  63  72.752   3.774  -8.288
  476    HB2  ASP  63           HB2      ASP  63  74.433   5.662  -7.898
  477    HB3  ASP  63           HB1      ASP  63  74.046   5.522  -6.182
  478    H    ILE  64           HN       ILE  64  70.380   3.437  -7.254
  479    HA   ILE  64           HA       ILE  64  70.867   2.129  -4.673
  480    HB   ILE  64           HB       ILE  64  68.803   4.345  -4.953
  481   HG12  ILE  64          HG12      ILE  64  71.327   4.049  -3.300
  482   HG13  ILE  64          HG11      ILE  64  70.998   5.265  -4.535
  483   HG21  ILE  64          HG21      ILE  64  68.244   3.809  -2.609
  484   HG22  ILE  64          HG22      ILE  64  69.391   2.470  -2.641
  485   HG23  ILE  64          HG23      ILE  64  67.952   2.423  -3.659
  486   HD11  ILE  64          HD11      ILE  64  70.622   6.355  -2.444
  487   HD12  ILE  64          HD12      ILE  64  69.704   4.987  -1.816
  488   HD13  ILE  64          HD13      ILE  64  69.021   5.997  -3.090
  489    H    THR  65           HN       THR  65  69.000   2.748  -7.521
  490    HA   THR  65           HA       THR  65  67.548   0.177  -7.078
  491    HB   THR  65           HB       THR  65  66.331   2.752  -8.128
  492    HG1  THR  65           HG1      THR  65  65.571   2.947  -6.189
  493   HG21  THR  65          HG21      THR  65  64.229   1.349  -8.144
  494   HG22  THR  65          HG22      THR  65  65.251  -0.067  -7.897
  495   HG23  THR  65          HG23      THR  65  65.420   0.898  -9.364
  496    H    VAL  66           HN       VAL  66  68.478   2.703  -9.419
  497    HA   VAL  66           HA       VAL  66  68.151   0.880 -11.682
  498    HB   VAL  66           HB       VAL  66  69.668   3.494 -11.705
  499   HG11  VAL  66          HG11      VAL  66  68.850   3.565 -14.023
  500   HG12  VAL  66          HG12      VAL  66  67.970   2.057 -13.769
  501   HG13  VAL  66          HG13      VAL  66  69.733   2.067 -13.730
  502   HG21  VAL  66          HG21      VAL  66  66.670   3.041 -11.845
  503   HG22  VAL  66          HG22      VAL  66  67.472   4.565 -12.224
  504   HG23  VAL  66          HG23      VAL  66  67.535   3.920 -10.584
  505    H    ILE  67           HN       ILE  67  70.909   2.315  -9.918
  506    HA   ILE  67           HA       ILE  67  72.622   0.153 -11.091
  507    HB   ILE  67           HB       ILE  67  73.605   2.912 -10.339
  508   HG12  ILE  67          HG12      ILE  67  72.770   1.856 -13.060
  509   HG13  ILE  67          HG11      ILE  67  71.947   3.122 -12.149
  510   HG21  ILE  67          HG21      ILE  67  75.195   0.937 -10.476
  511   HG22  ILE  67          HG22      ILE  67  75.572   2.272 -11.565
  512   HG23  ILE  67          HG23      ILE  67  74.784   0.822 -12.187
  513   HD11  ILE  67          HD11      ILE  67  74.116   4.425 -12.182
  514   HD12  ILE  67          HD12      ILE  67  73.364   4.216 -13.763
  515   HD13  ILE  67          HD13      ILE  67  74.745   3.219 -13.305
  516    H1U  RCY  68           H1U      RCY  68  70.008  -0.283   0.312
  517    H1S  RCY  68           H1S      RCY  68  69.813  -1.693  -4.342
  518    HB1  RCY  68           HB1      RCY  68  72.363  -2.346  -5.883
  519    HB2  RCY  68           HB2      RCY  68  71.372  -2.051  -7.309
  520    HA   RCY  68           HA       RCY  68  73.508  -0.056  -6.700
  521    HN1  RCY  68           HN1      RCY  68  72.380  -1.164  -9.241
  522    HA   PRO  69           HA       PRO  69  77.191  -2.445  -6.550
  523    HB2  PRO  69           HB2      PRO  69  75.715  -4.224  -4.625
  524    HB3  PRO  69           HB1      PRO  69  77.380  -3.612  -4.534
  525    HG2  PRO  69           HG2      PRO  69  75.342  -2.479  -3.187
  526    HG3  PRO  69           HG1      PRO  69  76.720  -1.550  -3.797
  527    HD2  PRO  69           HD2      PRO  69  73.928  -1.469  -4.681
  528    HD3  PRO  69           HD1      PRO  69  75.259  -0.364  -5.087
  529    H    TRP  70           HN       TRP  70  74.173  -4.329  -6.856
  530    HA   TRP  70           HA       TRP  70  75.596  -6.581  -8.075
  531    HD1  TRP  70           HD1      TRP  70  72.023  -4.995  -9.604
  532    HE1  TRP  70           HE1      TRP  70  70.206  -3.560  -8.473
  533    HE3  TRP  70           HE3      TRP  70  72.609  -6.492  -4.758
  534    HZ2  TRP  70           HZ2      TRP  70  69.140  -3.106  -5.854
  535    HZ3  TRP  70           HZ3      TRP  70  71.185  -5.545  -2.969
  536    HH2  TRP  70           HH2      TRP  70  69.452  -3.856  -3.507
  537    HB2  TRP  70           HB2      TRP  70  73.207  -7.363  -8.593
  538    HB3  TRP  70           HB1      TRP  70  73.652  -7.233  -6.894
  539    H    GLU  71           HN       GLU  71  75.745  -3.855  -9.304
  540    HA   GLU  71           HA       GLU  71  75.073  -4.720 -12.067
  541    HB2  GLU  71           HB2      GLU  71  73.999  -2.295 -10.648
  542    HB3  GLU  71           HB1      GLU  71  74.339  -2.189 -12.373
  543    HG2  GLU  71           HG2      GLU  71  72.919  -4.649 -11.713
  544    HG3  GLU  71           HG1      GLU  71  72.011  -3.221 -11.214
  545    H    ALA  72           HN       ALA  72  76.210  -1.710 -10.494
  546    HA   ALA  72           HA       ALA  72  78.315  -1.403 -12.483
  547    HB1  ALA  72           HB1      ALA  72  77.303   0.592 -11.574
  548    HB2  ALA  72           HB2      ALA  72  78.982   0.548 -11.036
  549    HB3  ALA  72           HB3      ALA  72  77.688   0.095  -9.927
  550    H1U  RCY  73           H1U      RCY  73  81.903  -1.403  -0.648
  551    H1S  RCY  73           H1S      RCY  73  80.049  -2.917  -4.679
  552    HB1  RCY  73           HB1      RCY  73  79.399  -3.404  -6.773
  553    HB2  RCY  73           HB2      RCY  73  79.669  -1.671  -6.952
  554    HA   RCY  73           HA       RCY  73  81.248  -2.378  -8.914
  555    HN1  RCY  73           HN1      RCY  73  78.408  -1.869  -8.917
  556    H    ASN  74           HN       ASN  74  79.471  -4.060 -10.711
  557    HA   ASN  74           HA       ASN  74  79.144  -6.334 -11.262
  558    HB2  ASN  74           HB2      ASN  74  81.270  -7.549 -11.384
  559    HB3  ASN  74           HB1      ASN  74  81.496  -5.876 -11.896
  560   HD21  ASN  74          HD21      ASN  74  82.725  -4.451 -10.489
  561   HD22  ASN  74          HD22      ASN  74  83.621  -5.046  -9.176
  562    H    HIS  75           HN       HIS  75  77.909  -6.056  -8.902
  563    HA   HIS  75           HA       HIS  75  77.407  -7.071  -6.828
  564    HD1  HIS  75           HD1      HIS  75  77.498  -8.464 -10.672
  565    HD2  HIS  75           HD2      HIS  75  79.640 -10.996  -8.142
  566    HE1  HIS  75           HE1      HIS  75  79.102  -9.757 -12.145
  567    HE2  HIS  75           HE2      HIS  75  80.412 -11.302 -10.618
  568    HB2  HIS  75           HB2      HIS  75  77.417  -9.621  -7.076
  569    HB3  HIS  75           HB1      HIS  75  76.465  -8.725  -8.259
  570    H1U  RCY  76           H1U      RCY  76  80.205  -1.459  -1.819
  571    H1S  RCY  76           H1S      RCY  76  79.360  -5.828  -1.986
  572    HB1  RCY  76           HB1      RCY  76  81.385  -8.302  -3.136
  573    HB2  RCY  76           HB2      RCY  76  79.696  -8.702  -2.827
  574    HA   RCY  76           HA       RCY  76  81.297  -9.083  -5.350
  575    HN1  RCY  76           HN1      RCY  76  78.357  -9.299  -5.539
  576    H    GLU  77           HN       GLU  77  79.941 -11.290  -6.229
  577    HA   GLU  77           HA       GLU  77  78.976 -13.147  -4.360
  578    HB2  GLU  77           HB2      GLU  77  80.641 -13.581  -6.853
  579    HB3  GLU  77           HB1      GLU  77  79.906 -14.899  -5.941
  580    HG2  GLU  77           HG2      GLU  77  77.696 -14.081  -6.359
  581    HG3  GLU  77           HG1      GLU  77  78.310 -12.549  -6.982
  582    H    LEU  78           HN       LEU  78  82.041 -11.734  -4.433
  583    HA   LEU  78           HA       LEU  78  83.836 -13.734  -3.673
  584    HG   LEU  78           HG       LEU  78  85.514 -10.547  -4.155
  585    HB2  LEU  78           HB2      LEU  78  83.534 -10.864  -2.795
  586    HB3  LEU  78           HB1      LEU  78  84.814 -11.875  -2.129
  587   HD11  LEU  78          HD11      LEU  78  86.298 -12.987  -3.396
  588   HD12  LEU  78          HD12      LEU  78  86.908 -12.243  -4.874
  589   HD13  LEU  78          HD13      LEU  78  85.602 -13.425  -4.957
  590   HD21  LEU  78          HD21      LEU  78  83.241 -10.838  -5.273
  591   HD22  LEU  78          HD22      LEU  78  83.738 -12.485  -5.659
  592   HD23  LEU  78          HD23      LEU  78  84.636 -11.117  -6.315
  593    H    HIS  79           HN       HIS  79  84.664 -14.049  -1.315
  594    HA   HIS  79           HA       HIS  79  82.565 -13.911   0.743
  595    HD1  HIS  79           HD1      HIS  79  80.674 -14.852   1.561
  596    HD2  HIS  79           HD2      HIS  79  81.040 -17.080  -1.947
  597    HE1  HIS  79           HE1      HIS  79  78.329 -15.139   0.648
  598    HE2  HIS  79           HE2      HIS  79  78.538 -16.493  -1.488
  599    HB2  HIS  79           HB2      HIS  79  83.377 -16.452  -0.626
  600    HB3  HIS  79           HB1      HIS  79  83.044 -16.508   1.104
  601    H    GLU  80           HN       GLU  80  85.798 -14.081  -0.249
  602    HA   GLU  80           HA       GLU  80  87.000 -15.082   2.180
  603    HB2  GLU  80           HB2      GLU  80  88.178 -13.196   0.115
  604    HB3  GLU  80           HB1      GLU  80  89.081 -14.160   1.284
  605    HG2  GLU  80           HG2      GLU  80  87.971 -16.212   0.243
  606    HG3  GLU  80           HG1      GLU  80  87.441 -15.145  -1.058
  607    H    LEU  81           HN       LEU  81  87.068 -11.734   0.911
  608    HA   LEU  81           HA       LEU  81  87.578 -10.657   3.558
  609    HG   LEU  81           HG       LEU  81  86.068 -10.226   0.403
  610    HB2  LEU  81           HB2      LEU  81  87.285  -8.450   2.426
  611    HB3  LEU  81           HB1      LEU  81  88.433  -9.497   1.594
  612   HD11  LEU  81          HD11      LEU  81  85.007  -8.293   1.698
  613   HD12  LEU  81          HD12      LEU  81  84.757  -8.280  -0.048
  614   HD13  LEU  81          HD13      LEU  81  85.961  -7.215   0.678
  615   HD21  LEU  81          HD21      LEU  81  88.184  -9.723  -0.743
  616   HD22  LEU  81          HD22      LEU  81  87.970  -8.004  -0.411
  617   HD23  LEU  81          HD23      LEU  81  86.860  -8.836  -1.500
  618    H    ALA  82           HN       ALA  82  84.736 -10.974   1.468
  619    HA   ALA  82           HA       ALA  82  82.975  -9.402   3.121
  620    HB1  ALA  82           HB1      ALA  82  81.186 -10.822   1.886
  621    HB2  ALA  82           HB2      ALA  82  82.548 -11.496   0.991
  622    HB3  ALA  82           HB3      ALA  82  82.212  -9.767   0.915
  623    H    GLN  83           HN       GLN  83  84.042 -10.585   5.129
  624    HA   GLN  83           HA       GLN  83  82.010 -12.470   6.107
  625    HB2  GLN  83           HB2      GLN  83  83.931 -13.774   4.912
  626    HB3  GLN  83           HB1      GLN  83  84.892 -13.333   6.323
  627    HG2  GLN  83           HG2      GLN  83  83.975 -15.419   6.926
  628    HG3  GLN  83           HG1      GLN  83  82.895 -14.262   7.704
  629   HE21  GLN  83          HE21      GLN  83  81.863 -13.599   4.828
  630   HE22  GLN  83          HE22      GLN  83  80.759 -14.850   4.517
  631    H    TYR  84           HN       TYR  84  83.174  -9.744   6.689
  632    HA   TYR  84           HA       TYR  84  84.236 -10.196   9.441
  633    HD1  TYR  84           HD2      TYR  84  86.159  -8.630  10.652
  634    HD2  TYR  84           HD1      TYR  84  86.241  -8.898   6.365
  635    HE1  TYR  84           HE2      TYR  84  88.548  -9.293  10.739
  636    HE2  TYR  84           HE1      TYR  84  88.629  -9.561   6.452
  637    HH   TYR  84           HH       TYR  84  90.152 -10.577   9.257
  638    HB2  TYR  84           HB2      TYR  84  84.356  -7.951   7.463
  639    HB3  TYR  84           HB1      TYR  84  84.409  -7.540   9.175
  640    H    GLY  85           HN       GLY  85  81.712  -8.404   7.685
  641    HA2  GLY  85           HA2      GLY  85  79.789  -8.796   9.806
  642    HA3  GLY  85           HA1      GLY  85  80.408  -7.142   9.804
  643    H    ILE  86           HN       ILE  86  80.733  -6.700   7.073
  644    HA   ILE  86           HA       ILE  86  78.124  -5.967   6.260
  645    HB   ILE  86           HB       ILE  86  79.407  -6.137   3.850
  646   HG12  ILE  86          HG12      ILE  86  81.808  -5.591   4.303
  647   HG13  ILE  86          HG11      ILE  86  81.538  -5.967   6.005
  648   HG21  ILE  86          HG21      ILE  86  78.494  -4.101   4.941
  649   HG22  ILE  86          HG22      ILE  86  80.084  -3.810   4.237
  650   HG23  ILE  86          HG23      ILE  86  79.919  -4.035   5.978
  651   HD11  ILE  86          HD11      ILE  86  82.489  -7.911   4.828
  652   HD12  ILE  86          HD12      ILE  86  81.143  -7.886   3.689
  653   HD13  ILE  86          HD13      ILE  86  80.854  -8.260   5.388
  654    H1U  RCY  87           H1U      RCY  87  78.039  -4.304  -2.046
  655    H1S  RCY  87           H1S      RCY  87  76.497  -6.725   1.387
  656    HB1  RCY  87           HB1      RCY  87  78.681 -10.588   1.749
  657    HB2  RCY  87           HB2      RCY  87  79.391  -8.979   1.869
  658    HA   RCY  87           HA       RCY  87  77.111  -9.542   3.692
  659    HN1  RCY  87           HN1      RCY  87  79.442  -7.789   3.679
  Start of MODEL   55
    1    HA   MET   1           HA       MET   1  60.388  12.051  14.881
    2    HB2  MET   1           HB2      MET   1  60.189  11.415  17.842
    3    HB3  MET   1           HB1      MET   1  59.826  10.299  16.525
    4    HG2  MET   1           HG2      MET   1  62.135  10.421  15.736
    5    HG3  MET   1           HG1      MET   1  62.518  11.621  16.970
    6    HE1  MET   1           HE1      MET   1  64.463  10.118  17.255
    7    HE2  MET   1           HE2      MET   1  64.032   8.561  16.552
    8    HE3  MET   1           HE3      MET   1  64.505   8.655  18.247
    9    H    ASN   2           HN       ASN   2  58.637  13.340  14.109
   10    HA   ASN   2           HA       ASN   2  56.466  14.129  15.886
   11    HB2  ASN   2           HB2      ASN   2  55.303  14.640  13.670
   12    HB3  ASN   2           HB1      ASN   2  56.811  15.507  13.960
   13   HD21  ASN   2          HD21      ASN   2  55.254  14.041  11.496
   14   HD22  ASN   2          HD22      ASN   2  56.568  13.402  10.631
   15    H    LEU   3           HN       LEU   3  55.212  12.811  13.026
   16    HA   LEU   3           HA       LEU   3  54.749  10.115  14.080
   17    HG   LEU   3           HG       LEU   3  52.929   9.354  15.337
   18    HB2  LEU   3           HB2      LEU   3  53.072  11.824  15.174
   19    HB3  LEU   3           HB1      LEU   3  52.271  11.756  13.605
   20   HD11  LEU   3          HD11      LEU   3  50.586   9.246  15.832
   21   HD12  LEU   3          HD12      LEU   3  50.214  10.507  14.657
   22   HD13  LEU   3          HD13      LEU   3  51.079  10.910  16.140
   23   HD21  LEU   3          HD21      LEU   3  51.687   9.714  12.614
   24   HD22  LEU   3          HD22      LEU   3  51.267   8.321  13.611
   25   HD23  LEU   3          HD23      LEU   3  52.940   8.577  13.114
   26    H    GLU   4           HN       GLU   4  55.348   9.163  12.157
   27    HA   GLU   4           HA       GLU   4  54.317  10.239   9.605
   28    HB2  GLU   4           HB2      GLU   4  56.404   8.262  10.425
   29    HB3  GLU   4           HB1      GLU   4  55.666   8.043   8.839
   30    HG2  GLU   4           HG2      GLU   4  57.704   9.477   8.747
   31    HG3  GLU   4           HG1      GLU   4  56.257  10.330   8.209
   32    HA   PRO   5           HA       PRO   5  50.788   7.692   8.913
   33    HB2  PRO   5           HB2      PRO   5  52.387   6.410   6.715
   34    HB3  PRO   5           HB1      PRO   5  50.725   7.029   6.678
   35    HG2  PRO   5           HG2      PRO   5  52.789   8.403   5.659
   36    HG3  PRO   5           HG1      PRO   5  51.392   9.196   6.403
   37    HD2  PRO   5           HD2      PRO   5  54.163   9.011   7.396
   38    HD3  PRO   5           HD1      PRO   5  52.866  10.124   7.882
   39    HA   PRO   6           HA       PRO   6  51.614   3.856  10.985
   40    HB2  PRO   6           HB2      PRO   6  49.527   2.301  10.080
   41    HB3  PRO   6           HB1      PRO   6  49.355   3.568  11.309
   42    HG2  PRO   6           HG2      PRO   6  48.711   3.653   8.407
   43    HG3  PRO   6           HG1      PRO   6  47.846   4.364   9.780
   44    HD2  PRO   6           HD2      PRO   6  49.452   5.836   8.129
   45    HD3  PRO   6           HD1      PRO   6  49.208   6.239   9.843
   46    H    LYS   7           HN       LYS   7  52.092   1.506  10.579
   47    HA   LYS   7           HA       LYS   7  52.673   0.845   7.736
   48    HB2  LYS   7           HB2      LYS   7  54.949  -0.047   8.601
   49    HB3  LYS   7           HB1      LYS   7  54.790   1.693   8.360
   50    HG2  LYS   7           HG2      LYS   7  54.624   2.130  10.658
   51    HG3  LYS   7           HG1      LYS   7  54.133   0.477  11.033
   52    HD2  LYS   7           HD2      LYS   7  56.400  -0.319  10.405
   53    HD3  LYS   7           HD1      LYS   7  56.885   1.351  10.106
   54    HE2  LYS   7           HE2      LYS   7  56.748   1.932  12.376
   55    HE3  LYS   7           HE1      LYS   7  55.699   0.567  12.759
   56    HZ1  LYS   7           HZ1      LYS   7  57.633  -0.287  13.503
   57    HZ2  LYS   7           HZ2      LYS   7  58.594   0.666  12.475
   58    HZ3  LYS   7           HZ3      LYS   7  57.826  -0.725  11.875
   59    H    ALA   8           HN       ALA   8  50.892  -0.668   8.065
   60    HA   ALA   8           HA       ALA   8  51.826  -3.198   9.273
   61    HB1  ALA   8           HB1      ALA   8  49.319  -1.747  10.159
   62    HB2  ALA   8           HB2      ALA   8  50.684  -2.235  11.164
   63    HB3  ALA   8           HB3      ALA   8  49.612  -3.456  10.477
   64    H    GLU   9           HN       GLU   9  51.723  -3.067   6.675
   65    HA   GLU   9           HA       GLU   9  49.689  -4.901   5.866
   66    HB2  GLU   9           HB2      GLU   9  48.544  -3.275   4.229
   67    HB3  GLU   9           HB1      GLU   9  48.086  -3.148   5.927
   68    HG2  GLU   9           HG2      GLU   9  49.618  -1.276   6.243
   69    HG3  GLU   9           HG1      GLU   9  50.200  -1.438   4.586
   70    H1U  RCY  10           H1U      RCY  10  58.378  -0.408   8.122
   71    H1S  RCY  10           H1S      RCY  10  56.846  -4.805   6.809
   72    HB1  RCY  10           HB1      RCY  10  54.720  -2.667   4.449
   73    HB2  RCY  10           HB2      RCY  10  55.402  -3.790   3.272
   74    HA   RCY  10           HA       RCY  10  53.031  -3.254   2.767
   75    HN1  RCY  10           HN1      RCY  10  52.600  -3.656   5.557
   76    H    ARG  11           HN       ARG  11  54.982  -5.135   2.034
   77    HA   ARG  11           HA       ARG  11  55.158  -7.237   1.011
   78    HE   ARG  11           HE       ARG  11  56.125 -11.663   2.203
   79    HB2  ARG  11           HB2      ARG  11  54.883  -7.854   3.519
   80    HB3  ARG  11           HB1      ARG  11  53.228  -8.280   3.084
   81    HG2  ARG  11           HG2      ARG  11  54.141  -9.773   1.289
   82    HG3  ARG  11           HG1      ARG  11  55.765  -9.429   1.887
   83    HD2  ARG  11           HD2      ARG  11  54.837 -10.190   4.193
   84    HD3  ARG  11           HD1      ARG  11  53.534 -10.921   3.256
   85   HH11  ARG  11          HH21      ARG  11  53.814 -12.211   4.702
   86   HH12  ARG  11          HH22      ARG  11  54.304 -13.849   4.979
   87   HH21  ARG  11          HH11      ARG  11  56.778 -13.798   2.550
   88   HH22  ARG  11          HH12      ARG  11  55.983 -14.748   3.760
   89    H    SER  12           HN       SER  12  54.149  -7.328  -0.944
   90    HA   SER  12           HA       SER  12  51.459  -8.361  -1.164
   91    HG   SER  12           HG       SER  12  50.895  -6.370  -3.457
   92    HB2  SER  12           HB2      SER  12  50.698  -6.162  -0.641
   93    HB3  SER  12           HB1      SER  12  51.933  -5.414  -1.648
   94    H    ALA  13           HN       ALA  13  53.916  -6.390  -2.858
   95    HA   ALA  13           HA       ALA  13  53.274  -7.494  -5.456
   96    HB1  ALA  13           HB1      ALA  13  54.355  -5.368  -5.445
   97    HB2  ALA  13           HB2      ALA  13  55.560  -6.502  -6.054
   98    HB3  ALA  13           HB3      ALA  13  55.639  -5.945  -4.382
   99    H    THR  14           HN       THR  14  54.424  -9.064  -2.864
  100    HA   THR  14           HA       THR  14  55.562 -11.089  -2.599
  101    HB   THR  14           HB       THR  14  54.447 -11.149  -5.226
  102    HG1  THR  14           HG1      THR  14  54.254 -12.586  -3.325
  103   HG21  THR  14          HG21      THR  14  56.768 -10.971  -6.057
  104   HG22  THR  14          HG22      THR  14  56.085 -12.561  -6.400
  105   HG23  THR  14          HG23      THR  14  57.223 -12.359  -5.068
  106    H    ARG  15           HN       ARG  15  57.721 -11.557  -2.270
  107    HA   ARG  15           HA       ARG  15  59.679  -9.581  -2.801
  108    HE   ARG  15           HE       ARG  15  61.622  -9.755   1.378
  109    HB2  ARG  15           HB2      ARG  15  59.643 -11.696  -1.170
  110    HB3  ARG  15           HB1      ARG  15  60.531 -12.439  -2.497
  111    HG2  ARG  15           HG2      ARG  15  62.156 -11.462  -1.005
  112    HG3  ARG  15           HG1      ARG  15  62.094 -10.451  -2.449
  113    HD2  ARG  15           HD2      ARG  15  61.340  -8.667  -1.285
  114    HD3  ARG  15           HD1      ARG  15  60.134  -9.636  -0.440
  115   HH11  ARG  15          HH21      ARG  15  63.256  -9.028  -1.570
  116   HH12  ARG  15          HH22      ARG  15  64.799  -8.805  -0.815
  117   HH21  ARG  15          HH11      ARG  15  63.627  -9.468   2.381
  118   HH22  ARG  15          HH12      ARG  15  65.009  -9.054   1.422
  119    H    VAL  16           HN       VAL  16  60.419  -9.009  -4.786
  120    HA   VAL  16           HA       VAL  16  60.455 -11.034  -6.961
  121    HB   VAL  16           HB       VAL  16  60.901  -8.034  -7.021
  122   HG11  VAL  16          HG11      VAL  16  60.755 -10.139  -9.193
  123   HG12  VAL  16          HG12      VAL  16  62.076  -9.016  -8.868
  124   HG13  VAL  16          HG13      VAL  16  60.548  -8.417  -9.513
  125   HG21  VAL  16          HG21      VAL  16  58.532  -9.800  -7.698
  126   HG22  VAL  16          HG22      VAL  16  58.658  -8.116  -8.208
  127   HG23  VAL  16          HG23      VAL  16  58.600  -8.516  -6.491
  128    H    MET  17           HN       MET  17  62.343 -11.992  -7.537
  129    HA   MET  17           HA       MET  17  64.893 -10.534  -7.192
  130    HB2  MET  17           HB2      MET  17  65.762 -12.844  -6.174
  131    HB3  MET  17           HB1      MET  17  65.081 -11.591  -5.139
  132    HG2  MET  17           HG2      MET  17  64.112 -13.846  -4.678
  133    HG3  MET  17           HG1      MET  17  62.896 -12.676  -5.189
  134    HE1  MET  17           HE1      MET  17  63.311 -16.308  -5.554
  135    HE2  MET  17           HE2      MET  17  61.847 -16.183  -6.527
  136    HE3  MET  17           HE3      MET  17  62.018 -15.202  -5.073
  137    H    GLY  18           HN       GLY  18  64.093 -10.825  -9.616
  138    HA2  GLY  18           HA2      GLY  18  65.047 -13.442 -10.682
  139    HA3  GLY  18           HA1      GLY  18  64.046 -12.293 -11.571
  140    H    GLY  19           HN       GLY  19  66.345 -13.244 -12.772
  141    HA2  GLY  19           HA2      GLY  19  68.633 -11.536 -12.304
  142    HA3  GLY  19           HA1      GLY  19  68.390 -12.565 -13.717
  143    HA   PRO  20           HA       PRO  20  67.013  -9.437 -16.495
  144    HB2  PRO  20           HB2      PRO  20  64.126 -10.028 -15.942
  145    HB3  PRO  20           HB1      PRO  20  64.970  -9.891 -17.498
  146    HG2  PRO  20           HG2      PRO  20  64.316 -12.260 -16.473
  147    HG3  PRO  20           HG1      PRO  20  65.822 -12.022 -17.373
  148    HD2  PRO  20           HD2      PRO  20  65.425 -12.404 -14.446
  149    HD3  PRO  20           HD1      PRO  20  66.833 -12.801 -15.457
  150    H1U  RCY  21           H1U      RCY  21  64.359  -6.095  -6.979
  151    H1S  RCY  21           H1S      RCY  21  67.275  -7.009  -9.649
  152    HB1  RCY  21           HB1      RCY  21  67.180  -5.043 -12.634
  153    HB2  RCY  21           HB2      RCY  21  68.316  -6.153 -13.400
  154    HA   RCY  21           HA       RCY  21  65.334  -6.173 -13.943
  155    HN1  RCY  21           HN1      RCY  21  67.498  -7.459 -15.556
  156    H    THR  22           HN       THR  22  64.997  -3.989 -14.432
  157    HA   THR  22           HA       THR  22  65.721  -3.035 -16.992
  158    HB   THR  22           HB       THR  22  65.112  -1.233 -14.644
  159    HG1  THR  22           HG1      THR  22  63.644  -2.983 -14.700
  160   HG21  THR  22          HG21      THR  22  65.712  -0.294 -16.923
  161   HG22  THR  22          HG22      THR  22  64.130   0.189 -16.310
  162   HG23  THR  22          HG23      THR  22  64.253  -1.069 -17.541
  163    HA   PRO  23           HA       PRO  23  70.137  -2.337 -16.223
  164    HB2  PRO  23           HB2      PRO  23  69.629  -0.486 -18.532
  165    HB3  PRO  23           HB1      PRO  23  70.957  -1.638 -18.284
  166    HG2  PRO  23           HG2      PRO  23  68.918  -2.190 -19.909
  167    HG3  PRO  23           HG1      PRO  23  69.682  -3.445 -18.919
  168    HD2  PRO  23           HD2      PRO  23  67.011  -2.178 -18.602
  169    HD3  PRO  23           HD1      PRO  23  67.575  -3.774 -18.061
  170    H    ARG  24           HN       ARG  24  70.347  -1.096 -14.365
  171    HA   ARG  24           HA       ARG  24  69.092   1.371 -13.816
  172    HE   ARG  24           HE       ARG  24  67.260  -0.899 -12.782
  173    HB2  ARG  24           HB2      ARG  24  71.514  -0.047 -12.790
  174    HB3  ARG  24           HB1      ARG  24  71.368   1.665 -12.399
  175    HG2  ARG  24           HG2      ARG  24  70.292   0.443 -10.623
  176    HG3  ARG  24           HG1      ARG  24  69.015   1.180 -11.591
  177    HD2  ARG  24           HD2      ARG  24  69.579  -1.321 -12.791
  178    HD3  ARG  24           HD1      ARG  24  69.481  -1.613 -11.054
  179   HH11  ARG  24          HH21      ARG  24  68.635  -0.640  -9.631
  180   HH12  ARG  24          HH22      ARG  24  67.109  -0.430  -8.837
  181   HH21  ARG  24          HH11      ARG  24  65.260  -0.627 -11.764
  182   HH22  ARG  24          HH12      ARG  24  65.199  -0.423 -10.045
  183    H    LYS  25           HN       LYS  25  69.268   3.247 -14.918
  184    HA   LYS  25           HA       LYS  25  71.936   3.992 -16.049
  185    HB2  LYS  25           HB2      LYS  25  69.857   3.257 -17.628
  186    HB3  LYS  25           HB1      LYS  25  69.488   4.970 -17.442
  187    HG2  LYS  25           HG2      LYS  25  70.904   4.994 -19.301
  188    HG3  LYS  25           HG1      LYS  25  72.040   5.296 -17.985
  189    HD2  LYS  25           HD2      LYS  25  73.145   3.573 -19.062
  190    HD3  LYS  25           HD1      LYS  25  72.152   2.636 -17.945
  191    HE2  LYS  25           HE2      LYS  25  70.391   2.526 -19.768
  192    HE3  LYS  25           HE1      LYS  25  71.592   3.211 -20.864
  193    HZ1  LYS  25           HZ1      LYS  25  71.980   0.730 -19.281
  194    HZ2  LYS  25           HZ2      LYS  25  73.036   1.364 -20.452
  195    HZ3  LYS  25           HZ3      LYS  25  71.514   0.765 -20.912
  196    H    GLY  26           HN       GLY  26  72.616   5.908 -15.211
  197    HA2  GLY  26           HA2      GLY  26  70.759   8.124 -14.812
  198    HA3  GLY  26           HA1      GLY  26  71.353   7.442 -13.297
  199    HA   PRO  27           HA       PRO  27  74.217  10.750 -15.517
  200    HB2  PRO  27           HB2      PRO  27  73.733  11.887 -12.786
  201    HB3  PRO  27           HB1      PRO  27  73.962  12.729 -14.331
  202    HG2  PRO  27           HG2      PRO  27  71.544  12.419 -13.236
  203    HG3  PRO  27           HG1      PRO  27  71.793  12.398 -14.989
  204    HD2  PRO  27           HD2      PRO  27  71.116  10.155 -13.173
  205    HD3  PRO  27           HD1      PRO  27  70.857  10.306 -14.924
  206    HA   PRO  28           HA       PRO  28  77.456   8.215 -13.588
  207    HB2  PRO  28           HB2      PRO  28  79.076  10.549 -14.555
  208    HB3  PRO  28           HB1      PRO  28  79.395   8.811 -14.725
  209    HG2  PRO  28           HG2      PRO  28  78.445  10.266 -16.750
  210    HG3  PRO  28           HG1      PRO  28  77.947   8.585 -16.495
  211    HD2  PRO  28           HD2      PRO  28  76.395  11.084 -16.068
  212    HD3  PRO  28           HD1      PRO  28  75.814   9.439 -16.403
  213    H    LYS  29           HN       LYS  29  78.226   8.265 -11.490
  214    HA   LYS  29           HA       LYS  29  78.622  10.921 -10.185
  215    HB2  LYS  29           HB2      LYS  29  76.335   9.681  -9.709
  216    HB3  LYS  29           HB1      LYS  29  77.328   8.686  -8.645
  217    HG2  LYS  29           HG2      LYS  29  77.111  11.712  -8.549
  218    HG3  LYS  29           HG1      LYS  29  76.383  10.587  -7.400
  219    HD2  LYS  29           HD2      LYS  29  78.789   9.698  -7.053
  220    HD3  LYS  29           HD1      LYS  29  79.306  11.190  -7.838
  221    HE2  LYS  29           HE2      LYS  29  77.827  12.419  -6.148
  222    HE3  LYS  29           HE1      LYS  29  77.731  10.889  -5.276
  223    HZ1  LYS  29           HZ1      LYS  29  80.398  11.687  -6.062
  224    HZ2  LYS  29           HZ2      LYS  29  79.841  11.049  -4.589
  225    HZ3  LYS  29           HZ3      LYS  29  79.663  12.705  -4.922
  226    H1U  RCY  30           H1U      RCY  30  84.919  11.878 -11.114
  227    H1S  RCY  30           H1S      RCY  30  84.849  10.150  -7.458
  228    HB1  RCY  30           HB1      RCY  30  81.200   8.078  -7.306
  229    HB2  RCY  30           HB2      RCY  30  81.259   9.780  -6.848
  230    HA   RCY  30           HA       RCY  30  82.817  10.106  -8.859
  231    HN1  RCY  30           HN1      RCY  30  80.772  10.858  -9.724
  232    H    LYS  31           HN       LYS  31  80.797   8.179 -10.709
  233    HA   LYS  31           HA       LYS  31  81.122   6.171 -11.893
  234    HB2  LYS  31           HB2      LYS  31  82.989   7.888 -12.648
  235    HB3  LYS  31           HB1      LYS  31  84.069   6.762 -11.830
  236    HG2  LYS  31           HG2      LYS  31  84.050   5.838 -13.960
  237    HG3  LYS  31           HG1      LYS  31  82.710   4.958 -13.224
  238    HD2  LYS  31           HD2      LYS  31  81.143   6.688 -14.128
  239    HD3  LYS  31           HD1      LYS  31  82.506   7.433 -14.965
  240    HE2  LYS  31           HE2      LYS  31  82.923   5.177 -16.057
  241    HE3  LYS  31           HE1      LYS  31  81.373   4.658 -15.395
  242    HZ1  LYS  31           HZ1      LYS  31  80.400   6.662 -16.513
  243    HZ2  LYS  31           HZ2      LYS  31  80.957   5.446 -17.561
  244    HZ3  LYS  31           HZ3      LYS  31  81.880   6.852 -17.321
  245    H    GLN  32           HN       GLN  32  83.719   4.677 -11.773
  246    HA   GLN  32           HA       GLN  32  83.649   3.649  -8.973
  247    HB2  GLN  32           HB2      GLN  32  83.007   2.160 -11.497
  248    HB3  GLN  32           HB1      GLN  32  83.883   1.305 -10.228
  249    HG2  GLN  32           HG2      GLN  32  81.491   0.968  -9.902
  250    HG3  GLN  32           HG1      GLN  32  82.108   1.990  -8.604
  251   HE21  GLN  32          HE21      GLN  32  80.350   3.378  -8.183
  252   HE22  GLN  32          HE22      GLN  32  79.591   4.336  -9.361
  253    H    ARG  33           HN       ARG  33  85.692   3.250  -8.221
  254    HA   ARG  33           HA       ARG  33  87.856   2.317  -9.861
  255    HE   ARG  33           HE       ARG  33  87.330   7.997  -7.983
  256    HB2  ARG  33           HB2      ARG  33  89.242   4.435  -9.710
  257    HB3  ARG  33           HB1      ARG  33  87.887   4.518 -10.836
  258    HG2  ARG  33           HG2      ARG  33  86.520   5.560  -8.989
  259    HG3  ARG  33           HG1      ARG  33  87.993   5.641  -8.023
  260    HD2  ARG  33           HD2      ARG  33  89.068   6.979  -9.828
  261    HD3  ARG  33           HD1      ARG  33  87.545   6.959 -10.717
  262   HH11  ARG  33          HH21      ARG  33  87.905   8.609 -11.326
  263   HH12  ARG  33          HH22      ARG  33  87.449  10.277 -11.236
  264   HH21  ARG  33          HH11      ARG  33  86.731  10.172  -7.845
  265   HH22  ARG  33          HH12      ARG  33  86.784  11.163  -9.265
  266    H    GLN  34           HN       GLN  34  87.127   1.254  -7.555
  267    HA   GLN  34           HA       GLN  34  87.953   2.278  -5.099
  268    HB2  GLN  34           HB2      GLN  34  86.879   0.065  -5.369
  269    HB3  GLN  34           HB1      GLN  34  88.364  -0.563  -6.086
  270    HG2  GLN  34           HG2      GLN  34  89.585  -0.247  -4.043
  271    HG3  GLN  34           HG1      GLN  34  88.264   0.676  -3.326
  272   HE21  GLN  34          HE21      GLN  34  89.345  -2.587  -4.165
  273   HE22  GLN  34          HE22      GLN  34  88.116  -3.402  -3.324
  274    H    THR  35           HN       THR  35  89.861   3.272  -4.659
  275    HA   THR  35           HA       THR  35  92.259   2.864  -6.192
  276    HB   THR  35           HB       THR  35  92.126   4.001  -3.392
  277    HG1  THR  35           HG1      THR  35  90.855   5.436  -4.214
  278   HG21  THR  35          HG21      THR  35  93.968   5.426  -4.292
  279   HG22  THR  35          HG22      THR  35  93.902   4.506  -5.795
  280   HG23  THR  35          HG23      THR  35  94.370   3.708  -4.294
  281    H    ARG  36           HN       ARG  36  91.442   1.900  -2.834
  282    HA   ARG  36           HA       ARG  36  92.738  -0.661  -3.115
  283    HE   ARG  36           HE       ARG  36  95.808   0.787   0.746
  284    HB2  ARG  36           HB2      ARG  36  94.685   1.036  -2.989
  285    HB3  ARG  36           HB1      ARG  36  94.219   1.249  -1.301
  286    HG2  ARG  36           HG2      ARG  36  94.335  -1.321  -1.130
  287    HG3  ARG  36           HG1      ARG  36  95.200  -1.260  -2.666
  288    HD2  ARG  36           HD2      ARG  36  96.957  -1.158  -1.128
  289    HD3  ARG  36           HD1      ARG  36  96.667   0.550  -1.456
  290   HH11  ARG  36          HH21      ARG  36  96.262  -2.502  -0.184
  291   HH12  ARG  36          HH22      ARG  36  96.004  -3.127   1.410
  292   HH21  ARG  36          HH11      ARG  36  95.468  -0.011   2.834
  293   HH22  ARG  36          HH12      ARG  36  95.555  -1.717   3.119
  294    H    GLN  37           HN       GLN  37  90.445  -0.819  -2.231
  295    HA   GLN  37           HA       GLN  37  88.950  -1.101  -0.437
  296    HB2  GLN  37           HB2      GLN  37  91.603  -1.827   0.840
  297    HB3  GLN  37           HB1      GLN  37  90.034  -2.146   1.580
  298    HG2  GLN  37           HG2      GLN  37  90.632  -3.091  -1.218
  299    HG3  GLN  37           HG1      GLN  37  91.134  -4.042   0.180
  300   HE21  GLN  37          HE21      GLN  37  89.600  -5.566   0.785
  301   HE22  GLN  37          HE22      GLN  37  87.923  -5.405   0.575
  302    H1U  RCY  38           H1U      RCY  38  83.405   2.272  -0.084
  303    H1S  RCY  38           H1S      RCY  38  86.733   2.593   2.312
  304    HB1  RCY  38           HB1      RCY  38  88.790   2.256   4.043
  305    HB2  RCY  38           HB2      RCY  38  88.285   1.241   2.692
  306    HA   RCY  38           HA       RCY  38  91.051   2.237   2.469
  307    HN1  RCY  38           HN1      RCY  38  90.789  -0.568   2.266
  308    H    LYS  39           HN       LYS  39  89.635  -0.450   4.365
  309    HA   LYS  39           HA       LYS  39  90.230  -1.301   6.464
  310    HB2  LYS  39           HB2      LYS  39  92.910   0.038   6.034
  311    HB3  LYS  39           HB1      LYS  39  92.556  -1.397   6.995
  312    HG2  LYS  39           HG2      LYS  39  91.729  -2.443   4.782
  313    HG3  LYS  39           HG1      LYS  39  92.579  -1.115   3.991
  314    HD2  LYS  39           HD2      LYS  39  94.666  -1.767   5.147
  315    HD3  LYS  39           HD1      LYS  39  93.816  -3.110   5.913
  316    HE2  LYS  39           HE2      LYS  39  93.386  -4.146   3.770
  317    HE3  LYS  39           HE1      LYS  39  94.020  -2.741   2.912
  318    HZ1  LYS  39           HZ1      LYS  39  95.744  -4.311   2.940
  319    HZ2  LYS  39           HZ2      LYS  39  95.505  -4.683   4.581
  320    HZ3  LYS  39           HZ3      LYS  39  96.161  -3.180   4.135
  321    H    SER  40           HN       SER  40  90.147  -0.610   8.610
  322    HA   SER  40           HA       SER  40  90.955   2.015   9.484
  323    HG   SER  40           HG       SER  40  88.333   3.242   7.542
  324    HB2  SER  40           HB2      SER  40  88.037   1.560   8.830
  325    HB3  SER  40           HB1      SER  40  88.564   2.790   9.975
  326    H    LYS  41           HN       LYS  41  89.176  -0.948   9.924
  327    HA   LYS  41           HA       LYS  41  89.746  -0.803  12.846
  328    HB2  LYS  41           HB2      LYS  41  87.509  -1.829  13.285
  329    HB3  LYS  41           HB1      LYS  41  87.386  -0.211  12.596
  330    HG2  LYS  41           HG2      LYS  41  87.503  -1.875  10.362
  331    HG3  LYS  41           HG1      LYS  41  86.481  -2.760  11.495
  332    HD2  LYS  41           HD2      LYS  41  85.136  -0.669  11.827
  333    HD3  LYS  41           HD1      LYS  41  86.091   0.095  10.556
  334    HE2  LYS  41           HE2      LYS  41  85.411  -1.935   9.101
  335    HE3  LYS  41           HE1      LYS  41  84.174  -2.222  10.324
  336    HZ1  LYS  41           HZ1      LYS  41  83.620  -0.739   8.315
  337    HZ2  LYS  41           HZ2      LYS  41  84.503   0.455   9.140
  338    HZ3  LYS  41           HZ3      LYS  41  83.127  -0.236   9.859
  339    HA   PRO  42           HA       PRO  42  91.370  -4.852  12.117
  340    HB2  PRO  42           HB2      PRO  42  90.847  -6.043  14.566
  341    HB3  PRO  42           HB1      PRO  42  92.201  -4.940  14.255
  342    HG2  PRO  42           HG2      PRO  42  89.580  -4.395  15.542
  343    HG3  PRO  42           HG1      PRO  42  91.187  -3.758  15.932
  344    HD2  PRO  42           HD2      PRO  42  89.330  -2.298  14.570
  345    HD3  PRO  42           HD1      PRO  42  91.078  -2.107  14.302
  346    HA   PRO  43           HA       PRO  43  88.015  -7.485  10.940
  347    HB2  PRO  43           HB2      PRO  43  89.174  -9.971  11.103
  348    HB3  PRO  43           HB1      PRO  43  89.525  -8.810   9.809
  349    HG2  PRO  43           HG2      PRO  43  91.101  -9.446  12.251
  350    HG3  PRO  43           HG1      PRO  43  91.656  -9.108  10.603
  351    HD2  PRO  43           HD2      PRO  43  91.748  -7.247  12.608
  352    HD3  PRO  43           HD1      PRO  43  91.555  -6.812  10.895
  353    H    LYS  44           HN       LYS  44  86.257  -7.961  12.168
  354    HA   LYS  44           HA       LYS  44  86.223 -10.014  14.165
  355    HB2  LYS  44           HB2      LYS  44  87.455  -8.069  15.351
  356    HB3  LYS  44           HB1      LYS  44  85.895  -7.250  15.346
  357    HG2  LYS  44           HG2      LYS  44  85.747  -8.348  17.377
  358    HG3  LYS  44           HG1      LYS  44  85.064  -9.585  16.322
  359    HD2  LYS  44           HD2      LYS  44  87.420 -10.514  16.080
  360    HD3  LYS  44           HD1      LYS  44  87.893  -9.426  17.385
  361    HE2  LYS  44           HE2      LYS  44  87.378 -11.473  18.471
  362    HE3  LYS  44           HE1      LYS  44  85.953 -10.464  18.722
  363    HZ1  LYS  44           HZ1      LYS  44  84.699 -11.805  17.481
  364    HZ2  LYS  44           HZ2      LYS  44  85.941 -12.950  17.662
  365    HZ3  LYS  44           HZ3      LYS  44  85.881 -11.971  16.275
  366    H    LYS  45           HN       LYS  45  84.230  -7.915  15.569
  367    HA   LYS  45           HA       LYS  45  82.105  -7.855  13.525
  368    HB2  LYS  45           HB2      LYS  45  82.222  -9.840  15.701
  369    HB3  LYS  45           HB1      LYS  45  80.708  -8.938  15.661
  370    HG2  LYS  45           HG2      LYS  45  80.340  -9.540  13.342
  371    HG3  LYS  45           HG1      LYS  45  81.934 -10.290  13.240
  372    HD2  LYS  45           HD2      LYS  45  80.180 -11.287  15.415
  373    HD3  LYS  45           HD1      LYS  45  79.669 -11.685  13.774
  374    HE2  LYS  45           HE2      LYS  45  81.195 -13.404  14.772
  375    HE3  LYS  45           HE1      LYS  45  81.830 -12.689  13.290
  376    HZ1  LYS  45           HZ1      LYS  45  82.512 -11.602  15.952
  377    HZ2  LYS  45           HZ2      LYS  45  83.319 -11.370  14.475
  378    HZ3  LYS  45           HZ3      LYS  45  83.397 -12.875  15.261
  379    H    GLY  46           HN       GLY  46  82.543  -5.553  13.937
  380    HA2  GLY  46           HA2      GLY  46  82.135  -4.391  16.545
  381    HA3  GLY  46           HA1      GLY  46  82.146  -3.505  15.020
  382    H    VAL  47           HN       VAL  47  80.141  -5.080  17.391
  383    HA   VAL  47           HA       VAL  47  77.678  -4.980  15.876
  384    HB   VAL  47           HB       VAL  47  76.618  -5.228  18.158
  385   HG11  VAL  47          HG11      VAL  47  78.857  -7.063  17.282
  386   HG12  VAL  47          HG12      VAL  47  77.129  -7.242  16.980
  387   HG13  VAL  47          HG13      VAL  47  77.768  -7.469  18.608
  388   HG21  VAL  47          HG21      VAL  47  79.497  -5.365  19.099
  389   HG22  VAL  47          HG22      VAL  47  78.043  -5.477  20.092
  390   HG23  VAL  47          HG23      VAL  47  78.470  -3.949  19.322
  391    H    GLN  48           HN       GLN  48  79.592  -2.615  17.435
  392    HA   GLN  48           HA       GLN  48  77.673  -0.752  18.349
  393    HB2  GLN  48           HB2      GLN  48  80.126  -0.520  18.683
  394    HB3  GLN  48           HB1      GLN  48  80.307  -0.153  16.967
  395    HG2  GLN  48           HG2      GLN  48  79.069   1.873  17.165
  396    HG3  GLN  48           HG1      GLN  48  78.474   1.439  18.768
  397   HE21  GLN  48          HE21      GLN  48  81.691   0.464  18.575
  398   HE22  GLN  48          HE22      GLN  48  82.418   1.825  19.282
  399    H    GLY  49           HN       GLY  49  79.456  -0.170  15.322
  400    HA2  GLY  49           HA2      GLY  49  77.528  -0.271  13.385
  401    HA3  GLY  49           HA1      GLY  49  77.130   1.232  14.220
  402    H1U  RCY  50           H1U      RCY  50  81.559   4.306   5.001
  403    H1S  RCY  50           H1S      RCY  50  82.562   3.859   9.196
  404    HB1  RCY  50           HB1      RCY  50  78.824   4.267  11.491
  405    HB2  RCY  50           HB2      RCY  50  79.551   2.825  10.781
  406    HA   RCY  50           HA       RCY  50  81.139   2.673  12.633
  407    HN1  RCY  50           HN1      RCY  50  78.658   2.974  14.152
  408    H    GLY  51           HN       GLY  51  78.840   5.352  13.251
  409    HA2  GLY  51           HA2      GLY  51  79.227   7.433  14.276
  410    HA3  GLY  51           HA1      GLY  51  80.072   6.476  15.494
  411    H    ASP  52           HN       ASP  52  80.997   6.800  12.088
  412    HA   ASP  52           HA       ASP  52  83.740   7.328  12.740
  413    HB2  ASP  52           HB2      ASP  52  83.155   6.373  10.580
  414    HB3  ASP  52           HB1      ASP  52  82.183   7.789  10.178
  415    H    ASP  53           HN       ASP  53  82.397   9.608  10.505
  416    HA   ASP  53           HA       ASP  53  83.301  11.815  12.265
  417    HB2  ASP  53           HB2      ASP  53  82.376  11.831   9.374
  418    HB3  ASP  53           HB1      ASP  53  83.050  13.212  10.243
  419    H    ILE  54           HN       ILE  54  80.414  11.020  10.289
  420    HA   ILE  54           HA       ILE  54  78.755  12.367  12.370
  421    HB   ILE  54           HB       ILE  54  77.286  13.100  10.321
  422   HG12  ILE  54          HG12      ILE  54  79.097  11.744   8.876
  423   HG13  ILE  54          HG11      ILE  54  78.271  13.164   8.235
  424   HG21  ILE  54          HG21      ILE  54  78.248  14.779  11.699
  425   HG22  ILE  54          HG22      ILE  54  78.792  15.172  10.068
  426   HG23  ILE  54          HG23      ILE  54  79.887  14.367  11.193
  427   HD11  ILE  54          HD11      ILE  54  80.878  13.048   8.078
  428   HD12  ILE  54          HD12      ILE  54  80.829  13.481   9.787
  429   HD13  ILE  54          HD13      ILE  54  80.122  14.559   8.584
  430    HA   PRO  55           HA       PRO  55  76.398   8.632  11.947
  431    HB2  PRO  55           HB2      PRO  55  74.000   9.424  12.962
  432    HB3  PRO  55           HB1      PRO  55  75.444   9.226  13.976
  433    HG2  PRO  55           HG2      PRO  55  74.257  11.722  12.862
  434    HG3  PRO  55           HG1      PRO  55  74.939  11.415  14.468
  435    HD2  PRO  55           HD2      PRO  55  76.325  12.696  12.472
  436    HD3  PRO  55           HD1      PRO  55  77.114  11.756  13.758
  437    H    GLY  56           HN       GLY  56  76.541   9.159   9.455
  438    HA2  GLY  56           HA2      GLY  56  75.466   9.460   7.374
  439    HA3  GLY  56           HA1      GLY  56  74.199   8.503   8.141
  440    H    MET  57           HN       MET  57  75.286  11.788   8.970
  441    HA   MET  57           HA       MET  57  74.073  13.787   9.115
  442    HB2  MET  57           HB2      MET  57  73.922  13.250   6.603
  443    HB3  MET  57           HB1      MET  57  72.297  12.660   6.941
  444    HG2  MET  57           HG2      MET  57  73.230  15.414   7.772
  445    HG3  MET  57           HG1      MET  57  72.456  15.103   6.218
  446    HE1  MET  57           HE1      MET  57  70.996  17.047   7.139
  447    HE2  MET  57           HE2      MET  57  69.355  16.586   7.585
  448    HE3  MET  57           HE3      MET  57  70.069  15.954   6.103
  449    H    GLU  58           HN       GLU  58  71.326  11.784   8.075
  450    HA   GLU  58           HA       GLU  58  69.893  12.574  10.530
  451    HB2  GLU  58           HB2      GLU  58  68.634  12.704   8.467
  452    HB3  GLU  58           HB1      GLU  58  69.045  11.040   8.054
  453    HG2  GLU  58           HG2      GLU  58  66.732  11.300   9.014
  454    HG3  GLU  58           HG1      GLU  58  67.758  10.193   9.926
  455    H    GLY  59           HN       GLY  59  71.357   9.719   9.082
  456    HA2  GLY  59           HA2      GLY  59  71.768   8.340  11.479
  457    HA3  GLY  59           HA1      GLY  59  70.182   7.816  10.912
  458    H1U  RCY  60           H1U      RCY  60  76.444   4.324   4.469
  459    H1S  RCY  60           H1S      RCY  60  73.578   2.448   6.860
  460    HB1  RCY  60           HB1      RCY  60  73.173   4.038  10.952
  461    HB2  RCY  60           HB2      RCY  60  74.803   4.417  10.403
  462    HA   RCY  60           HA       RCY  60  74.060   5.822   8.724
  463    HN1  RCY  60           HN1      RCY  60  72.697   6.261  11.106
  464    H    GLY  61           HN       GLY  61  70.756   4.867   9.529
  465    HA2  GLY  61           HA2      GLY  61  70.170   3.078   7.466
  466    HA3  GLY  61           HA1      GLY  61  69.002   4.246   8.086
  467    H    THR  62           HN       THR  62  70.372   6.619   7.309
  468    HA   THR  62           HA       THR  62  70.168   8.061   5.437
  469    HB   THR  62           HB       THR  62  71.821   7.467   3.675
  470    HG1  THR  62           HG1      THR  62  72.752   5.501   3.680
  471   HG21  THR  62          HG21      THR  62  73.776   7.443   5.135
  472   HG22  THR  62          HG22      THR  62  72.797   6.859   6.480
  473   HG23  THR  62          HG23      THR  62  72.536   8.480   5.838
  474    H    ASP  63           HN       ASP  63  67.816   7.254   5.225
  475    HA   ASP  63           HA       ASP  63  67.191   5.290   3.202
  476    HB2  ASP  63           HB2      ASP  63  65.656   6.084   5.070
  477    HB3  ASP  63           HB1      ASP  63  65.407   7.554   4.127
  478    H    ILE  64           HN       ILE  64  68.995   7.669   2.522
  479    HA   ILE  64           HA       ILE  64  68.788   7.977  -0.124
  480    HB   ILE  64           HB       ILE  64  66.461   8.513  -0.200
  481   HG12  ILE  64          HG12      ILE  64  67.432  11.313  -0.312
  482   HG13  ILE  64          HG11      ILE  64  68.355  10.154  -1.269
  483   HG21  ILE  64          HG21      ILE  64  67.024   9.727   2.328
  484   HG22  ILE  64          HG22      ILE  64  65.451   9.431   1.588
  485   HG23  ILE  64          HG23      ILE  64  66.296  10.949   1.284
  486   HD11  ILE  64          HD11      ILE  64  66.333   9.421  -2.414
  487   HD12  ILE  64          HD12      ILE  64  66.464  11.174  -2.548
  488   HD13  ILE  64          HD13      ILE  64  65.341  10.460  -1.391
  489    H    THR  65           HN       THR  65  70.961   8.398   0.978
  490    HA   THR  65           HA       THR  65  71.406  11.069   2.044
  491    HB   THR  65           HB       THR  65  73.016   9.427   2.715
  492    HG1  THR  65           HG1      THR  65  74.639  10.402   0.758
  493   HG21  THR  65          HG21      THR  65  73.150   8.767  -0.233
  494   HG22  THR  65          HG22      THR  65  72.662   7.710   1.092
  495   HG23  THR  65          HG23      THR  65  74.350   8.192   0.925
  496    H    VAL  66           HN       VAL  66  69.936  10.981  -0.381
  497    HA   VAL  66           HA       VAL  66  69.806  12.224  -2.356
  498    HB   VAL  66           HB       VAL  66  72.694  13.036  -2.103
  499   HG11  VAL  66          HG11      VAL  66  71.943  15.021  -3.181
  500   HG12  VAL  66          HG12      VAL  66  70.256  14.685  -2.793
  501   HG13  VAL  66          HG13      VAL  66  71.095  13.708  -3.998
  502   HG21  VAL  66          HG21      VAL  66  70.483  13.619  -0.200
  503   HG22  VAL  66          HG22      VAL  66  71.461  14.997  -0.705
  504   HG23  VAL  66          HG23      VAL  66  72.225  13.610   0.070
  505    H    ILE  67           HN       ILE  67  72.142   9.855  -1.635
  506    HA   ILE  67           HA       ILE  67  72.266   9.107  -4.519
  507    HB   ILE  67           HB       ILE  67  74.648   9.263  -2.649
  508   HG12  ILE  67          HG12      ILE  67  75.140  10.510  -5.125
  509   HG13  ILE  67          HG11      ILE  67  73.515  11.019  -4.662
  510   HG21  ILE  67          HG21      ILE  67  75.866   8.480  -4.764
  511   HG22  ILE  67          HG22      ILE  67  74.282   8.001  -5.372
  512   HG23  ILE  67          HG23      ILE  67  74.926   7.258  -3.908
  513   HD11  ILE  67          HD11      ILE  67  74.467  11.552  -2.362
  514   HD12  ILE  67          HD12      ILE  67  75.018  12.599  -3.670
  515   HD13  ILE  67          HD13      ILE  67  76.068  11.318  -3.065
  516    H1U  RCY  68           H1U      RCY  68  73.810   1.713  -0.687
  517    H1S  RCY  68           H1S      RCY  68  72.154   5.722  -1.451
  518    HB1  RCY  68           HB1      RCY  68  69.568   4.309  -2.612
  519    HB2  RCY  68           HB2      RCY  68  69.216   5.975  -3.069
  520    HA   RCY  68           HA       RCY  68  72.049   5.166  -2.454
  521    HN1  RCY  68           HN1      RCY  68  70.995   7.262  -4.314
  522    HA   PRO  69           HA       PRO  69  72.976   2.298  -5.629
  523    HB2  PRO  69           HB2      PRO  69  70.502   0.847  -4.729
  524    HB3  PRO  69           HB1      PRO  69  72.105   0.194  -5.123
  525    HG2  PRO  69           HG2      PRO  69  71.273   0.680  -2.588
  526    HG3  PRO  69           HG1      PRO  69  72.969   0.735  -3.089
  527    HD2  PRO  69           HD2      PRO  69  71.283   2.933  -2.202
  528    HD3  PRO  69           HD1      PRO  69  73.021   2.952  -2.570
  529    H    TRP  70           HN       TRP  70  69.532   3.236  -5.419
  530    HA   TRP  70           HA       TRP  70  69.124   2.590  -8.247
  531    HD1  TRP  70           HD1      TRP  70  68.425   1.863  -4.822
  532    HE1  TRP  70           HE1      TRP  70  67.862   2.932  -2.545
  533    HE3  TRP  70           HE3      TRP  70  65.939   6.036  -6.397
  534    HZ2  TRP  70           HZ2      TRP  70  66.531   5.254  -1.525
  535    HZ3  TRP  70           HZ3      TRP  70  65.036   7.655  -4.758
  536    HH2  TRP  70           HH2      TRP  70  65.327   7.273  -2.327
  537    HB2  TRP  70           HB2      TRP  70  66.957   4.129  -7.608
  538    HB3  TRP  70           HB1      TRP  70  67.051   2.396  -7.315
  539    H    GLU  71           HN       GLU  71  71.256   4.489  -7.554
  540    HA   GLU  71           HA       GLU  71  70.377   6.698  -9.337
  541    HB2  GLU  71           HB2      GLU  71  71.615   7.040  -6.593
  542    HB3  GLU  71           HB1      GLU  71  71.610   8.317  -7.809
  543    HG2  GLU  71           HG2      GLU  71  69.106   6.918  -6.827
  544    HG3  GLU  71           HG1      GLU  71  69.688   8.455  -6.185
  545    H    ALA  72           HN       ALA  72  73.290   6.166  -7.346
  546    HA   ALA  72           HA       ALA  72  75.007   6.680  -9.640
  547    HB1  ALA  72           HB1      ALA  72  76.848   6.210  -8.043
  548    HB2  ALA  72           HB2      ALA  72  75.656   5.701  -6.846
  549    HB3  ALA  72           HB3      ALA  72  75.694   7.377  -7.397
  550    H1U  RCY  73           H1U      RCY  73  76.958  -3.573  -3.887
  551    H1S  RCY  73           H1S      RCY  73  74.098  -0.522  -6.218
  552    HB1  RCY  73           HB1      RCY  73  73.479   1.446  -7.711
  553    HB2  RCY  73           HB2      RCY  73  75.030   1.363  -6.877
  554    HA   RCY  73           HA       RCY  73  76.202   2.021  -8.912
  555    HN1  RCY  73           HN1      RCY  73  74.527   3.793  -7.556
  556    H    ASN  74           HN       ASN  74  76.285   1.938 -11.111
  557    HA   ASN  74           HA       ASN  74  73.784   1.956 -12.692
  558    HB2  ASN  74           HB2      ASN  74  75.618   3.298 -13.553
  559    HB3  ASN  74           HB1      ASN  74  76.711   1.915 -13.488
  560   HD21  ASN  74          HD21      ASN  74  76.700   0.469 -15.265
  561   HD22  ASN  74          HD22      ASN  74  75.645   0.610 -16.587
  562    H    HIS  75           HN       HIS  75  76.533  -0.185 -11.982
  563    HA   HIS  75           HA       HIS  75  75.092  -2.586 -11.986
  564    HD1  HIS  75           HD1      HIS  75  73.148  -2.118 -12.663
  565    HD2  HIS  75           HD2      HIS  75  74.304  -4.605 -15.806
  566    HE1  HIS  75           HE1      HIS  75  71.124  -3.527 -13.243
  567    HE2  HIS  75           HE2      HIS  75  71.815  -5.045 -15.154
  568    HB2  HIS  75           HB2      HIS  75  75.537  -1.548 -14.677
  569    HB3  HIS  75           HB1      HIS  75  76.306  -3.119 -14.474
  570    H1U  RCY  76           H1U      RCY  76  73.496  -5.317  -6.975
  571    H1S  RCY  76           H1S      RCY  76  76.599  -3.005  -8.976
  572    HB1  RCY  76           HB1      RCY  76  79.363  -1.910 -10.603
  573    HB2  RCY  76           HB2      RCY  76  80.468  -3.123  -9.958
  574    HA   RCY  76           HA       RCY  76  79.197  -4.245 -11.637
  575    HN1  RCY  76           HN1      RCY  76  76.516  -3.622 -10.664
  576    H    GLU  77           HN       GLU  77  77.134  -5.971 -11.044
  577    HA   GLU  77           HA       GLU  77  76.889  -6.929  -8.413
  578    HB2  GLU  77           HB2      GLU  77  76.852  -8.332 -11.087
  579    HB3  GLU  77           HB1      GLU  77  76.629  -9.229  -9.585
  580    HG2  GLU  77           HG2      GLU  77  74.719  -7.830  -8.987
  581    HG3  GLU  77           HG1      GLU  77  74.969  -6.833 -10.421
  582    H    LEU  78           HN       LEU  78  78.906  -8.695 -10.761
  583    HA   LEU  78           HA       LEU  78  80.940  -9.819 -10.461
  584    HG   LEU  78           HG       LEU  78  83.056  -9.793  -9.507
  585    HB2  LEU  78           HB2      LEU  78  81.752  -7.489 -10.251
  586    HB3  LEU  78           HB1      LEU  78  81.434  -7.538  -8.519
  587   HD11  LEU  78          HD11      LEU  78  85.126  -8.309  -9.569
  588   HD12  LEU  78          HD12      LEU  78  84.030  -6.933  -9.694
  589   HD13  LEU  78          HD13      LEU  78  84.049  -8.163 -10.958
  590   HD21  LEU  78          HD21      LEU  78  83.490  -7.747  -7.308
  591   HD22  LEU  78          HD22      LEU  78  84.314  -9.298  -7.473
  592   HD23  LEU  78          HD23      LEU  78  82.589  -9.250  -7.109
  593    H    HIS  79           HN       HIS  79  82.158 -11.146  -8.904
  594    HA   HIS  79           HA       HIS  79  81.015 -11.417  -6.197
  595    HD1  HIS  79           HD1      HIS  79  78.716 -13.856  -9.375
  596    HD2  HIS  79           HD2      HIS  79  82.873 -13.536  -9.240
  597    HE1  HIS  79           HE1      HIS  79  79.555 -14.451 -11.689
  598    HE2  HIS  79           HE2      HIS  79  82.084 -14.260 -11.621
  599    HB2  HIS  79           HB2      HIS  79  80.831 -13.989  -6.722
  600    HB3  HIS  79           HB1      HIS  79  79.512 -12.915  -7.187
  601    H    GLU  80           HN       GLU  80  83.310 -10.658  -5.880
  602    HA   GLU  80           HA       GLU  80  85.079 -13.008  -5.577
  603    HB2  GLU  80           HB2      GLU  80  85.387 -11.622  -7.875
  604    HB3  GLU  80           HB1      GLU  80  86.375 -10.617  -6.819
  605    HG2  GLU  80           HG2      GLU  80  87.928 -12.198  -7.573
  606    HG3  GLU  80           HG1      GLU  80  87.403 -12.902  -6.044
  607    H    LEU  81           HN       LEU  81  84.471  -9.574  -5.107
  608    HA   LEU  81           HA       LEU  81  86.447  -9.363  -2.940
  609    HG   LEU  81           HG       LEU  81  85.880  -7.246  -1.620
  610    HB2  LEU  81           HB2      LEU  81  86.217  -7.419  -4.290
  611    HB3  LEU  81           HB1      LEU  81  84.461  -7.484  -4.234
  612   HD11  LEU  81          HD11      LEU  81  86.006  -4.761  -1.911
  613   HD12  LEU  81          HD12      LEU  81  85.636  -4.980  -3.621
  614   HD13  LEU  81          HD13      LEU  81  87.130  -5.636  -2.952
  615   HD21  LEU  81          HD21      LEU  81  83.271  -7.206  -2.411
  616   HD22  LEU  81          HD22      LEU  81  83.633  -5.480  -2.403
  617   HD23  LEU  81          HD23      LEU  81  83.856  -6.434  -0.937
  618    H    ALA  82           HN       ALA  82  83.867 -11.109  -2.935
  619    HA   ALA  82           HA       ALA  82  81.934 -10.227  -1.141
  620    HB1  ALA  82           HB1      ALA  82  83.245 -12.959  -1.268
  621    HB2  ALA  82           HB2      ALA  82  81.806 -12.439  -2.146
  622    HB3  ALA  82           HB3      ALA  82  81.755 -12.610  -0.391
  623    H    GLN  83           HN       GLN  83  84.590 -12.304   0.080
  624    HA   GLN  83           HA       GLN  83  85.713 -12.227   2.144
  625    HB2  GLN  83           HB2      GLN  83  86.326  -9.927   1.143
  626    HB3  GLN  83           HB1      GLN  83  85.070  -9.272   2.193
  627    HG2  GLN  83           HG2      GLN  83  87.154  -9.110   3.391
  628    HG3  GLN  83           HG1      GLN  83  86.224 -10.412   4.133
  629   HE21  GLN  83          HE21      GLN  83  88.482 -10.123   1.317
  630   HE22  GLN  83          HE22      GLN  83  89.373 -11.513   1.710
  631    H    TYR  84           HN       TYR  84  85.131 -12.399   4.346
  632    HA   TYR  84           HA       TYR  84  83.639 -12.581   6.152
  633    HD1  TYR  84           HD2      TYR  84  84.840 -10.676   7.498
  634    HD2  TYR  84           HD1      TYR  84  83.461  -8.655   3.967
  635    HE1  TYR  84           HE2      TYR  84  86.838  -9.208   7.557
  636    HE2  TYR  84           HE1      TYR  84  85.459  -7.188   4.026
  637    HH   TYR  84           HH       TYR  84  87.321  -6.663   5.102
  638    HB2  TYR  84           HB2      TYR  84  82.097 -10.271   4.971
  639    HB3  TYR  84           HB1      TYR  84  82.346 -10.676   6.669
  640    H    GLY  85           HN       GLY  85  81.446 -11.328   3.629
  641    HA2  GLY  85           HA2      GLY  85  80.335 -13.560   2.538
  642    HA3  GLY  85           HA1      GLY  85  79.588 -13.544   4.136
  643    H    ILE  86           HN       ILE  86  79.628 -10.571   4.231
  644    HA   ILE  86           HA       ILE  86  78.020  -9.591   2.016
  645    HB   ILE  86           HB       ILE  86  76.015  -9.169   3.644
  646   HG12  ILE  86          HG12      ILE  86  77.300 -11.604   4.924
  647   HG13  ILE  86          HG11      ILE  86  77.240  -9.998   5.652
  648   HG21  ILE  86          HG21      ILE  86  74.915 -10.958   2.665
  649   HG22  ILE  86          HG22      ILE  86  76.261 -12.066   2.930
  650   HG23  ILE  86          HG23      ILE  86  76.341 -10.876   1.631
  651   HD11  ILE  86          HD11      ILE  86  74.690 -10.135   5.330
  652   HD12  ILE  86          HD12      ILE  86  75.390 -11.149   6.592
  653   HD13  ILE  86          HD13      ILE  86  74.940 -11.857   5.041
  654    H1U  RCY  87           H1U      RCY  87  81.436  -3.106  -3.213
  655    H1S  RCY  87           H1S      RCY  87  80.173  -5.179   0.978
  656    HB1  RCY  87           HB1      RCY  87  82.185  -6.706   4.060
  657    HB2  RCY  87           HB2      RCY  87  81.593  -5.142   3.505
  658    HA   RCY  87           HA       RCY  87  80.075  -6.646   5.051
  659    HN1  RCY  87           HN1      RCY  87  80.182  -8.333   2.755
  Start of MODEL   56
    1    HA   MET   1           HA       MET   1  72.129   8.221  25.811
    2    HB2  MET   1           HB2      MET   1  71.666  11.209  25.563
    3    HB3  MET   1           HB1      MET   1  70.385  10.011  25.748
    4    HG2  MET   1           HG2      MET   1  71.349   9.290  27.895
    5    HG3  MET   1           HG1      MET   1  72.653  10.464  27.710
    6    HE1  MET   1           HE1      MET   1  71.246  13.831  28.301
    7    HE2  MET   1           HE2      MET   1  72.149  12.932  27.084
    8    HE3  MET   1           HE3      MET   1  72.555  12.748  28.788
    9    H    ASN   2           HN       ASN   2  71.348   7.222  24.020
   10    HA   ASN   2           HA       ASN   2  70.701   8.681  21.597
   11    HB2  ASN   2           HB2      ASN   2  72.317   7.255  20.184
   12    HB3  ASN   2           HB1      ASN   2  73.018   8.604  21.079
   13   HD21  ASN   2          HD21      ASN   2  74.904   8.013  22.145
   14   HD22  ASN   2          HD22      ASN   2  75.223   6.477  22.793
   15    H    LEU   3           HN       LEU   3  68.813   7.666  21.123
   16    HA   LEU   3           HA       LEU   3  68.487   4.803  21.773
   17    HG   LEU   3           HG       LEU   3  67.304   8.021  21.806
   18    HB2  LEU   3           HB2      LEU   3  66.132   5.500  20.586
   19    HB3  LEU   3           HB1      LEU   3  66.462   5.728  22.301
   20   HD11  LEU   3          HD11      LEU   3  66.536   7.180  19.013
   21   HD12  LEU   3          HD12      LEU   3  68.039   7.919  19.564
   22   HD13  LEU   3          HD13      LEU   3  66.565   8.883  19.473
   23   HD21  LEU   3          HD21      LEU   3  64.950   7.677  22.463
   24   HD22  LEU   3          HD22      LEU   3  64.511   7.428  20.773
   25   HD23  LEU   3          HD23      LEU   3  65.088   9.006  21.312
   26    H    GLU   4           HN       GLU   4  68.668   3.210  20.274
   27    HA   GLU   4           HA       GLU   4  68.594   3.975  17.384
   28    HB2  GLU   4           HB2      GLU   4  70.932   3.568  18.283
   29    HB3  GLU   4           HB1      GLU   4  70.445   1.896  18.569
   30    HG2  GLU   4           HG2      GLU   4  69.929   1.604  16.197
   31    HG3  GLU   4           HG1      GLU   4  70.310   3.297  15.882
   32    HA   PRO   5           HA       PRO   5  65.241   0.971  17.321
   33    HB2  PRO   5           HB2      PRO   5  66.367   0.586  14.565
   34    HB3  PRO   5           HB1      PRO   5  64.676   0.768  15.074
   35    HG2  PRO   5           HG2      PRO   5  66.035   2.790  13.988
   36    HG3  PRO   5           HG1      PRO   5  64.844   3.052  15.272
   37    HD2  PRO   5           HD2      PRO   5  67.804   3.246  15.400
   38    HD3  PRO   5           HD1      PRO   5  66.577   4.010  16.435
   39    HA   PRO   6           HA       PRO   6  68.164  -2.492  17.964
   40    HB2  PRO   6           HB2      PRO   6  66.790  -3.726  19.949
   41    HB3  PRO   6           HB1      PRO   6  67.771  -2.276  20.237
   42    HG2  PRO   6           HG2      PRO   6  64.826  -2.541  19.983
   43    HG3  PRO   6           HG1      PRO   6  65.780  -1.473  21.023
   44    HD2  PRO   6           HD2      PRO   6  64.568  -0.706  18.626
   45    HD3  PRO   6           HD1      PRO   6  65.890   0.169  19.427
   46    H    LYS   7           HN       LYS   7  68.134  -4.552  17.070
   47    HA   LYS   7           HA       LYS   7  66.117  -5.327  15.264
   48    HB2  LYS   7           HB2      LYS   7  67.164  -7.582  15.341
   49    HB3  LYS   7           HB1      LYS   7  68.362  -6.297  15.201
   50    HG2  LYS   7           HG2      LYS   7  68.162  -6.479  17.909
   51    HG3  LYS   7           HG1      LYS   7  67.841  -8.152  17.453
   52    HD2  LYS   7           HD2      LYS   7  70.222  -7.946  17.737
   53    HD3  LYS   7           HD1      LYS   7  69.916  -8.052  16.003
   54    HE2  LYS   7           HE2      LYS   7  70.564  -5.894  15.621
   55    HE3  LYS   7           HE1      LYS   7  69.886  -5.315  17.143
   56    HZ1  LYS   7           HZ1      LYS   7  71.772  -5.793  18.279
   57    HZ2  LYS   7           HZ2      LYS   7  72.470  -5.512  16.756
   58    HZ3  LYS   7           HZ3      LYS   7  72.192  -7.102  17.284
   59    H    ALA   8           HN       ALA   8  64.028  -5.337  16.089
   60    HA   ALA   8           HA       ALA   8  63.139  -7.667  17.500
   61    HB1  ALA   8           HB1      ALA   8  62.308  -6.382  19.559
   62    HB2  ALA   8           HB2      ALA   8  63.448  -5.117  19.098
   63    HB3  ALA   8           HB3      ALA   8  64.036  -6.730  19.503
   64    H    GLU   9           HN       GLU   9  62.621  -5.488  15.328
   65    HA   GLU   9           HA       GLU   9  59.697  -5.684  15.503
   66    HB2  GLU   9           HB2      GLU   9  59.347  -3.237  15.290
   67    HB3  GLU   9           HB1      GLU   9  60.125  -3.650  16.818
   68    HG2  GLU   9           HG2      GLU   9  62.352  -3.260  15.517
   69    HG3  GLU   9           HG1      GLU   9  61.337  -2.385  14.369
   70    H1U  RCY  10           H1U      RCY  10  60.682 -10.537   6.953
   71    H1S  RCY  10           H1S      RCY  10  62.693  -8.250  10.261
   72    HB1  RCY  10           HB1      RCY  10  62.011  -5.867  11.306
   73    HB2  RCY  10           HB2      RCY  10  61.098  -6.671  10.029
   74    HA   RCY  10           HA       RCY  10  59.920  -4.708  11.151
   75    HN1  RCY  10           HN1      RCY  10  59.098  -6.221  13.464
   76    H    ARG  11           HN       ARG  11  57.437  -5.522  12.232
   77    HA   ARG  11           HA       ARG  11  56.344  -7.883  11.087
   78    HE   ARG  11           HE       ARG  11  55.070  -6.660  15.811
   79    HB2  ARG  11           HB2      ARG  11  54.862  -5.274  11.509
   80    HB3  ARG  11           HB1      ARG  11  54.180  -6.901  11.498
   81    HG2  ARG  11           HG2      ARG  11  55.444  -7.480  13.511
   82    HG3  ARG  11           HG1      ARG  11  56.219  -5.895  13.506
   83    HD2  ARG  11           HD2      ARG  11  54.172  -4.778  13.990
   84    HD3  ARG  11           HD1      ARG  11  53.215  -6.211  13.615
   85   HH11  ARG  11          HH21      ARG  11  52.018  -5.390  14.830
   86   HH12  ARG  11          HH22      ARG  11  51.284  -5.592  16.386
   87   HH21  ARG  11          HH11      ARG  11  54.128  -6.931  17.849
   88   HH22  ARG  11          HH12      ARG  11  52.479  -6.464  18.095
   89    H    SER  12           HN       SER  12  57.692  -5.313   9.485
   90    HA   SER  12           HA       SER  12  57.746  -4.807   7.190
   91    HG   SER  12           HG       SER  12  57.937  -7.316   7.887
   92    HB2  SER  12           HB2      SER  12  55.570  -6.768   6.574
   93    HB3  SER  12           HB1      SER  12  57.046  -6.414   5.680
   94    H    ALA  13           HN       ALA  13  54.389  -5.639   8.144
   95    HA   ALA  13           HA       ALA  13  52.397  -4.439   7.794
   96    HB1  ALA  13           HB1      ALA  13  53.490  -3.075   9.565
   97    HB2  ALA  13           HB2      ALA  13  52.510  -2.088   8.481
   98    HB3  ALA  13           HB3      ALA  13  54.265  -2.105   8.313
   99    H    THR  14           HN       THR  14  52.662  -1.542   6.758
  100    HA   THR  14           HA       THR  14  52.277  -2.209   3.960
  101    HB   THR  14           HB       THR  14  52.665   0.543   5.171
  102    HG1  THR  14           HG1      THR  14  50.142   0.076   4.830
  103   HG21  THR  14          HG21      THR  14  51.257   1.236   3.264
  104   HG22  THR  14          HG22      THR  14  51.195  -0.437   2.707
  105   HG23  THR  14          HG23      THR  14  52.728   0.435   2.712
  106    H    ARG  15           HN       ARG  15  54.390  -3.200   3.513
  107    HA   ARG  15           HA       ARG  15  56.864  -1.808   3.801
  108    HE   ARG  15           HE       ARG  15  55.373  -5.815  -0.906
  109    HB2  ARG  15           HB2      ARG  15  57.608  -3.379   1.912
  110    HB3  ARG  15           HB1      ARG  15  56.986  -4.144   3.373
  111    HG2  ARG  15           HG2      ARG  15  54.823  -4.496   2.349
  112    HG3  ARG  15           HG1      ARG  15  55.287  -3.548   0.936
  113    HD2  ARG  15           HD2      ARG  15  57.147  -5.230   0.550
  114    HD3  ARG  15           HD1      ARG  15  56.404  -6.226   1.801
  115   HH11  ARG  15          HH21      ARG  15  54.720  -6.624   2.381
  116   HH12  ARG  15          HH22      ARG  15  53.290  -7.529   2.013
  117   HH21  ARG  15          HH11      ARG  15  53.509  -6.993  -1.406
  118   HH22  ARG  15          HH12      ARG  15  52.605  -7.739  -0.130
  119    H    VAL  16           HN       VAL  16  56.866  -2.521   0.562
  120    HA   VAL  16           HA       VAL  16  55.630  -0.182  -0.566
  121    HB   VAL  16           HB       VAL  16  57.339   1.086   0.556
  122   HG11  VAL  16          HG11      VAL  16  58.845  -0.793   1.075
  123   HG12  VAL  16          HG12      VAL  16  59.737   0.522   0.309
  124   HG13  VAL  16          HG13      VAL  16  59.298  -0.908  -0.625
  125   HG21  VAL  16          HG21      VAL  16  58.431   0.644  -2.230
  126   HG22  VAL  16          HG22      VAL  16  58.403   2.141  -1.298
  127   HG23  VAL  16          HG23      VAL  16  56.903   1.478  -1.948
  128    H    MET  17           HN       MET  17  58.118  -2.678  -0.795
  129    HA   MET  17           HA       MET  17  57.413  -2.990  -3.682
  130    HB2  MET  17           HB2      MET  17  59.539  -1.825  -3.661
  131    HB3  MET  17           HB1      MET  17  60.193  -2.952  -2.473
  132    HG2  MET  17           HG2      MET  17  59.127  -4.033  -5.059
  133    HG3  MET  17           HG1      MET  17  60.722  -3.280  -5.042
  134    HE1  MET  17           HE1      MET  17  62.966  -5.426  -3.024
  135    HE2  MET  17           HE2      MET  17  62.339  -3.786  -2.870
  136    HE3  MET  17           HE3      MET  17  62.787  -4.406  -4.458
  137    H    GLY  18           HN       GLY  18  57.368  -5.143  -4.387
  138    HA2  GLY  18           HA2      GLY  18  58.280  -7.273  -2.553
  139    HA3  GLY  18           HA1      GLY  18  56.549  -7.223  -2.890
  140    H    GLY  19           HN       GLY  19  55.888  -8.397  -4.625
  141    HA2  GLY  19           HA2      GLY  19  55.943  -9.363  -6.781
  142    HA3  GLY  19           HA1      GLY  19  57.474  -8.534  -7.069
  143    HA   PRO  20           HA       PRO  20  57.923 -12.937  -4.688
  144    HB2  PRO  20           HB2      PRO  20  56.510 -14.198  -7.012
  145    HB3  PRO  20           HB1      PRO  20  56.568 -14.713  -5.314
  146    HG2  PRO  20           HG2      PRO  20  54.426 -13.499  -6.318
  147    HG3  PRO  20           HG1      PRO  20  54.972 -13.185  -4.662
  148    HD2  PRO  20           HD2      PRO  20  55.174 -11.436  -7.071
  149    HD3  PRO  20           HD1      PRO  20  55.047 -10.986  -5.355
  150    H1U  RCY  21           H1U      RCY  21  63.808  -5.809  -7.516
  151    H1S  RCY  21           H1S      RCY  21  64.938 -10.351  -8.495
  152    HB1  RCY  21           HB1      RCY  21  61.248 -10.977  -6.995
  153    HB2  RCY  21           HB2      RCY  21  61.456 -11.688  -8.594
  154    HA   RCY  21           HA       RCY  21  60.951 -13.770  -7.843
  155    HN1  RCY  21           HN1      RCY  21  60.100 -12.562  -5.255
  156    H    THR  22           HN       THR  22  63.275 -14.413  -7.780
  157    HA   THR  22           HA       THR  22  64.391 -14.668  -5.035
  158    HB   THR  22           HB       THR  22  64.606 -17.007  -5.132
  159    HG1  THR  22           HG1      THR  22  65.409 -17.456  -7.066
  160   HG21  THR  22          HG21      THR  22  62.383 -17.858  -5.615
  161   HG22  THR  22          HG22      THR  22  62.037 -16.471  -6.647
  162   HG23  THR  22          HG23      THR  22  62.229 -16.250  -4.908
  163    HA   PRO  23           HA       PRO  23  68.275 -13.468  -6.779
  164    HB2  PRO  23           HB2      PRO  23  69.300 -16.013  -5.562
  165    HB3  PRO  23           HB1      PRO  23  69.966 -14.371  -5.464
  166    HG2  PRO  23           HG2      PRO  23  68.573 -15.467  -3.455
  167    HG3  PRO  23           HG1      PRO  23  68.515 -13.735  -3.813
  168    HD2  PRO  23           HD2      PRO  23  66.420 -15.785  -4.199
  169    HD3  PRO  23           HD1      PRO  23  66.260 -14.019  -4.089
  170    H    ARG  24           HN       ARG  24  69.016 -13.761  -8.847
  171    HA   ARG  24           HA       ARG  24  69.837 -16.235  -9.966
  172    HE   ARG  24           HE       ARG  24  66.519 -17.318 -12.729
  173    HB2  ARG  24           HB2      ARG  24  66.981 -15.857  -9.973
  174    HB3  ARG  24           HB1      ARG  24  67.559 -15.797 -11.636
  175    HG2  ARG  24           HG2      ARG  24  68.607 -17.945 -11.443
  176    HG3  ARG  24           HG1      ARG  24  68.378 -17.971  -9.694
  177    HD2  ARG  24           HD2      ARG  24  66.695 -19.389 -10.774
  178    HD3  ARG  24           HD1      ARG  24  65.917 -17.987 -10.039
  179   HH11  ARG  24          HH21      ARG  24  64.594 -19.491 -10.870
  180   HH12  ARG  24          HH22      ARG  24  63.337 -19.603 -12.056
  181   HH21  ARG  24          HH11      ARG  24  64.889 -17.452 -14.290
  182   HH22  ARG  24          HH12      ARG  24  63.504 -18.449 -13.993
  183    H    LYS  25           HN       LYS  25  68.591 -12.988 -10.453
  184    HA   LYS  25           HA       LYS  25  69.360 -12.587 -13.153
  185    HB2  LYS  25           HB2      LYS  25  69.659 -10.468 -11.020
  186    HB3  LYS  25           HB1      LYS  25  69.206 -10.261 -12.711
  187    HG2  LYS  25           HG2      LYS  25  67.551 -11.554 -10.527
  188    HG3  LYS  25           HG1      LYS  25  67.197 -10.051 -11.380
  189    HD2  LYS  25           HD2      LYS  25  67.198 -11.454 -13.529
  190    HD3  LYS  25           HD1      LYS  25  67.150 -12.867 -12.474
  191    HE2  LYS  25           HE2      LYS  25  65.134 -11.748 -11.340
  192    HE3  LYS  25           HE1      LYS  25  65.103 -10.660 -12.728
  193    HZ1  LYS  25           HZ1      LYS  25  64.763 -13.601 -12.709
  194    HZ2  LYS  25           HZ2      LYS  25  65.091 -12.732 -14.132
  195    HZ3  LYS  25           HZ3      LYS  25  63.669 -12.424 -13.254
  196    H    GLY  26           HN       GLY  26  71.282 -13.215 -10.417
  197    HA2  GLY  26           HA2      GLY  26  73.602 -13.168 -10.066
  198    HA3  GLY  26           HA1      GLY  26  73.720 -13.362 -11.816
  199    HA   PRO  27           HA       PRO  27  75.475  -9.195 -10.220
  200    HB2  PRO  27           HB2      PRO  27  77.572 -10.131 -12.136
  201    HB3  PRO  27           HB1      PRO  27  77.757  -9.311 -10.574
  202    HG2  PRO  27           HG2      PRO  27  78.218 -11.920 -10.842
  203    HG3  PRO  27           HG1      PRO  27  77.492 -11.249  -9.372
  204    HD2  PRO  27           HD2      PRO  27  76.206 -12.828 -11.551
  205    HD3  PRO  27           HD1      PRO  27  75.786 -12.732  -9.827
  206    HA   PRO  28           HA       PRO  28  73.395  -7.330 -13.775
  207    HB2  PRO  28           HB2      PRO  28  75.249  -5.097 -13.006
  208    HB3  PRO  28           HB1      PRO  28  73.515  -5.040 -13.384
  209    HG2  PRO  28           HG2      PRO  28  74.405  -4.951 -10.869
  210    HG3  PRO  28           HG1      PRO  28  72.901  -5.783 -11.298
  211    HD2  PRO  28           HD2      PRO  28  75.509  -6.941 -10.480
  212    HD3  PRO  28           HD1      PRO  28  73.880  -7.642 -10.371
  213    H    LYS  29           HN       LYS  29  74.099  -6.314 -15.880
  214    HA   LYS  29           HA       LYS  29  76.148  -7.757 -17.170
  215    HB2  LYS  29           HB2      LYS  29  74.302  -6.408 -18.269
  216    HB3  LYS  29           HB1      LYS  29  75.258  -4.964 -17.935
  217    HG2  LYS  29           HG2      LYS  29  77.154  -6.528 -19.088
  218    HG3  LYS  29           HG1      LYS  29  75.717  -7.114 -19.928
  219    HD2  LYS  29           HD2      LYS  29  76.492  -4.192 -19.684
  220    HD3  LYS  29           HD1      LYS  29  76.800  -5.194 -21.103
  221    HE2  LYS  29           HE2      LYS  29  74.410  -5.574 -21.405
  222    HE3  LYS  29           HE1      LYS  29  74.053  -4.688 -19.923
  223    HZ1  LYS  29           HZ1      LYS  29  74.391  -3.671 -22.504
  224    HZ2  LYS  29           HZ2      LYS  29  75.667  -3.082 -21.549
  225    HZ3  LYS  29           HZ3      LYS  29  74.057  -2.818 -21.076
  226    H1U  RCY  30           H1U      RCY  30  80.591   0.142 -10.848
  227    H1S  RCY  30           H1S      RCY  30  77.098  -2.104 -13.388
  228    HB1  RCY  30           HB1      RCY  30  80.062  -4.593 -13.897
  229    HB2  RCY  30           HB2      RCY  30  78.729  -5.605 -13.340
  230    HA   RCY  30           HA       RCY  30  79.760  -5.452 -16.192
  231    HN1  RCY  30           HN1      RCY  30  77.828  -7.518 -15.397
  232    H    LYS  31           HN       LYS  31  81.851  -5.804 -14.819
  233    HA   LYS  31           HA       LYS  31  82.094  -8.594 -13.846
  234    HB2  LYS  31           HB2      LYS  31  82.691  -8.252 -16.393
  235    HB3  LYS  31           HB1      LYS  31  84.167  -7.531 -15.753
  236    HG2  LYS  31           HG2      LYS  31  83.130 -10.308 -15.103
  237    HG3  LYS  31           HG1      LYS  31  84.490  -9.938 -16.163
  238    HD2  LYS  31           HD2      LYS  31  85.384  -8.621 -14.060
  239    HD3  LYS  31           HD1      LYS  31  84.295  -9.693 -13.179
  240    HE2  LYS  31           HE2      LYS  31  85.394 -11.618 -14.469
  241    HE3  LYS  31           HE1      LYS  31  86.633 -10.453 -14.937
  242    HZ1  LYS  31           HZ1      LYS  31  85.855 -10.879 -12.114
  243    HZ2  LYS  31           HZ2      LYS  31  87.248 -10.116 -12.718
  244    HZ3  LYS  31           HZ3      LYS  31  87.068 -11.799 -12.862
  245    H    GLN  32           HN       GLN  32  83.071  -8.439 -11.902
  246    HA   GLN  32           HA       GLN  32  84.123  -7.353 -10.084
  247    HB2  GLN  32           HB2      GLN  32  86.430  -7.653 -10.226
  248    HB3  GLN  32           HB1      GLN  32  85.842  -8.737 -11.479
  249    HG2  GLN  32           HG2      GLN  32  87.081  -7.617 -13.000
  250    HG3  GLN  32           HG1      GLN  32  86.125  -6.170 -12.679
  251   HE21  GLN  32          HE21      GLN  32  89.191  -6.711 -13.058
  252   HE22  GLN  32          HE22      GLN  32  89.889  -5.871 -11.759
  253    H    ARG  33           HN       ARG  33  86.337  -5.477 -10.251
  254    HA   ARG  33           HA       ARG  33  84.785  -3.031 -10.443
  255    HE   ARG  33           HE       ARG  33  88.316  -2.626  -7.915
  256    HB2  ARG  33           HB2      ARG  33  86.757  -3.493  -8.865
  257    HB3  ARG  33           HB1      ARG  33  87.798  -3.211 -10.261
  258    HG2  ARG  33           HG2      ARG  33  86.397  -1.013 -10.532
  259    HG3  ARG  33           HG1      ARG  33  85.985  -1.279  -8.837
  260    HD2  ARG  33           HD2      ARG  33  88.642  -0.653 -10.066
  261    HD3  ARG  33           HD1      ARG  33  87.914  -0.017  -8.591
  262   HH11  ARG  33          HH21      ARG  33  90.266  -0.246  -9.469
  263   HH12  ARG  33          HH22      ARG  33  91.760  -0.886  -8.871
  264   HH21  ARG  33          HH11      ARG  33  90.255  -3.477  -7.125
  265   HH22  ARG  33          HH12      ARG  33  91.754  -2.716  -7.543
  266    H    GLN  34           HN       GLN  34  84.265  -2.201 -12.415
  267    HA   GLN  34           HA       GLN  34  86.403  -1.652 -14.342
  268    HB2  GLN  34           HB2      GLN  34  85.476  -4.063 -14.742
  269    HB3  GLN  34           HB1      GLN  34  84.060  -3.234 -15.388
  270    HG2  GLN  34           HG2      GLN  34  85.467  -3.580 -17.271
  271    HG3  GLN  34           HG1      GLN  34  85.712  -1.889 -16.831
  272   HE21  GLN  34          HE21      GLN  34  87.752  -1.312 -15.766
  273   HE22  GLN  34          HE22      GLN  34  89.086  -2.361 -15.803
  274    H    THR  35           HN       THR  35  83.996  -1.610 -16.362
  275    HA   THR  35           HA       THR  35  82.650   0.118 -17.202
  276    HB   THR  35           HB       THR  35  80.955   0.945 -15.657
  277    HG1  THR  35           HG1      THR  35  81.188   0.534 -13.441
  278   HG21  THR  35          HG21      THR  35  80.028  -1.147 -14.960
  279   HG22  THR  35          HG22      THR  35  81.624  -1.887 -14.835
  280   HG23  THR  35          HG23      THR  35  80.960  -1.486 -16.419
  281    H    ARG  36           HN       ARG  36  82.952   1.805 -14.135
  282    HA   ARG  36           HA       ARG  36  84.403   3.981 -15.566
  283    HE   ARG  36           HE       ARG  36  82.649   3.763 -16.994
  284    HB2  ARG  36           HB2      ARG  36  82.863   3.962 -12.956
  285    HB3  ARG  36           HB1      ARG  36  83.702   5.370 -13.602
  286    HG2  ARG  36           HG2      ARG  36  81.544   3.854 -15.096
  287    HG3  ARG  36           HG1      ARG  36  81.252   5.322 -14.163
  288    HD2  ARG  36           HD2      ARG  36  81.634   6.300 -16.208
  289    HD3  ARG  36           HD1      ARG  36  83.306   6.191 -15.660
  290   HH11  ARG  36          HH21      ARG  36  83.075   7.138 -17.555
  291   HH12  ARG  36          HH22      ARG  36  83.604   6.935 -19.192
  292   HH21  ARG  36          HH11      ARG  36  83.338   3.478 -19.129
  293   HH22  ARG  36          HH12      ARG  36  83.753   4.863 -20.083
  294    H    GLN  37           HN       GLN  37  85.192   1.365 -13.763
  295    HA   GLN  37           HA       GLN  37  87.080   0.780 -12.508
  296    HB2  GLN  37           HB2      GLN  37  88.197   1.995 -14.433
  297    HB3  GLN  37           HB1      GLN  37  88.217   3.436 -13.416
  298    HG2  GLN  37           HG2      GLN  37  89.559   2.303 -11.740
  299    HG3  GLN  37           HG1      GLN  37  89.432   0.777 -12.617
  300   HE21  GLN  37          HE21      GLN  37  91.629   3.138 -12.048
  301   HE22  GLN  37          HE22      GLN  37  92.476   3.131 -13.519
  302    H1U  RCY  38           H1U      RCY  38  82.560   6.818  -4.791
  303    H1S  RCY  38           H1S      RCY  38  84.039   6.912  -8.773
  304    HB1  RCY  38           HB1      RCY  38  85.483   4.762  -8.382
  305    HB2  RCY  38           HB2      RCY  38  85.233   3.351  -9.408
  306    HA   RCY  38           HA       RCY  38  87.021   5.656 -10.210
  307    HN1  RCY  38           HN1      RCY  38  87.082   4.338 -12.144
  308    H    LYS  39           HN       LYS  39  88.875   5.853  -9.107
  309    HA   LYS  39           HA       LYS  39  90.755   4.033  -8.363
  310    HB2  LYS  39           HB2      LYS  39  89.804   6.445  -6.803
  311    HB3  LYS  39           HB1      LYS  39  91.241   5.527  -6.357
  312    HG2  LYS  39           HG2      LYS  39  91.945   7.382  -7.747
  313    HG3  LYS  39           HG1      LYS  39  92.117   5.900  -8.688
  314    HD2  LYS  39           HD2      LYS  39  90.267   6.376 -10.029
  315    HD3  LYS  39           HD1      LYS  39  89.547   7.448  -8.827
  316    HE2  LYS  39           HE2      LYS  39  91.305   9.114  -9.232
  317    HE3  LYS  39           HE1      LYS  39  92.071   8.039 -10.402
  318    HZ1  LYS  39           HZ1      LYS  39  89.241   8.712 -10.760
  319    HZ2  LYS  39           HZ2      LYS  39  90.427   8.364 -11.925
  320    HZ3  LYS  39           HZ3      LYS  39  90.401   9.882 -11.163
  321    H    SER  40           HN       SER  40  90.922   2.341  -6.976
  322    HA   SER  40           HA       SER  40  88.736   1.147  -5.694
  323    HG   SER  40           HG       SER  40  91.756   1.173  -3.612
  324    HB2  SER  40           HB2      SER  40  90.342  -0.190  -4.463
  325    HB3  SER  40           HB1      SER  40  90.986   0.085  -6.079
  326    H    LYS  41           HN       LYS  41  91.223   3.243  -4.194
  327    HA   LYS  41           HA       LYS  41  89.819   3.366  -1.667
  328    HB2  LYS  41           HB2      LYS  41  91.413   5.433  -1.394
  329    HB3  LYS  41           HB1      LYS  41  92.109   3.814  -1.458
  330    HG2  LYS  41           HG2      LYS  41  92.759   4.066  -3.731
  331    HG3  LYS  41           HG1      LYS  41  91.740   5.489  -3.945
  332    HD2  LYS  41           HD2      LYS  41  93.161   6.711  -2.299
  333    HD3  LYS  41           HD1      LYS  41  94.218   5.302  -2.206
  334    HE2  LYS  41           HE2      LYS  41  93.721   7.111  -4.572
  335    HE3  LYS  41           HE1      LYS  41  95.258   6.715  -3.801
  336    HZ1  LYS  41           HZ1      LYS  41  93.534   4.858  -5.350
  337    HZ2  LYS  41           HZ2      LYS  41  94.958   4.412  -4.538
  338    HZ3  LYS  41           HZ3      LYS  41  95.026   5.495  -5.846
  339    HA   PRO  42           HA       PRO  42  86.914   6.415  -3.244
  340    HB2  PRO  42           HB2      PRO  42  85.418   6.724  -0.995
  341    HB3  PRO  42           HB1      PRO  42  85.306   5.282  -2.023
  342    HG2  PRO  42           HG2      PRO  42  86.748   5.650   0.554
  343    HG3  PRO  42           HG1      PRO  42  85.824   4.258  -0.036
  344    HD2  PRO  42           HD2      PRO  42  88.582   4.407  -0.102
  345    HD3  PRO  42           HD1      PRO  42  87.618   3.398  -1.202
  346    HA   PRO  43           HA       PRO  43  88.663  10.233  -1.738
  347    HB2  PRO  43           HB2      PRO  43  86.834  12.014  -2.663
  348    HB3  PRO  43           HB1      PRO  43  87.923  11.127  -3.748
  349    HG2  PRO  43           HG2      PRO  43  85.062  10.601  -3.114
  350    HG3  PRO  43           HG1      PRO  43  85.911  10.506  -4.666
  351    HD2  PRO  43           HD2      PRO  43  85.327   8.303  -3.117
  352    HD3  PRO  43           HD1      PRO  43  86.684   8.369  -4.262
  353    H    LYS  44           HN       LYS  44  88.147  12.114  -0.288
  354    HA   LYS  44           HA       LYS  44  86.563  11.261   1.988
  355    HB2  LYS  44           HB2      LYS  44  87.722  14.005   1.410
  356    HB3  LYS  44           HB1      LYS  44  87.212  13.392   2.982
  357    HG2  LYS  44           HG2      LYS  44  89.332  11.994   1.346
  358    HG3  LYS  44           HG1      LYS  44  89.732  13.295   2.469
  359    HD2  LYS  44           HD2      LYS  44  88.464  11.981   4.246
  360    HD3  LYS  44           HD1      LYS  44  88.439  10.635   3.106
  361    HE2  LYS  44           HE2      LYS  44  90.919  10.732   2.972
  362    HE3  LYS  44           HE1      LYS  44  90.915  12.023   4.174
  363    HZ1  LYS  44           HZ1      LYS  44  89.481  10.269   5.476
  364    HZ2  LYS  44           HZ2      LYS  44  91.179  10.233   5.523
  365    HZ3  LYS  44           HZ3      LYS  44  90.332   9.175   4.498
  366    H    LYS  45           HN       LYS  45  85.523  14.001   2.545
  367    HA   LYS  45           HA       LYS  45  83.008  13.717   1.010
  368    HB2  LYS  45           HB2      LYS  45  83.804  15.383   3.409
  369    HB3  LYS  45           HB1      LYS  45  82.239  15.544   2.611
  370    HG2  LYS  45           HG2      LYS  45  81.629  13.300   3.128
  371    HG3  LYS  45           HG1      LYS  45  83.279  12.880   3.588
  372    HD2  LYS  45           HD2      LYS  45  81.794  13.235   5.564
  373    HD3  LYS  45           HD1      LYS  45  83.157  14.354   5.528
  374    HE2  LYS  45           HE2      LYS  45  81.807  16.158   4.808
  375    HE3  LYS  45           HE1      LYS  45  80.494  15.089   4.315
  376    HZ1  LYS  45           HZ1      LYS  45  80.905  16.307   6.806
  377    HZ2  LYS  45           HZ2      LYS  45  81.015  14.625   7.017
  378    HZ3  LYS  45           HZ3      LYS  45  79.623  15.307   6.321
  379    H    GLY  46           HN       GLY  46  83.946  14.482  -1.034
  380    HA2  GLY  46           HA2      GLY  46  84.680  17.365  -1.082
  381    HA3  GLY  46           HA1      GLY  46  84.959  16.220  -2.395
  382    H    VAL  47           HN       VAL  47  83.814  17.228  -4.037
  383    HA   VAL  47           HA       VAL  47  80.861  17.273  -3.711
  384    HB   VAL  47           HB       VAL  47  82.211  19.586  -5.084
  385   HG11  VAL  47          HG11      VAL  47  79.754  19.161  -5.301
  386   HG12  VAL  47          HG12      VAL  47  80.118  20.705  -4.531
  387   HG13  VAL  47          HG13      VAL  47  79.606  19.331  -3.551
  388   HG21  VAL  47          HG21      VAL  47  83.248  19.632  -2.913
  389   HG22  VAL  47          HG22      VAL  47  81.726  19.240  -2.112
  390   HG23  VAL  47          HG23      VAL  47  81.943  20.817  -2.873
  391    H    GLN  48           HN       GLN  48  82.667  15.483  -5.116
  392    HA   GLN  48           HA       GLN  48  83.036  15.957  -7.842
  393    HB2  GLN  48           HB2      GLN  48  82.384  13.489  -6.258
  394    HB3  GLN  48           HB1      GLN  48  82.397  13.394  -8.019
  395    HG2  GLN  48           HG2      GLN  48  84.612  12.852  -6.915
  396    HG3  GLN  48           HG1      GLN  48  84.684  14.138  -8.120
  397   HE21  GLN  48          HE21      GLN  48  85.978  15.822  -7.387
  398   HE22  GLN  48          HE22      GLN  48  86.056  16.369  -5.782
  399    H    GLY  49           HN       GLY  49  81.604  14.756  -9.604
  400    HA2  GLY  49           HA2      GLY  49  79.022  16.102  -9.565
  401    HA3  GLY  49           HA1      GLY  49  79.636  15.084 -10.867
  402    H1U  RCY  50           H1U      RCY  50  79.457   6.489  -2.040
  403    H1S  RCY  50           H1S      RCY  50  79.593   8.826  -5.400
  404    HB1  RCY  50           HB1      RCY  50  80.074  11.590  -6.886
  405    HB2  RCY  50           HB2      RCY  50  79.319  10.216  -7.690
  406    HA   RCY  50           HA       RCY  50  77.827  11.544  -8.764
  407    HN1  RCY  50           HN1      RCY  50  79.984  13.345  -8.058
  408    H    GLY  51           HN       GLY  51  78.120  14.289  -6.662
  409    HA2  GLY  51           HA2      GLY  51  76.262  15.448  -5.695
  410    HA3  GLY  51           HA1      GLY  51  75.263  14.017  -5.958
  411    H    ASP  52           HN       ASP  52  77.316  15.670  -3.725
  412    HA   ASP  52           HA       ASP  52  77.050  13.404  -1.781
  413    HB2  ASP  52           HB2      ASP  52  79.095  15.621  -2.024
  414    HB3  ASP  52           HB1      ASP  52  78.933  14.635  -0.570
  415    H    ASP  53           HN       ASP  53  74.864  15.146  -2.222
  416    HA   ASP  53           HA       ASP  53  74.595  16.272   0.484
  417    HB2  ASP  53           HB2      ASP  53  75.550  18.178  -0.694
  418    HB3  ASP  53           HB1      ASP  53  74.382  17.996  -2.003
  419    H    ILE  54           HN       ILE  54  73.252  15.322  -2.597
  420    HA   ILE  54           HA       ILE  54  70.492  15.853  -1.840
  421    HB   ILE  54           HB       ILE  54  70.063  14.299  -3.868
  422   HG12  ILE  54          HG12      ILE  54  73.012  14.805  -4.318
  423   HG13  ILE  54          HG11      ILE  54  72.412  13.297  -3.628
  424   HG21  ILE  54          HG21      ILE  54  69.957  16.750  -3.997
  425   HG22  ILE  54          HG22      ILE  54  70.729  16.099  -5.442
  426   HG23  ILE  54          HG23      ILE  54  71.710  16.829  -4.172
  427   HD11  ILE  54          HD11      ILE  54  71.643  14.459  -6.322
  428   HD12  ILE  54          HD12      ILE  54  70.958  12.991  -5.623
  429   HD13  ILE  54          HD13      ILE  54  72.668  13.050  -6.051
  430    HA   PRO  55           HA       PRO  55  70.086  12.098   0.551
  431    HB2  PRO  55           HB2      PRO  55  67.387  12.079   0.869
  432    HB3  PRO  55           HB1      PRO  55  68.431  13.249   1.700
  433    HG2  PRO  55           HG2      PRO  55  66.771  13.617  -0.746
  434    HG3  PRO  55           HG1      PRO  55  67.021  14.713   0.624
  435    HD2  PRO  55           HD2      PRO  55  68.337  14.974  -1.780
  436    HD3  PRO  55           HD1      PRO  55  68.999  15.547  -0.233
  437    H    GLY  56           HN       GLY  56  70.382  11.673  -2.285
  438    HA2  GLY  56           HA2      GLY  56  69.872  10.097  -3.953
  439    HA3  GLY  56           HA1      GLY  56  69.418   9.053  -2.605
  440    H    MET  57           HN       MET  57  68.117  11.808  -4.482
  441    HA   MET  57           HA       MET  57  65.385  11.326  -3.740
  442    HB2  MET  57           HB2      MET  57  64.852  12.776  -5.704
  443    HB3  MET  57           HB1      MET  57  66.066  13.485  -4.640
  444    HG2  MET  57           HG2      MET  57  67.392  13.691  -6.457
  445    HG3  MET  57           HG1      MET  57  67.543  11.934  -6.443
  446    HE1  MET  57           HE1      MET  57  66.571  14.866  -8.779
  447    HE2  MET  57           HE2      MET  57  65.565  14.920  -7.333
  448    HE3  MET  57           HE3      MET  57  64.825  14.617  -8.903
  449    H    GLU  58           HN       GLU  58  65.660   8.870  -4.086
  450    HA   GLU  58           HA       GLU  58  65.083   8.153  -6.938
  451    HB2  GLU  58           HB2      GLU  58  66.278   6.564  -4.657
  452    HB3  GLU  58           HB1      GLU  58  65.694   5.805  -6.138
  453    HG2  GLU  58           HG2      GLU  58  67.213   7.296  -7.449
  454    HG3  GLU  58           HG1      GLU  58  67.857   7.920  -5.930
  455    H    GLY  59           HN       GLY  59  64.357   6.707  -3.745
  456    HA2  GLY  59           HA2      GLY  59  61.602   7.165  -3.660
  457    HA3  GLY  59           HA1      GLY  59  61.797   5.715  -4.645
  458    H1U  RCY  60           H1U      RCY  60  70.990   4.868  -1.761
  459    H1S  RCY  60           H1S      RCY  60  67.354   3.580  -4.110
  460    HB1  RCY  60           HB1      RCY  60  65.436   3.035  -0.285
  461    HB2  RCY  60           HB2      RCY  60  65.936   4.599  -0.927
  462    HA   RCY  60           HA       RCY  60  63.194   3.326  -1.154
  463    HN1  RCY  60           HN1      RCY  60  64.350   5.216  -2.953
  464    H    GLY  61           HN       GLY  61  65.383   5.707   0.240
  465    HA2  GLY  61           HA2      GLY  61  63.914   7.542   1.551
  466    HA3  GLY  61           HA1      GLY  61  63.463   6.094   2.450
  467    H    THR  62           HN       THR  62  66.082   8.317   1.734
  468    HA   THR  62           HA       THR  62  68.037   6.872   3.356
  469    HB   THR  62           HB       THR  62  69.535   8.598   2.807
  470    HG1  THR  62           HG1      THR  62  67.243  10.127   2.996
  471   HG21  THR  62          HG21      THR  62  68.614   7.421   0.793
  472   HG22  THR  62          HG22      THR  62  69.202   9.047   0.447
  473   HG23  THR  62          HG23      THR  62  67.470   8.749   0.594
  474    H    ASP  63           HN       ASP  63  67.133   6.648   5.430
  475    HA   ASP  63           HA       ASP  63  65.874   8.827   6.838
  476    HB2  ASP  63           HB2      ASP  63  65.657   6.291   7.276
  477    HB3  ASP  63           HB1      ASP  63  67.170   6.448   8.169
  478    H    ILE  64           HN       ILE  64  69.152   8.163   6.160
  479    HA   ILE  64           HA       ILE  64  69.961  10.076   8.309
  480    HB   ILE  64           HB       ILE  64  71.138   7.437   7.566
  481   HG12  ILE  64          HG12      ILE  64  71.026   9.015  10.156
  482   HG13  ILE  64          HG11      ILE  64  69.828   7.819   9.660
  483   HG21  ILE  64          HG21      ILE  64  72.976   8.887   6.999
  484   HG22  ILE  64          HG22      ILE  64  73.314   8.225   8.598
  485   HG23  ILE  64          HG23      ILE  64  72.712   9.875   8.435
  486   HD11  ILE  64          HD11      ILE  64  71.391   6.038   9.785
  487   HD12  ILE  64          HD12      ILE  64  71.702   7.005  11.227
  488   HD13  ILE  64          HD13      ILE  64  72.766   7.142   9.827
  489    H    THR  65           HN       THR  65  70.135   9.131   5.000
  490    HA   THR  65           HA       THR  65  70.839  10.478   3.189
  491    HB   THR  65           HB       THR  65  72.509  12.255   4.919
  492    HG1  THR  65           HG1      THR  65  70.857  13.067   5.938
  493   HG21  THR  65          HG21      THR  65  72.121  12.413   2.370
  494   HG22  THR  65          HG22      THR  65  71.928  13.890   3.314
  495   HG23  THR  65          HG23      THR  65  70.507  12.989   2.786
  496    H    VAL  66           HN       VAL  66  73.309  10.146   5.774
  497    HA   VAL  66           HA       VAL  66  75.285   9.421   3.694
  498    HB   VAL  66           HB       VAL  66  76.831   9.221   5.768
  499   HG11  VAL  66          HG11      VAL  66  76.850  11.113   4.169
  500   HG12  VAL  66          HG12      VAL  66  77.145  11.661   5.819
  501   HG13  VAL  66          HG13      VAL  66  75.558  11.889   5.085
  502   HG21  VAL  66          HG21      VAL  66  75.975  10.619   7.693
  503   HG22  VAL  66          HG22      VAL  66  75.143   9.076   7.497
  504   HG23  VAL  66          HG23      VAL  66  74.380  10.566   6.942
  505    H    ILE  67           HN       ILE  67  74.264   7.921   6.823
  506    HA   ILE  67           HA       ILE  67  74.386   5.298   5.410
  507    HB   ILE  67           HB       ILE  67  75.665   5.970   8.071
  508   HG12  ILE  67          HG12      ILE  67  76.852   4.758   5.559
  509   HG13  ILE  67          HG11      ILE  67  76.906   6.484   5.920
  510   HG21  ILE  67          HG21      ILE  67  74.974   3.345   6.762
  511   HG22  ILE  67          HG22      ILE  67  74.726   3.841   8.436
  512   HG23  ILE  67          HG23      ILE  67  76.350   3.470   7.858
  513   HD11  ILE  67          HD11      ILE  67  78.094   6.016   8.026
  514   HD12  ILE  67          HD12      ILE  67  78.980   5.357   6.651
  515   HD13  ILE  67          HD13      ILE  67  78.031   4.287   7.683
  516    H1U  RCY  68           H1U      RCY  68  71.549   3.197  -0.465
  517    H1S  RCY  68           H1S      RCY  68  71.883   4.488   3.369
  518    HB1  RCY  68           HB1      RCY  68  68.751   5.257   6.337
  519    HB2  RCY  68           HB2      RCY  68  69.407   3.718   5.780
  520    HA   RCY  68           HA       RCY  68  70.474   5.578   7.783
  521    HN1  RCY  68           HN1      RCY  68  72.079   5.273   5.417
  522    HA   PRO  69           HA       PRO  69  71.089   1.813   9.993
  523    HB2  PRO  69           HB2      PRO  69  68.435   0.999  10.407
  524    HB3  PRO  69           HB1      PRO  69  69.339   2.134  11.425
  525    HG2  PRO  69           HG2      PRO  69  67.348   2.680   9.299
  526    HG3  PRO  69           HG1      PRO  69  67.662   3.550  10.809
  527    HD2  PRO  69           HD2      PRO  69  68.485   4.511   8.409
  528    HD3  PRO  69           HD1      PRO  69  69.424   4.774   9.897
  529    H    TRP  70           HN       TRP  70  68.952   1.712   7.193
  530    HA   TRP  70           HA       TRP  70  68.887  -1.176   6.984
  531    HD1  TRP  70           HD1      TRP  70  67.455  -2.665   5.913
  532    HE1  TRP  70           HE1      TRP  70  67.269  -4.129   3.801
  533    HE3  TRP  70           HE3      TRP  70  68.568   0.804   2.335
  534    HZ2  TRP  70           HZ2      TRP  70  67.555  -3.864   0.963
  535    HZ3  TRP  70           HZ3      TRP  70  68.605   0.174  -0.058
  536    HH2  TRP  70           HH2      TRP  70  68.101  -2.151  -0.750
  537    HB2  TRP  70           HB2      TRP  70  67.219   0.309   5.876
  538    HB3  TRP  70           HB1      TRP  70  68.491   0.905   4.810
  539    H    GLU  71           HN       GLU  71  71.483  -0.602   7.514
  540    HA   GLU  71           HA       GLU  71  72.848  -1.215   4.926
  541    HB2  GLU  71           HB2      GLU  71  73.379   0.959   6.876
  542    HB3  GLU  71           HB1      GLU  71  74.807   0.077   6.331
  543    HG2  GLU  71           HG2      GLU  71  72.755   1.071   4.357
  544    HG3  GLU  71           HG1      GLU  71  74.044   2.127   4.935
  545    H    ALA  72           HN       ALA  72  72.716  -1.565   8.431
  546    HA   ALA  72           HA       ALA  72  75.018  -3.301   8.645
  547    HB1  ALA  72           HB1      ALA  72  74.083  -2.105  10.592
  548    HB2  ALA  72           HB2      ALA  72  74.106  -3.845  10.875
  549    HB3  ALA  72           HB3      ALA  72  72.595  -3.041  10.453
  550    H1U  RCY  73           H1U      RCY  73  76.934  -3.329   5.294
  551    H1S  RCY  73           H1S      RCY  73  74.176  -6.528   4.941
  552    HB1  RCY  73           HB1      RCY  73  71.511  -4.674   5.202
  553    HB2  RCY  73           HB2      RCY  73  70.448  -6.015   5.621
  554    HA   RCY  73           HA       RCY  73  71.698  -6.428   7.451
  555    HN1  RCY  73           HN1      RCY  73  72.996  -3.970   6.549
  556    H    ASN  74           HN       ASN  74  74.549  -5.588   5.500
  557    HA   ASN  74           HA       ASN  74  76.313  -6.939   4.728
  558    HB2  ASN  74           HB2      ASN  74  75.658  -8.601   7.174
  559    HB3  ASN  74           HB1      ASN  74  77.219  -8.457   6.365
  560   HD21  ASN  74          HD21      ASN  74  77.758  -7.781   8.772
  561   HD22  ASN  74          HD22      ASN  74  77.640  -6.123   9.115
  562    H    HIS  75           HN       HIS  75  76.099  -9.945   5.700
  563    HA   HIS  75           HA       HIS  75  75.495 -11.940   4.619
  564    HD1  HIS  75           HD1      HIS  75  74.786 -13.345   3.223
  565    HD2  HIS  75           HD2      HIS  75  70.770 -12.436   3.891
  566    HE1  HIS  75           HE1      HIS  75  73.443 -15.186   2.118
  567    HE2  HIS  75           HE2      HIS  75  70.996 -14.645   2.517
  568    HB2  HIS  75           HB2      HIS  75  73.313 -11.391   5.613
  569    HB3  HIS  75           HB1      HIS  75  72.921 -10.381   4.222
  570    H1U  RCY  76           H1U      RCY  76  80.113  -5.388   2.082
  571    H1S  RCY  76           H1S      RCY  76  79.255  -8.401  -0.634
  572    HB1  RCY  76           HB1      RCY  76  76.974  -9.097   1.152
  573    HB2  RCY  76           HB2      RCY  76  75.469  -9.440   0.303
  574    HA   RCY  76           HA       RCY  76  75.874 -11.765   0.268
  575    HN1  RCY  76           HN1      RCY  76  77.007 -11.664   2.873
  576    H    GLU  77           HN       GLU  77  77.637 -11.828  -1.399
  577    HA   GLU  77           HA       GLU  77  79.854 -13.383  -0.431
  578    HB2  GLU  77           HB2      GLU  77  78.679 -13.383  -2.770
  579    HB3  GLU  77           HB1      GLU  77  79.825 -12.099  -3.153
  580    HG2  GLU  77           HG2      GLU  77  81.703 -13.556  -2.567
  581    HG3  GLU  77           HG1      GLU  77  80.587 -14.835  -2.088
  582    H    LEU  78           HN       LEU  78  79.924 -10.886   0.891
  583    HA   LEU  78           HA       LEU  78  82.667 -10.147   0.448
  584    HG   LEU  78           HG       LEU  78  79.582  -8.382   0.308
  585    HB2  LEU  78           HB2      LEU  78  82.429  -7.912  -0.400
  586    HB3  LEU  78           HB1      LEU  78  81.538  -8.976  -1.485
  587   HD11  LEU  78          HD11      LEU  78  81.293  -6.805   1.412
  588   HD12  LEU  78          HD12      LEU  78  79.710  -6.124   1.035
  589   HD13  LEU  78          HD13      LEU  78  81.089  -5.783  -0.011
  590   HD21  LEU  78          HD21      LEU  78  80.381  -6.690  -2.083
  591   HD22  LEU  78          HD22      LEU  78  78.768  -6.775  -1.376
  592   HD23  LEU  78          HD23      LEU  78  79.462  -8.193  -2.160
  593    H    HIS  79           HN       HIS  79  83.437  -9.345   2.357
  594    HA   HIS  79           HA       HIS  79  82.086  -7.546   4.080
  595    HD1  HIS  79           HD1      HIS  79  83.651 -11.075   4.314
  596    HD2  HIS  79           HD2      HIS  79  79.522 -11.643   4.157
  597    HE1  HIS  79           HE1      HIS  79  83.286 -13.455   3.529
  598    HE2  HIS  79           HE2      HIS  79  80.776 -13.814   3.430
  599    HB2  HIS  79           HB2      HIS  79  81.663  -9.388   5.929
  600    HB3  HIS  79           HB1      HIS  79  80.439  -9.072   4.700
  601    H    GLU  80           HN       GLU  80  84.427  -6.983   3.861
  602    HA   GLU  80           HA       GLU  80  86.308  -8.700   5.357
  603    HB2  GLU  80           HB2      GLU  80  86.689  -6.033   3.959
  604    HB3  GLU  80           HB1      GLU  80  87.981  -6.978   4.701
  605    HG2  GLU  80           HG2      GLU  80  86.164  -8.142   2.587
  606    HG3  GLU  80           HG1      GLU  80  87.649  -7.283   2.174
  607    H    LEU  81           HN       LEU  81  86.238  -5.173   5.525
  608    HA   LEU  81           HA       LEU  81  86.190  -5.397   8.494
  609    HG   LEU  81           HG       LEU  81  86.642  -3.497   5.490
  610    HB2  LEU  81           HB2      LEU  81  86.688  -2.752   8.005
  611    HB3  LEU  81           HB1      LEU  81  87.949  -3.973   8.158
  612   HD11  LEU  81          HD11      LEU  81  87.332  -1.277   6.152
  613   HD12  LEU  81          HD12      LEU  81  88.535  -1.895   5.021
  614   HD13  LEU  81          HD13      LEU  81  88.876  -1.884   6.751
  615   HD21  LEU  81          HD21      LEU  81  89.540  -4.074   5.924
  616   HD22  LEU  81          HD22      LEU  81  88.455  -4.664   4.665
  617   HD23  LEU  81          HD23      LEU  81  88.394  -5.366   6.282
  618    H    ALA  82           HN       ALA  82  83.805  -5.606   6.666
  619    HA   ALA  82           HA       ALA  82  82.175  -3.350   6.577
  620    HB1  ALA  82           HB1      ALA  82  80.261  -4.871   6.717
  621    HB2  ALA  82           HB2      ALA  82  81.289  -6.132   7.399
  622    HB3  ALA  82           HB3      ALA  82  81.529  -5.602   5.734
  623    H    GLN  83           HN       GLN  83  82.672  -2.012   8.406
  624    HA   GLN  83           HA       GLN  83  81.038  -2.651  10.775
  625    HB2  GLN  83           HB2      GLN  83  84.038  -2.256  10.881
  626    HB3  GLN  83           HB1      GLN  83  82.995  -2.085  12.291
  627    HG2  GLN  83           HG2      GLN  83  82.138  -4.418  11.832
  628    HG3  GLN  83           HG1      GLN  83  83.394  -4.568  10.603
  629   HE21  GLN  83          HE21      GLN  83  84.744  -2.582  12.878
  630   HE22  GLN  83          HE22      GLN  83  85.512  -3.739  13.854
  631    H    TYR  84           HN       TYR  84  83.631  -0.369   9.800
  632    HA   TYR  84           HA       TYR  84  81.724   1.857   9.749
  633    HD1  TYR  84           HD1      TYR  84  80.294   2.487  12.010
  634    HD2  TYR  84           HD2      TYR  84  83.613   0.008  13.144
  635    HE1  TYR  84           HE1      TYR  84  78.835   1.259  13.596
  636    HE2  TYR  84           HE2      TYR  84  82.155  -1.220  14.730
  637    HH   TYR  84           HH       TYR  84  79.235  -1.510  14.692
  638    HB2  TYR  84           HB2      TYR  84  83.971   1.921  11.775
  639    HB3  TYR  84           HB1      TYR  84  82.707   3.129  11.549
  640    H    GLY  85           HN       GLY  85  82.785   1.623   7.529
  641    HA2  GLY  85           HA2      GLY  85  84.506   3.706   6.934
  642    HA3  GLY  85           HA1      GLY  85  85.592   2.364   7.295
  643    H    ILE  86           HN       ILE  86  84.573   0.200   6.176
  644    HA   ILE  86           HA       ILE  86  84.836   0.721   3.331
  645    HB   ILE  86           HB       ILE  86  85.624  -1.376   4.543
  646   HG12  ILE  86          HG12      ILE  86  83.821  -1.605   2.115
  647   HG13  ILE  86          HG11      ILE  86  85.565  -1.340   2.122
  648   HG21  ILE  86          HG21      ILE  86  84.143  -2.762   5.545
  649   HG22  ILE  86          HG22      ILE  86  83.048  -2.709   4.163
  650   HG23  ILE  86          HG23      ILE  86  82.977  -1.447   5.393
  651   HD11  ILE  86          HD11      ILE  86  84.029  -3.840   2.756
  652   HD12  ILE  86          HD12      ILE  86  85.609  -3.585   3.497
  653   HD13  ILE  86          HD13      ILE  86  85.457  -3.637   1.740
  654    H1U  RCY  87           H1U      RCY  87  76.022  -7.491   3.783
  655    H1S  RCY  87           H1S      RCY  87  78.275  -4.366   2.108
  656    HB1  RCY  87           HB1      RCY  87  80.716  -2.796   2.826
  657    HB2  RCY  87           HB2      RCY  87  80.421  -2.072   1.248
  658    HA   RCY  87           HA       RCY  87  80.589   0.099   2.060
  659    HN1  RCY  87           HN1      RCY  87  82.579  -1.612   3.197
  Start of MODEL   57
    1    HA   MET   1           HA       MET   1  70.979 -14.709 -24.057
    2    HB2  MET   1           HB2      MET   1  68.610 -14.097 -25.078
    3    HB3  MET   1           HB1      MET   1  69.444 -12.631 -25.591
    4    HG2  MET   1           HG2      MET   1  70.276 -15.481 -26.213
    5    HG3  MET   1           HG1      MET   1  69.615 -14.311 -27.355
    6    HE1  MET   1           HE1      MET   1  70.419 -12.111 -27.659
    7    HE2  MET   1           HE2      MET   1  71.400 -12.850 -28.922
    8    HE3  MET   1           HE3      MET   1  72.118 -11.658 -27.840
    9    H    ASN   2           HN       ASN   2  70.135 -11.235 -23.816
   10    HA   ASN   2           HA       ASN   2  72.736 -10.399 -24.810
   11    HB2  ASN   2           HB2      ASN   2  70.515  -8.893 -23.400
   12    HB3  ASN   2           HB1      ASN   2  71.969  -8.126 -24.039
   13   HD21  ASN   2          HD21      ASN   2  70.855  -6.942 -25.722
   14   HD22  ASN   2          HD22      ASN   2  70.134  -7.722 -27.046
   15    H    LEU   3           HN       LEU   3  71.538  -9.005 -21.825
   16    HA   LEU   3           HA       LEU   3  74.036  -8.926 -20.538
   17    HG   LEU   3           HG       LEU   3  71.682  -6.642 -18.982
   18    HB2  LEU   3           HB2      LEU   3  71.206  -8.960 -19.497
   19    HB3  LEU   3           HB1      LEU   3  72.567  -8.926 -18.378
   20   HD11  LEU   3          HD11      LEU   3  73.793  -5.724 -18.855
   21   HD12  LEU   3          HD12      LEU   3  74.443  -6.786 -20.105
   22   HD13  LEU   3          HD13      LEU   3  74.201  -7.396 -18.468
   23   HD21  LEU   3          HD21      LEU   3  72.960  -7.192 -21.671
   24   HD22  LEU   3          HD22      LEU   3  72.019  -5.779 -21.193
   25   HD23  LEU   3          HD23      LEU   3  71.225  -7.340 -21.395
   26    H    GLU   4           HN       GLU   4  74.193 -10.190 -18.216
   27    HA   GLU   4           HA       GLU   4  74.726 -12.929 -18.938
   28    HB2  GLU   4           HB2      GLU   4  74.572 -11.703 -16.167
   29    HB3  GLU   4           HB1      GLU   4  75.369 -13.216 -16.596
   30    HG2  GLU   4           HG2      GLU   4  77.128 -11.629 -16.534
   31    HG3  GLU   4           HG1      GLU   4  76.759 -11.803 -18.250
   32    HA   PRO   5           HA       PRO   5  70.909 -15.108 -18.467
   33    HB2  PRO   5           HB2      PRO   5  72.402 -16.608 -16.335
   34    HB3  PRO   5           HB1      PRO   5  71.383 -17.235 -17.647
   35    HG2  PRO   5           HG2      PRO   5  74.065 -17.236 -17.782
   36    HG3  PRO   5           HG1      PRO   5  73.039 -17.038 -19.210
   37    HD2  PRO   5           HD2      PRO   5  74.784 -15.061 -17.904
   38    HD3  PRO   5           HD1      PRO   5  74.043 -15.010 -19.518
   39    HA   PRO   6           HA       PRO   6  69.724 -12.884 -14.632
   40    HB2  PRO   6           HB2      PRO   6  67.434 -11.787 -15.560
   41    HB3  PRO   6           HB1      PRO   6  69.027 -11.121 -15.973
   42    HG2  PRO   6           HG2      PRO   6  67.194 -12.780 -17.610
   43    HG3  PRO   6           HG1      PRO   6  68.286 -11.478 -18.103
   44    HD2  PRO   6           HD2      PRO   6  68.810 -14.229 -18.346
   45    HD3  PRO   6           HD1      PRO   6  70.016 -12.930 -18.462
   46    H    LYS   7           HN       LYS   7  67.770 -13.113 -13.207
   47    HA   LYS   7           HA       LYS   7  65.863 -15.246 -13.905
   48    HB2  LYS   7           HB2      LYS   7  66.432 -16.604 -11.907
   49    HB3  LYS   7           HB1      LYS   7  67.775 -16.529 -13.047
   50    HG2  LYS   7           HG2      LYS   7  68.670 -14.575 -11.689
   51    HG3  LYS   7           HG1      LYS   7  67.453 -14.967 -10.474
   52    HD2  LYS   7           HD2      LYS   7  68.376 -17.208 -10.210
   53    HD3  LYS   7           HD1      LYS   7  69.531 -16.917 -11.511
   54    HE2  LYS   7           HE2      LYS   7  70.632 -15.181 -10.220
   55    HE3  LYS   7           HE1      LYS   7  69.404 -15.287  -8.958
   56    HZ1  LYS   7           HZ1      LYS   7  70.146 -17.376  -8.305
   57    HZ2  LYS   7           HZ2      LYS   7  71.585 -16.523  -8.600
   58    HZ3  LYS   7           HZ3      LYS   7  71.007 -17.640  -9.742
   59    H    ALA   8           HN       ALA   8  65.427 -15.581 -10.904
   60    HA   ALA   8           HA       ALA   8  63.288 -13.854 -10.511
   61    HB1  ALA   8           HB1      ALA   8  65.221 -15.007  -8.487
   62    HB2  ALA   8           HB2      ALA   8  63.642 -15.641  -8.950
   63    HB3  ALA   8           HB3      ALA   8  63.754 -14.142  -8.027
   64    H    GLU   9           HN       GLU   9  66.602 -13.008 -10.619
   65    HA   GLU   9           HA       GLU   9  66.530 -10.695  -8.897
   66    HB2  GLU   9           HB2      GLU   9  68.327 -11.467 -11.210
   67    HB3  GLU   9           HB1      GLU   9  68.573 -10.012 -10.243
   68    HG2  GLU   9           HG2      GLU   9  68.769 -11.369  -8.209
   69    HG3  GLU   9           HG1      GLU   9  68.465 -12.835  -9.141
   70    H1U  RCY  10           H1U      RCY  10  64.418  -6.412  -5.529
   71    H1S  RCY  10           H1S      RCY  10  63.149  -9.696  -8.128
   72    HB1  RCY  10           HB1      RCY  10  62.491  -9.878 -12.354
   73    HB2  RCY  10           HB2      RCY  10  61.980  -8.239 -11.950
   74    HA   RCY  10           HA       RCY  10  64.494  -8.625 -12.438
   75    HN1  RCY  10           HN1      RCY  10  64.259 -10.141  -9.906
   76    H    ARG  11           HN       ARG  11  62.138  -7.221 -10.525
   77    HA   ARG  11           HA       ARG  11  63.932  -5.278  -9.207
   78    HE   ARG  11           HE       ARG  11  62.447  -1.778 -12.239
   79    HB2  ARG  11           HB2      ARG  11  61.969  -4.486 -11.382
   80    HB3  ARG  11           HB1      ARG  11  62.814  -3.352 -10.328
   81    HG2  ARG  11           HG2      ARG  11  64.983  -4.460 -11.145
   82    HG3  ARG  11           HG1      ARG  11  63.997  -5.197 -12.408
   83    HD2  ARG  11           HD2      ARG  11  64.731  -2.329 -12.008
   84    HD3  ARG  11           HD1      ARG  11  64.613  -3.259 -13.502
   85   HH11  ARG  11          HH21      ARG  11  63.348  -4.466 -14.200
   86   HH12  ARG  11          HH22      ARG  11  61.826  -4.545 -15.024
   87   HH21  ARG  11          HH11      ARG  11  60.455  -1.865 -13.303
   88   HH22  ARG  11          HH12      ARG  11  60.188  -3.073 -14.515
   89    H    SER  12           HN       SER  12  61.808  -7.265  -8.451
   90    HA   SER  12           HA       SER  12  60.435  -5.593  -6.525
   91    HG   SER  12           HG       SER  12  58.363  -5.138  -6.406
   92    HB2  SER  12           HB2      SER  12  59.127  -5.243  -8.702
   93    HB3  SER  12           HB1      SER  12  58.649  -6.933  -8.565
   94    H    ALA  13           HN       ALA  13  59.045  -6.939  -5.086
   95    HA   ALA  13           HA       ALA  13  58.876  -9.788  -5.384
   96    HB1  ALA  13           HB1      ALA  13  60.520 -10.322  -3.502
   97    HB2  ALA  13           HB2      ALA  13  61.169  -8.699  -3.739
   98    HB3  ALA  13           HB3      ALA  13  61.242  -9.877  -5.049
   99    H    THR  14           HN       THR  14  57.105  -7.734  -4.594
  100    HA   THR  14           HA       THR  14  55.441  -7.396  -2.987
  101    HB   THR  14           HB       THR  14  56.277 -10.063  -2.620
  102    HG1  THR  14           HG1      THR  14  54.196 -10.052  -2.583
  103   HG21  THR  14          HG21      THR  14  55.848  -8.771   0.079
  104   HG22  THR  14          HG22      THR  14  57.457  -9.106  -0.562
  105   HG23  THR  14          HG23      THR  14  56.333 -10.432  -0.265
  106    H    ARG  15           HN       ARG  15  58.577  -6.720  -2.642
  107    HA   ARG  15           HA       ARG  15  59.723  -5.236  -1.231
  108    HE   ARG  15           HE       ARG  15  60.410  -1.377   0.391
  109    HB2  ARG  15           HB2      ARG  15  57.320  -4.177  -1.230
  110    HB3  ARG  15           HB1      ARG  15  57.216  -4.852   0.395
  111    HG2  ARG  15           HG2      ARG  15  58.130  -2.780   0.885
  112    HG3  ARG  15           HG1      ARG  15  59.607  -3.716   0.651
  113    HD2  ARG  15           HD2      ARG  15  59.706  -2.975  -1.702
  114    HD3  ARG  15           HD1      ARG  15  58.234  -2.033  -1.467
  115   HH11  ARG  15          HH21      ARG  15  58.821  -0.802  -2.614
  116   HH12  ARG  15          HH22      ARG  15  59.420   0.815  -2.774
  117   HH21  ARG  15          HH11      ARG  15  61.201   0.732   0.200
  118   HH22  ARG  15          HH12      ARG  15  60.767   1.684  -1.180
  119    H    VAL  16           HN       VAL  16  60.933  -5.525   0.644
  120    HA   VAL  16           HA       VAL  16  60.116  -7.829   2.373
  121    HB   VAL  16           HB       VAL  16  62.553  -8.020   2.879
  122   HG11  VAL  16          HG11      VAL  16  61.412  -9.255   0.981
  123   HG12  VAL  16          HG12      VAL  16  63.150  -9.033   0.777
  124   HG13  VAL  16          HG13      VAL  16  62.020  -8.004  -0.103
  125   HG21  VAL  16          HG21      VAL  16  62.752  -5.839   0.777
  126   HG22  VAL  16          HG22      VAL  16  64.122  -6.742   1.424
  127   HG23  VAL  16          HG23      VAL  16  63.185  -5.685   2.480
  128    H    MET  17           HN       MET  17  60.804  -4.446   2.324
  129    HA   MET  17           HA       MET  17  61.723  -3.942   4.926
  130    HB2  MET  17           HB2      MET  17  61.054  -2.326   2.921
  131    HB3  MET  17           HB1      MET  17  59.541  -2.205   3.817
  132    HG2  MET  17           HG2      MET  17  60.875  -0.454   4.693
  133    HG3  MET  17           HG1      MET  17  61.017  -1.746   5.886
  134    HE1  MET  17           HE1      MET  17  62.958  -0.468   6.811
  135    HE2  MET  17           HE2      MET  17  63.118   0.746   5.544
  136    HE3  MET  17           HE3      MET  17  64.522  -0.202   6.031
  137    H    GLY  18           HN       GLY  18  60.493  -3.300   6.873
  138    HA2  GLY  18           HA2      GLY  18  58.488  -3.319   8.224
  139    HA3  GLY  18           HA1      GLY  18  57.719  -4.354   7.020
  140    H    GLY  19           HN       GLY  19  57.270  -5.453   9.281
  141    HA2  GLY  19           HA2      GLY  19  57.602  -7.395  10.558
  142    HA3  GLY  19           HA1      GLY  19  58.795  -7.885   9.353
  143    HA   PRO  20           HA       PRO  20  61.109  -7.303  13.344
  144    HB2  PRO  20           HB2      PRO  20  62.999  -8.926  11.687
  145    HB3  PRO  20           HB1      PRO  20  62.531  -9.126  13.387
  146    HG2  PRO  20           HG2      PRO  20  61.584 -10.730  11.486
  147    HG3  PRO  20           HG1      PRO  20  60.583 -10.227  12.859
  148    HD2  PRO  20           HD2      PRO  20  60.469  -9.318  10.015
  149    HD3  PRO  20           HD1      PRO  20  59.159  -9.462  11.209
  150    H1U  RCY  21           H1U      RCY  21  66.949  -1.733   5.242
  151    H1S  RCY  21           H1S      RCY  21  67.075  -4.336   8.454
  152    HB1  RCY  21           HB1      RCY  21  63.758  -4.545   8.224
  153    HB2  RCY  21           HB2      RCY  21  63.318  -6.191   8.671
  154    HA   RCY  21           HA       RCY  21  63.743  -4.455  10.999
  155    HN1  RCY  21           HN1      RCY  21  61.336  -6.075  10.285
  156    H    THR  22           HN       THR  22  62.510  -2.630  11.565
  157    HA   THR  22           HA       THR  22  60.725  -1.536   9.427
  158    HB   THR  22           HB       THR  22  59.747  -0.173  11.342
  159    HG1  THR  22           HG1      THR  22  60.469  -1.938  13.223
  160   HG21  THR  22          HG21      THR  22  58.543  -2.089  10.489
  161   HG22  THR  22          HG22      THR  22  58.469  -2.140  12.250
  162   HG23  THR  22          HG23      THR  22  59.584  -3.197  11.384
  163    HA   PRO  23           HA       PRO  23  63.531   1.781   8.554
  164    HB2  PRO  23           HB2      PRO  23  61.154   3.536   9.065
  165    HB3  PRO  23           HB1      PRO  23  62.282   3.538   7.695
  166    HG2  PRO  23           HG2      PRO  23  59.832   2.459   7.532
  167    HG3  PRO  23           HG1      PRO  23  61.218   1.813   6.640
  168    HD2  PRO  23           HD2      PRO  23  59.783   0.645   8.945
  169    HD3  PRO  23           HD1      PRO  23  60.827  -0.151   7.748
  170    H    ARG  24           HN       ARG  24  64.838   3.179   9.760
  171    HA   ARG  24           HA       ARG  24  64.247   3.345  12.653
  172    HE   ARG  24           HE       ARG  24  67.478   2.022  15.742
  173    HB2  ARG  24           HB2      ARG  24  66.649   3.522  10.934
  174    HB3  ARG  24           HB1      ARG  24  66.649   4.646  12.291
  175    HG2  ARG  24           HG2      ARG  24  66.085   1.680  12.557
  176    HG3  ARG  24           HG1      ARG  24  67.667   2.410  12.833
  177    HD2  ARG  24           HD2      ARG  24  65.819   3.963  14.305
  178    HD3  ARG  24           HD1      ARG  24  65.405   2.278  14.620
  179   HH11  ARG  24          HH21      ARG  24  67.289   4.947  13.926
  180   HH12  ARG  24          HH22      ARG  24  68.748   5.607  14.586
  181   HH21  ARG  24          HH11      ARG  24  69.384   2.867  16.614
  182   HH22  ARG  24          HH12      ARG  24  69.934   4.430  16.108
  183    H    LYS  25           HN       LYS  25  62.818   4.965  10.514
  184    HA   LYS  25           HA       LYS  25  63.487   7.597  10.310
  185    HB2  LYS  25           HB2      LYS  25  61.055   6.065  10.225
  186    HB3  LYS  25           HB1      LYS  25  60.731   7.570  11.082
  187    HG2  LYS  25           HG2      LYS  25  62.144   7.417   8.404
  188    HG3  LYS  25           HG1      LYS  25  60.421   7.747   8.595
  189    HD2  LYS  25           HD2      LYS  25  60.795   9.825   9.601
  190    HD3  LYS  25           HD1      LYS  25  62.431   9.397  10.104
  191    HE2  LYS  25           HE2      LYS  25  63.144   9.404   7.725
  192    HE3  LYS  25           HE1      LYS  25  61.518   9.899   7.256
  193    HZ1  LYS  25           HZ1      LYS  25  62.222  11.969   7.553
  194    HZ2  LYS  25           HZ2      LYS  25  63.653  11.467   8.319
  195    HZ3  LYS  25           HZ3      LYS  25  62.226  11.657   9.220
  196    H    GLY  26           HN       GLY  26  63.703   9.330  11.663
  197    HA2  GLY  26           HA2      GLY  26  62.404   9.654  14.183
  198    HA3  GLY  26           HA1      GLY  26  64.019   8.995  14.462
  199    HA   PRO  27           HA       PRO  27  65.237  13.335  14.674
  200    HB2  PRO  27           HB2      PRO  27  67.880  12.103  13.985
  201    HB3  PRO  27           HB1      PRO  27  67.476  13.252  15.275
  202    HG2  PRO  27           HG2      PRO  27  67.889  10.654  15.762
  203    HG3  PRO  27           HG1      PRO  27  66.726  11.618  16.685
  204    HD2  PRO  27           HD2      PRO  27  66.218   9.507  14.660
  205    HD3  PRO  27           HD1      PRO  27  65.180  10.071  15.988
  206    HA   PRO  28           HA       PRO  28  65.611  14.957  10.570
  207    HB2  PRO  28           HB2      PRO  28  68.505  15.616  10.989
  208    HB3  PRO  28           HB1      PRO  28  67.188  16.648  10.395
  209    HG2  PRO  28           HG2      PRO  28  68.116  16.869  12.881
  210    HG3  PRO  28           HG1      PRO  28  66.395  17.077  12.512
  211    HD2  PRO  28           HD2      PRO  28  67.766  14.798  13.864
  212    HD3  PRO  28           HD1      PRO  28  66.101  15.391  14.058
  213    H    LYS  29           HN       LYS  29  66.565  14.503   8.420
  214    HA   LYS  29           HA       LYS  29  67.069  11.860   7.821
  215    HB2  LYS  29           HB2      LYS  29  68.647  13.955   6.345
  216    HB3  LYS  29           HB1      LYS  29  67.793  12.552   5.705
  217    HG2  LYS  29           HG2      LYS  29  66.531  15.063   6.844
  218    HG3  LYS  29           HG1      LYS  29  66.530  14.561   5.153
  219    HD2  LYS  29           HD2      LYS  29  65.298  12.485   5.825
  220    HD3  LYS  29           HD1      LYS  29  65.193  13.126   7.465
  221    HE2  LYS  29           HE2      LYS  29  64.146  14.570   5.014
  222    HE3  LYS  29           HE1      LYS  29  63.147  13.579   6.078
  223    HZ1  LYS  29           HZ1      LYS  29  63.209  15.106   7.713
  224    HZ2  LYS  29           HZ2      LYS  29  63.512  16.180   6.431
  225    HZ3  LYS  29           HZ3      LYS  29  64.799  15.590   7.371
  226    H1U  RCY  30           H1U      RCY  30  76.519  13.382   5.301
  227    H1S  RCY  30           H1S      RCY  30  73.414  14.211   7.950
  228    HB1  RCY  30           HB1      RCY  30  71.445  11.910   7.337
  229    HB2  RCY  30           HB2      RCY  30  72.685  10.934   8.118
  230    HA   RCY  30           HA       RCY  30  70.862   9.643   8.654
  231    HN1  RCY  30           HN1      RCY  30  68.679  10.450   8.263
  232    H    LYS  31           HN       LYS  31  71.735   9.053  10.601
  233    HA   LYS  31           HA       LYS  31  70.497   9.919  13.017
  234    HB2  LYS  31           HB2      LYS  31  73.051   8.377  12.486
  235    HB3  LYS  31           HB1      LYS  31  72.444   8.676  14.108
  236    HG2  LYS  31           HG2      LYS  31  71.612   6.518  13.437
  237    HG3  LYS  31           HG1      LYS  31  70.250   7.638  13.376
  238    HD2  LYS  31           HD2      LYS  31  70.335   6.212  11.354
  239    HD3  LYS  31           HD1      LYS  31  70.567   7.914  10.952
  240    HE2  LYS  31           HE2      LYS  31  72.787   7.628  10.409
  241    HE3  LYS  31           HE1      LYS  31  73.006   6.308  11.557
  242    HZ1  LYS  31           HZ1      LYS  31  72.978   5.742   9.088
  243    HZ2  LYS  31           HZ2      LYS  31  71.300   5.997   9.167
  244    HZ3  LYS  31           HZ3      LYS  31  72.025   4.790  10.119
  245    H    GLN  32           HN       GLN  32  73.287  10.029  14.396
  246    HA   GLN  32           HA       GLN  32  74.224  12.701  13.581
  247    HB2  GLN  32           HB2      GLN  32  73.946  13.552  15.952
  248    HB3  GLN  32           HB1      GLN  32  72.438  13.355  15.059
  249    HG2  GLN  32           HG2      GLN  32  73.511  11.113  16.762
  250    HG3  GLN  32           HG1      GLN  32  72.563  12.414  17.484
  251   HE21  GLN  32          HE21      GLN  32  70.639  12.912  15.516
  252   HE22  GLN  32          HE22      GLN  32  69.694  11.524  15.268
  253    H    ARG  33           HN       ARG  33  74.781   9.635  14.753
  254    HA   ARG  33           HA       ARG  33  76.795   9.811  16.668
  255    HE   ARG  33           HE       ARG  33  74.559   6.186  18.406
  256    HB2  ARG  33           HB2      ARG  33  76.971   8.020  14.232
  257    HB3  ARG  33           HB1      ARG  33  77.649   7.719  15.832
  258    HG2  ARG  33           HG2      ARG  33  74.709   7.854  15.106
  259    HG3  ARG  33           HG1      ARG  33  75.607   6.424  15.614
  260    HD2  ARG  33           HD2      ARG  33  76.150   7.791  17.754
  261    HD3  ARG  33           HD1      ARG  33  74.811   8.824  17.254
  262   HH11  ARG  33          HH21      ARG  33  73.272   8.399  16.097
  263   HH12  ARG  33          HH22      ARG  33  71.669   7.748  16.168
  264   HH21  ARG  33          HH11      ARG  33  72.472   5.323  18.512
  265   HH22  ARG  33          HH12      ARG  33  71.216   6.006  17.536
  266    H    GLN  34           HN       GLN  34  77.855   9.213  13.356
  267    HA   GLN  34           HA       GLN  34  79.328  11.663  13.058
  268    HB2  GLN  34           HB2      GLN  34  80.538  10.156  14.921
  269    HB3  GLN  34           HB1      GLN  34  81.229   9.391  13.491
  270    HG2  GLN  34           HG2      GLN  34  81.895  11.671  12.671
  271    HG3  GLN  34           HG1      GLN  34  81.350  12.333  14.213
  272   HE21  GLN  34          HE21      GLN  34  82.943   9.165  13.898
  273   HE22  GLN  34          HE22      GLN  34  84.356   9.605  14.729
  274    H    THR  35           HN       THR  35  77.663  10.333  11.329
  275    HA   THR  35           HA       THR  35  78.913   8.468   9.570
  276    HB   THR  35           HB       THR  35  77.184   9.201   7.927
  277    HG1  THR  35           HG1      THR  35  76.611  11.103   9.951
  278   HG21  THR  35          HG21      THR  35  76.388   8.714  10.800
  279   HG22  THR  35          HG22      THR  35  76.459   7.551   9.476
  280   HG23  THR  35          HG23      THR  35  75.199   8.785   9.499
  281    H    ARG  36           HN       ARG  36  79.571  11.766  10.104
  282    HA   ARG  36           HA       ARG  36  80.604  12.246   7.379
  283    HE   ARG  36           HE       ARG  36  81.881  16.701   9.617
  284    HB2  ARG  36           HB2      ARG  36  81.212  14.471   8.254
  285    HB3  ARG  36           HB1      ARG  36  79.524  14.097   8.604
  286    HG2  ARG  36           HG2      ARG  36  80.185  13.346  10.881
  287    HG3  ARG  36           HG1      ARG  36  81.851  13.807  10.528
  288    HD2  ARG  36           HD2      ARG  36  79.438  15.575  10.863
  289    HD3  ARG  36           HD1      ARG  36  81.018  15.704  11.634
  290   HH11  ARG  36          HH21      ARG  36  78.575  15.737   9.467
  291   HH12  ARG  36          HH22      ARG  36  78.234  16.654   8.038
  292   HH21  ARG  36          HH11      ARG  36  81.456  17.904   7.752
  293   HH22  ARG  36          HH12      ARG  36  79.865  17.881   7.067
  294    H    GLN  37           HN       GLN  37  81.695  10.653  10.091
  295    HA   GLN  37           HA       GLN  37  84.414  11.548  10.262
  296    HB2  GLN  37           HB2      GLN  37  82.936   9.831  11.732
  297    HB3  GLN  37           HB1      GLN  37  83.814   8.663  10.749
  298    HG2  GLN  37           HG2      GLN  37  84.974  10.790  12.563
  299    HG3  GLN  37           HG1      GLN  37  85.158   9.041  12.698
  300   HE21  GLN  37          HE21      GLN  37  86.990  11.602  11.940
  301   HE22  GLN  37          HE22      GLN  37  87.954  10.958  10.700
  302    H1U  RCY  38           H1U      RCY  38  85.909   3.872   5.544
  303    H1S  RCY  38           H1S      RCY  38  86.330   7.990   5.951
  304    HB1  RCY  38           HB1      RCY  38  87.096  11.324   5.907
  305    HB2  RCY  38           HB2      RCY  38  85.361  11.374   6.215
  306    HA   RCY  38           HA       RCY  38  85.961   8.834   7.039
  307    HN1  RCY  38           HN1      RCY  38  86.167  11.064   8.987
  308    H    LYS  39           HN       LYS  39  87.636   7.757   8.153
  309    HA   LYS  39           HA       LYS  39  90.327   8.819   7.636
  310    HB2  LYS  39           HB2      LYS  39  89.124   9.313  10.127
  311    HB3  LYS  39           HB1      LYS  39  90.194   7.949  10.426
  312    HG2  LYS  39           HG2      LYS  39  91.051  10.488   9.008
  313    HG3  LYS  39           HG1      LYS  39  91.310  10.183  10.726
  314    HD2  LYS  39           HD2      LYS  39  92.248   8.212   8.647
  315    HD3  LYS  39           HD1      LYS  39  93.239   9.602   9.092
  316    HE2  LYS  39           HE2      LYS  39  93.839   8.660  11.055
  317    HE3  LYS  39           HE1      LYS  39  92.173   8.224  11.434
  318    HZ1  LYS  39           HZ1      LYS  39  93.510   6.702   9.334
  319    HZ2  LYS  39           HZ2      LYS  39  92.389   6.189  10.502
  320    HZ3  LYS  39           HZ3      LYS  39  94.017   6.421  10.928
  321    H    SER  40           HN       SER  40  91.431   6.902   9.659
  322    HA   SER  40           HA       SER  40  92.272   4.708   9.522
  323    HG   SER  40           HG       SER  40  90.563   2.157   9.169
  324    HB2  SER  40           HB2      SER  40  89.906   4.495  10.522
  325    HB3  SER  40           HB1      SER  40  89.412   3.945   8.924
  326    H    LYS  41           HN       LYS  41  91.271   2.518   7.948
  327    HA   LYS  41           HA       LYS  41  91.391   3.517   5.158
  328    HB2  LYS  41           HB2      LYS  41  93.155   1.712   4.691
  329    HB3  LYS  41           HB1      LYS  41  93.712   3.157   5.532
  330    HG2  LYS  41           HG2      LYS  41  92.699   0.959   7.255
  331    HG3  LYS  41           HG1      LYS  41  94.225   0.652   6.423
  332    HD2  LYS  41           HD2      LYS  41  93.822   3.270   7.837
  333    HD3  LYS  41           HD1      LYS  41  94.241   1.836   8.774
  334    HE2  LYS  41           HE2      LYS  41  96.303   1.564   7.670
  335    HE3  LYS  41           HE1      LYS  41  95.810   2.573   6.310
  336    HZ1  LYS  41           HZ1      LYS  41  96.731   3.362   8.976
  337    HZ2  LYS  41           HZ2      LYS  41  95.602   4.359   8.191
  338    HZ3  LYS  41           HZ3      LYS  41  97.102   4.032   7.462
  339    HA   PRO  42           HA       PRO  42  88.466   0.212   4.677
  340    HB2  PRO  42           HB2      PRO  42  88.607  -0.132   1.960
  341    HB3  PRO  42           HB1      PRO  42  87.796   1.250   2.723
  342    HG2  PRO  42           HG2      PRO  42  90.499   1.094   1.489
  343    HG3  PRO  42           HG1      PRO  42  89.295   2.392   1.416
  344    HD2  PRO  42           HD2      PRO  42  91.478   2.477   3.071
  345    HD3  PRO  42           HD1      PRO  42  89.944   3.292   3.447
  346    HA   PRO  43           HA       PRO  43  90.513  -3.700   4.638
  347    HB2  PRO  43           HB2      PRO  43  88.828  -5.181   2.951
  348    HB3  PRO  43           HB1      PRO  43  88.586  -4.930   4.689
  349    HG2  PRO  43           HG2      PRO  43  87.329  -3.547   2.388
  350    HG3  PRO  43           HG1      PRO  43  86.647  -3.972   3.968
  351    HD2  PRO  43           HD2      PRO  43  87.382  -1.431   3.369
  352    HD3  PRO  43           HD1      PRO  43  87.544  -2.091   5.014
  353    H    LYS  44           HN       LYS  44  91.946  -4.984   3.356
  354    HA   LYS  44           HA       LYS  44  93.355  -5.439   1.543
  355    HB2  LYS  44           HB2      LYS  44  90.988  -5.776   0.490
  356    HB3  LYS  44           HB1      LYS  44  91.294  -4.231  -0.299
  357    HG2  LYS  44           HG2      LYS  44  93.291  -5.083  -1.355
  358    HG3  LYS  44           HG1      LYS  44  93.209  -6.577  -0.419
  359    HD2  LYS  44           HD2      LYS  44  91.055  -5.682  -2.355
  360    HD3  LYS  44           HD1      LYS  44  92.349  -6.804  -2.776
  361    HE2  LYS  44           HE2      LYS  44  91.496  -8.018  -0.548
  362    HE3  LYS  44           HE1      LYS  44  89.993  -7.211  -0.991
  363    HZ1  LYS  44           HZ1      LYS  44  90.036  -9.338  -2.030
  364    HZ2  LYS  44           HZ2      LYS  44  91.587  -9.068  -2.667
  365    HZ3  LYS  44           HZ3      LYS  44  90.262  -8.173  -3.242
  366    H    LYS  45           HN       LYS  45  92.685  -3.331  -0.856
  367    HA   LYS  45           HA       LYS  45  94.301  -1.118   0.349
  368    HB2  LYS  45           HB2      LYS  45  95.558  -0.949  -1.771
  369    HB3  LYS  45           HB1      LYS  45  95.778  -2.530  -1.022
  370    HG2  LYS  45           HG2      LYS  45  93.655  -3.134  -2.520
  371    HG3  LYS  45           HG1      LYS  45  94.268  -1.799  -3.497
  372    HD2  LYS  45           HD2      LYS  45  95.855  -4.236  -2.634
  373    HD3  LYS  45           HD1      LYS  45  95.231  -3.933  -4.257
  374    HE2  LYS  45           HE2      LYS  45  96.582  -1.821  -4.320
  375    HE3  LYS  45           HE1      LYS  45  97.290  -2.277  -2.770
  376    HZ1  LYS  45           HZ1      LYS  45  98.633  -2.931  -4.729
  377    HZ2  LYS  45           HZ2      LYS  45  97.381  -3.979  -5.199
  378    HZ3  LYS  45           HZ3      LYS  45  98.203  -4.236  -3.735
  379    H    GLY  46           HN       GLY  46  91.766  -0.574   0.407
  380    HA2  GLY  46           HA2      GLY  46  90.831   0.524  -2.173
  381    HA3  GLY  46           HA1      GLY  46  89.909   0.493  -0.669
  382    H    VAL  47           HN       VAL  47  93.215   1.636  -0.746
  383    HA   VAL  47           HA       VAL  47  94.120   3.735  -0.240
  384    HB   VAL  47           HB       VAL  47  91.645   4.668  -1.727
  385   HG11  VAL  47          HG11      VAL  47  94.184   6.069  -0.863
  386   HG12  VAL  47          HG12      VAL  47  92.519   6.534  -0.512
  387   HG13  VAL  47          HG13      VAL  47  93.151   6.688  -2.152
  388   HG21  VAL  47          HG21      VAL  47  94.488   4.352  -2.726
  389   HG22  VAL  47          HG22      VAL  47  93.046   4.690  -3.683
  390   HG23  VAL  47          HG23      VAL  47  93.254   3.108  -2.931
  391    H    GLN  48           HN       GLN  48  93.919   5.471   1.291
  392    HA   GLN  48           HA       GLN  48  92.411   4.954   3.593
  393    HB2  GLN  48           HB2      GLN  48  94.246   6.525   3.677
  394    HB3  GLN  48           HB1      GLN  48  93.447   7.595   2.524
  395    HG2  GLN  48           HG2      GLN  48  91.788   8.231   4.084
  396    HG3  GLN  48           HG1      GLN  48  92.139   6.865   5.143
  397   HE21  GLN  48          HE21      GLN  48  92.665  10.170   4.815
  398   HE22  GLN  48          HE22      GLN  48  94.050  10.313   5.787
  399    H    GLY  49           HN       GLY  49  90.351   5.525   4.295
  400    HA2  GLY  49           HA2      GLY  49  88.574   7.424   3.689
  401    HA3  GLY  49           HA1      GLY  49  88.500   6.494   2.192
  402    H1U  RCY  50           H1U      RCY  50  80.098   3.798   4.791
  403    H1S  RCY  50           H1S      RCY  50  84.333   3.355   6.526
  404    HB1  RCY  50           HB1      RCY  50  88.126   2.558   5.965
  405    HB2  RCY  50           HB2      RCY  50  87.402   2.866   4.387
  406    HA   RCY  50           HA       RCY  50  85.893   4.562   5.610
  407    HN1  RCY  50           HN1      RCY  50  88.517   5.754   5.709
  408    H    GLY  51           HN       GLY  51  86.758   6.416   7.337
  409    HA2  GLY  51           HA2      GLY  51  88.139   5.766   9.657
  410    HA3  GLY  51           HA1      GLY  51  86.727   6.823   9.658
  411    H    ASP  52           HN       ASP  52  84.723   5.011   8.941
  412    HA   ASP  52           HA       ASP  52  83.250   3.520  10.004
  413    HB2  ASP  52           HB2      ASP  52  84.869   1.890   9.121
  414    HB3  ASP  52           HB1      ASP  52  85.873   2.096  10.557
  415    H    ASP  53           HN       ASP  53  85.845   2.725  12.243
  416    HA   ASP  53           HA       ASP  53  86.058   3.101  14.547
  417    HB2  ASP  53           HB2      ASP  53  84.163   5.428  14.344
  418    HB3  ASP  53           HB1      ASP  53  85.601   5.248  15.349
  419    H    ILE  54           HN       ILE  54  82.719   4.229  13.906
  420    HA   ILE  54           HA       ILE  54  81.774   2.310  15.976
  421    HB   ILE  54           HB       ILE  54  80.167   4.487  14.630
  422   HG12  ILE  54          HG12      ILE  54  82.101   5.582  15.587
  423   HG13  ILE  54          HG11      ILE  54  80.746   5.839  16.686
  424   HG21  ILE  54          HG21      ILE  54  79.930   3.006  17.268
  425   HG22  ILE  54          HG22      ILE  54  78.875   2.822  15.866
  426   HG23  ILE  54          HG23      ILE  54  78.887   4.337  16.769
  427   HD11  ILE  54          HD11      ILE  54  83.072   3.943  16.990
  428   HD12  ILE  54          HD12      ILE  54  81.573   3.701  17.888
  429   HD13  ILE  54          HD13      ILE  54  82.508   5.179  18.114
  430    HA   PRO  55           HA       PRO  55  80.332   0.067  12.287
  431    HB2  PRO  55           HB2      PRO  55  80.138  -2.379  13.425
  432    HB3  PRO  55           HB1      PRO  55  81.706  -1.671  12.985
  433    HG2  PRO  55           HG2      PRO  55  80.416  -1.878  15.655
  434    HG3  PRO  55           HG1      PRO  55  82.121  -2.041  15.207
  435    HD2  PRO  55           HD2      PRO  55  80.981   0.255  16.305
  436    HD3  PRO  55           HD1      PRO  55  82.505   0.215  15.392
  437    H    GLY  56           HN       GLY  56  78.302   1.453  12.731
  438    HA2  GLY  56           HA2      GLY  56  76.094  -0.370  13.549
  439    HA3  GLY  56           HA1      GLY  56  76.165   1.247  14.253
  440    H    MET  57           HN       MET  57  75.452   2.991  13.027
  441    HA   MET  57           HA       MET  57  74.148   4.002  11.344
  442    HB2  MET  57           HB2      MET  57  76.190   2.423   9.760
  443    HB3  MET  57           HB1      MET  57  75.081   3.578   9.020
  444    HG2  MET  57           HG2      MET  57  77.160   4.731   9.481
  445    HG3  MET  57           HG1      MET  57  75.945   5.322  10.615
  446    HE1  MET  57           HE1      MET  57  78.869   5.595  12.879
  447    HE2  MET  57           HE2      MET  57  77.140   5.884  13.056
  448    HE3  MET  57           HE3      MET  57  77.949   6.312  11.550
  449    H    GLU  58           HN       GLU  58  72.354   2.492  12.121
  450    HA   GLU  58           HA       GLU  58  71.662   0.043  10.984
  451    HB2  GLU  58           HB2      GLU  58  69.833   2.369  11.655
  452    HB3  GLU  58           HB1      GLU  58  69.284   0.721  11.353
  453    HG2  GLU  58           HG2      GLU  58  71.318   1.430  13.481
  454    HG3  GLU  58           HG1      GLU  58  69.589   1.291  13.799
  455    H    GLY  59           HN       GLY  59  70.436   3.185   9.768
  456    HA2  GLY  59           HA2      GLY  59  71.107   3.000   7.097
  457    HA3  GLY  59           HA1      GLY  59  69.669   1.984   7.225
  458    H1U  RCY  60           H1U      RCY  60  74.852   4.737   4.351
  459    H1S  RCY  60           H1S      RCY  60  71.652   6.829   6.314
  460    HB1  RCY  60           HB1      RCY  60  70.226   7.446   8.235
  461    HB2  RCY  60           HB2      RCY  60  68.638   8.125   7.867
  462    HA   RCY  60           HA       RCY  60  68.488   6.469   9.690
  463    HN1  RCY  60           HN1      RCY  60  70.036   4.703   9.353
  464    H    GLY  61           HN       GLY  61  66.962   7.752   7.594
  465    HA2  GLY  61           HA2      GLY  61  64.914   5.644   7.047
  466    HA3  GLY  61           HA1      GLY  61  64.478   7.282   7.547
  467    H    THR  62           HN       THR  62  63.268   7.329   5.499
  468    HA   THR  62           HA       THR  62  63.089   7.565   3.128
  469    HB   THR  62           HB       THR  62  63.226   9.835   3.979
  470    HG1  THR  62           HG1      THR  62  65.031   9.593   1.811
  471   HG21  THR  62          HG21      THR  62  65.225   9.707   5.317
  472   HG22  THR  62          HG22      THR  62  65.494  10.943   4.089
  473   HG23  THR  62          HG23      THR  62  66.212   9.343   3.902
  474    H    ASP  63           HN       ASP  63  65.116   5.581   3.750
  475    HA   ASP  63           HA       ASP  63  67.531   6.133   2.275
  476    HB2  ASP  63           HB2      ASP  63  67.759   3.600   2.303
  477    HB3  ASP  63           HB1      ASP  63  67.582   4.354   3.888
  478    H    ILE  64           HN       ILE  64  64.323   5.219   1.349
  479    HA   ILE  64           HA       ILE  64  65.243   5.047  -1.485
  480    HB   ILE  64           HB       ILE  64  64.930   2.742  -0.876
  481   HG12  ILE  64          HG12      ILE  64  62.240   3.368  -2.047
  482   HG13  ILE  64          HG11      ILE  64  63.685   3.808  -2.957
  483   HG21  ILE  64          HG21      ILE  64  62.290   3.650   0.312
  484   HG22  ILE  64          HG22      ILE  64  63.698   3.086   1.212
  485   HG23  ILE  64          HG23      ILE  64  62.809   1.970   0.176
  486   HD11  ILE  64          HD11      ILE  64  63.373   1.044  -1.795
  487   HD12  ILE  64          HD12      ILE  64  64.411   1.571  -3.120
  488   HD13  ILE  64          HD13      ILE  64  62.668   1.454  -3.359
  489    H    THR  65           HN       THR  65  63.790   7.039   0.350
  490    HA   THR  65           HA       THR  65  61.076   7.303  -0.260
  491    HB   THR  65           HB       THR  65  63.229   9.431  -0.085
  492    HG1  THR  65           HG1      THR  65  62.943   8.819   1.909
  493   HG21  THR  65          HG21      THR  65  60.237   9.672  -0.418
  494   HG22  THR  65          HG22      THR  65  61.505  10.460  -1.357
  495   HG23  THR  65          HG23      THR  65  61.204  10.956   0.308
  496    H    VAL  66           HN       VAL  66  63.715   7.232  -2.404
  497    HA   VAL  66           HA       VAL  66  61.915   7.775  -4.676
  498    HB   VAL  66           HB       VAL  66  64.030   9.179  -5.587
  499   HG11  VAL  66          HG11      VAL  66  62.783  11.226  -4.922
  500   HG12  VAL  66          HG12      VAL  66  61.819  10.255  -3.810
  501   HG13  VAL  66          HG13      VAL  66  61.711   9.973  -5.547
  502   HG21  VAL  66          HG21      VAL  66  65.113   8.813  -3.276
  503   HG22  VAL  66          HG22      VAL  66  63.922   9.963  -2.669
  504   HG23  VAL  66          HG23      VAL  66  65.090  10.466  -3.890
  505    H    ILE  67           HN       ILE  67  65.476   7.530  -4.312
  506    HA   ILE  67           HA       ILE  67  65.355   4.929  -5.761
  507    HB   ILE  67           HB       ILE  67  66.958   7.378  -6.518
  508   HG12  ILE  67          HG12      ILE  67  65.317   5.497  -8.231
  509   HG13  ILE  67          HG11      ILE  67  64.619   6.913  -7.444
  510   HG21  ILE  67          HG21      ILE  67  67.900   5.659  -8.270
  511   HG22  ILE  67          HG22      ILE  67  67.479   4.465  -7.042
  512   HG23  ILE  67          HG23      ILE  67  68.627   5.749  -6.665
  513   HD11  ILE  67          HD11      ILE  67  65.429   7.239  -9.855
  514   HD12  ILE  67          HD12      ILE  67  67.065   7.102  -9.209
  515   HD13  ILE  67          HD13      ILE  67  66.010   8.408  -8.668
  516    H1U  RCY  68           H1U      RCY  68  71.832   2.842  -6.357
  517    H1S  RCY  68           H1S      RCY  68  69.785   0.113  -3.263
  518    HB1  RCY  68           HB1      RCY  68  66.599   2.152  -2.543
  519    HB2  RCY  68           HB2      RCY  68  67.090   3.043  -1.104
  520    HA   RCY  68           HA       RCY  68  68.282   4.592  -2.308
  521    HN1  RCY  68           HN1      RCY  68  66.059   3.720  -3.953
  522    HA   PRO  69           HA       PRO  69  71.540   3.858  -5.291
  523    HB2  PRO  69           HB2      PRO  69  73.005   3.050  -2.805
  524    HB3  PRO  69           HB1      PRO  69  73.513   4.141  -4.109
  525    HG2  PRO  69           HG2      PRO  69  72.632   5.047  -1.742
  526    HG3  PRO  69           HG1      PRO  69  72.355   5.917  -3.258
  527    HD2  PRO  69           HD2      PRO  69  70.414   4.461  -1.567
  528    HD3  PRO  69           HD1      PRO  69  70.123   5.722  -2.784
  529    H    TRP  70           HN       TRP  70  70.774   1.480  -2.764
  530    HA   TRP  70           HA       TRP  70  72.111  -0.700  -4.186
  531    HD1  TRP  70           HD1      TRP  70  73.081  -2.775  -3.458
  532    HE1  TRP  70           HE1      TRP  70  72.500  -5.282  -3.322
  533    HE3  TRP  70           HE3      TRP  70  68.552  -2.503  -1.117
  534    HZ2  TRP  70           HZ2      TRP  70  70.388  -6.954  -2.348
  535    HZ3  TRP  70           HZ3      TRP  70  67.279  -4.561  -0.598
  536    HH2  TRP  70           HH2      TRP  70  68.188  -6.785  -1.208
  537    HB2  TRP  70           HB2      TRP  70  71.919  -0.706  -1.720
  538    HB3  TRP  70           HB1      TRP  70  70.163  -0.781  -1.863
  539    H    GLU  71           HN       GLU  71  69.040   0.817  -4.386
  540    HA   GLU  71           HA       GLU  71  67.674  -1.579  -5.416
  541    HB2  GLU  71           HB2      GLU  71  66.580   0.294  -4.036
  542    HB3  GLU  71           HB1      GLU  71  66.635   1.255  -5.514
  543    HG2  GLU  71           HG2      GLU  71  65.387  -1.501  -5.372
  544    HG3  GLU  71           HG1      GLU  71  64.469  -0.010  -5.162
  545    H    ALA  72           HN       ALA  72  67.918   1.700  -6.830
  546    HA   ALA  72           HA       ALA  72  67.595   0.675  -9.504
  547    HB1  ALA  72           HB1      ALA  72  66.967   2.988  -8.766
  548    HB2  ALA  72           HB2      ALA  72  67.949   2.954 -10.230
  549    HB3  ALA  72           HB3      ALA  72  68.685   3.378  -8.683
  550    H1U  RCY  73           H1U      RCY  73  77.003   4.619  -6.064
  551    H1S  RCY  73           H1S      RCY  73  74.586   5.453  -9.215
  552    HB1  RCY  73           HB1      RCY  73  73.950   2.479  -8.904
  553    HB2  RCY  73           HB2      RCY  73  72.656   2.827  -7.756
  554    HA   RCY  73           HA       RCY  73  72.099   1.816 -10.549
  555    HN1  RCY  73           HN1      RCY  73  70.354   2.715  -8.575
  556    H    ASN  74           HN       ASN  74  71.822  -0.454 -10.786
  557    HA   ASN  74           HA       ASN  74  72.140  -2.736 -10.281
  558    HB2  ASN  74           HB2      ASN  74  74.580  -1.253 -10.379
  559    HB3  ASN  74           HB1      ASN  74  74.765  -2.492  -9.139
  560   HD21  ASN  74          HD21      ASN  74  75.619  -4.374 -10.019
  561   HD22  ASN  74          HD22      ASN  74  75.272  -4.978 -11.567
  562    H    HIS  75           HN       HIS  75  73.633  -4.031  -8.362
  563    HA   HIS  75           HA       HIS  75  72.623  -3.075  -5.731
  564    HD1  HIS  75           HD1      HIS  75  71.025  -4.042  -8.744
  565    HD2  HIS  75           HD2      HIS  75  69.139  -4.553  -5.059
  566    HE1  HIS  75           HE1      HIS  75  68.641  -3.241  -9.044
  567    HE2  HIS  75           HE2      HIS  75  67.482  -3.548  -6.808
  568    HB2  HIS  75           HB2      HIS  75  72.164  -5.855  -6.867
  569    HB3  HIS  75           HB1      HIS  75  71.771  -5.350  -5.225
  570    H1U  RCY  76           H1U      RCY  76  77.397  -0.077  -0.949
  571    H1S  RCY  76           H1S      RCY  76  76.956  -3.420  -1.660
  572    HB1  RCY  76           HB1      RCY  76  77.121  -3.998  -4.656
  573    HB2  RCY  76           HB2      RCY  76  77.263  -4.531  -2.984
  574    HA   RCY  76           HA       RCY  76  76.052  -6.060  -4.770
  575    HN1  RCY  76           HN1      RCY  76  73.536  -4.805  -4.011
  576    H    GLU  77           HN       GLU  77  74.330  -7.576  -3.730
  577    HA   GLU  77           HA       GLU  77  73.963  -7.415  -0.861
  578    HB2  GLU  77           HB2      GLU  77  73.201  -9.844  -1.180
  579    HB3  GLU  77           HB1      GLU  77  72.297  -8.612  -2.061
  580    HG2  GLU  77           HG2      GLU  77  73.416  -9.114  -4.110
  581    HG3  GLU  77           HG1      GLU  77  74.635 -10.087  -3.287
  582    H    LEU  78           HN       LEU  78  76.496  -8.676  -2.897
  583    HA   LEU  78           HA       LEU  78  77.923  -9.549  -0.447
  584    HG   LEU  78           HG       LEU  78  79.297 -11.467  -0.424
  585    HB2  LEU  78           HB2      LEU  78  76.643 -11.467  -1.840
  586    HB3  LEU  78           HB1      LEU  78  78.131 -11.403  -2.780
  587   HD11  LEU  78          HD11      LEU  78  78.064 -12.466   1.330
  588   HD12  LEU  78          HD12      LEU  78  76.763 -12.963   0.247
  589   HD13  LEU  78          HD13      LEU  78  76.960 -11.261   0.666
  590   HD21  LEU  78          HD21      LEU  78  77.934 -13.834  -1.742
  591   HD22  LEU  78          HD22      LEU  78  79.173 -13.990  -0.497
  592   HD23  LEU  78          HD23      LEU  78  79.568 -13.243  -2.046
  593    H    HIS  79           HN       HIS  79  78.653 -10.068  -3.916
  594    HA   HIS  79           HA       HIS  79  81.344  -9.090  -3.609
  595    HD1  HIS  79           HD1      HIS  79  83.266 -10.345  -5.765
  596    HD2  HIS  79           HD2      HIS  79  79.736 -12.406  -4.931
  597    HE1  HIS  79           HE1      HIS  79  83.918 -12.766  -5.406
  598    HE2  HIS  79           HE2      HIS  79  81.778 -14.031  -4.898
  599    HB2  HIS  79           HB2      HIS  79  79.585  -9.728  -5.973
  600    HB3  HIS  79           HB1      HIS  79  81.149  -8.952  -6.219
  601    H    GLU  80           HN       GLU  80  80.427  -7.051  -2.420
  602    HA   GLU  80           HA       GLU  80  79.262  -4.966  -4.049
  603    HB2  GLU  80           HB2      GLU  80  79.843  -3.479  -2.130
  604    HB3  GLU  80           HB1      GLU  80  78.966  -4.923  -1.631
  605    HG2  GLU  80           HG2      GLU  80  81.955  -5.046  -1.691
  606    HG3  GLU  80           HG1      GLU  80  81.187  -4.167  -0.368
  607    H    LEU  81           HN       LEU  81  82.234  -6.319  -4.256
  608    HA   LEU  81           HA       LEU  81  83.671  -3.771  -4.795
  609    HG   LEU  81           HG       LEU  81  83.762  -6.071  -2.684
  610    HB2  LEU  81           HB2      LEU  81  84.760  -6.595  -4.927
  611    HB3  LEU  81           HB1      LEU  81  85.680  -5.094  -4.819
  612   HD11  LEU  81          HD11      LEU  81  85.831  -6.582  -1.400
  613   HD12  LEU  81          HD12      LEU  81  86.790  -6.199  -2.830
  614   HD13  LEU  81          HD13      LEU  81  85.688  -7.576  -2.850
  615   HD21  LEU  81          HD21      LEU  81  85.135  -4.337  -1.358
  616   HD22  LEU  81          HD22      LEU  81  83.972  -3.708  -2.526
  617   HD23  LEU  81          HD23      LEU  81  85.689  -3.754  -2.928
  618    H    ALA  82           HN       ALA  82  83.590  -6.954  -6.402
  619    HA   ALA  82           HA       ALA  82  84.138  -5.813  -8.988
  620    HB1  ALA  82           HB1      ALA  82  82.971  -8.535  -8.337
  621    HB2  ALA  82           HB2      ALA  82  84.694  -8.158  -8.325
  622    HB3  ALA  82           HB3      ALA  82  83.783  -8.070  -9.833
  623    H    GLN  83           HN       GLN  83  81.137  -6.457  -7.257
  624    HA   GLN  83           HA       GLN  83  79.260  -6.726  -9.283
  625    HB2  GLN  83           HB2      GLN  83  79.218  -5.188  -6.703
  626    HB3  GLN  83           HB1      GLN  83  77.873  -4.986  -7.822
  627    HG2  GLN  83           HG2      GLN  83  78.805  -7.763  -7.182
  628    HG3  GLN  83           HG1      GLN  83  77.816  -6.906  -5.999
  629   HE21  GLN  83          HE21      GLN  83  77.215  -5.934  -9.255
  630   HE22  GLN  83          HE22      GLN  83  75.788  -6.823  -9.490
  631    H    TYR  84           HN       TYR  84  81.410  -4.109  -8.768
  632    HA   TYR  84           HA       TYR  84  80.883  -2.907 -11.291
  633    HD1  TYR  84           HD1      TYR  84  80.721  -0.146 -11.973
  634    HD2  TYR  84           HD2      TYR  84  77.230  -2.361 -10.808
  635    HE1  TYR  84           HE1      TYR  84  79.617   0.474 -14.105
  636    HE2  TYR  84           HE2      TYR  84  76.126  -1.741 -12.940
  637    HH   TYR  84           HH       TYR  84  77.683   0.471 -15.240
  638    HB2  TYR  84           HB2      TYR  84  79.002  -2.149  -9.304
  639    HB3  TYR  84           HB1      TYR  84  80.100  -0.780  -9.476
  640    H    GLY  85           HN       GLY  85  82.880  -3.679  -9.067
  641    HA2  GLY  85           HA2      GLY  85  85.027  -2.965  -8.444
  642    HA3  GLY  85           HA1      GLY  85  84.908  -1.763  -9.732
  643    H    ILE  86           HN       ILE  86  83.259   0.031  -9.164
  644    HA   ILE  86           HA       ILE  86  82.940   0.714  -6.355
  645    HB   ILE  86           HB       ILE  86  84.303   2.977  -6.965
  646   HG12  ILE  86          HG12      ILE  86  86.381   2.355  -8.156
  647   HG13  ILE  86          HG11      ILE  86  85.736   0.737  -8.433
  648   HG21  ILE  86          HG21      ILE  86  85.883   0.570  -6.085
  649   HG22  ILE  86          HG22      ILE  86  84.573   1.186  -5.078
  650   HG23  ILE  86          HG23      ILE  86  85.946   2.222  -5.469
  651   HD11  ILE  86          HD11      ILE  86  85.426   2.235 -10.403
  652   HD12  ILE  86          HD12      ILE  86  84.435   3.299  -9.404
  653   HD13  ILE  86          HD13      ILE  86  83.895   1.656  -9.748
  654    H1U  RCY  87           H1U      RCY  87  78.706   4.565  -2.140
  655    H1S  RCY  87           H1S      RCY  87  80.185   0.972  -5.044
  656    HB1  RCY  87           HB1      RCY  87  78.184   1.208  -8.992
  657    HB2  RCY  87           HB2      RCY  87  77.807   2.550  -7.916
  658    HA   RCY  87           HA       RCY  87  80.014   2.456  -9.524
  659    HN1  RCY  87           HN1      RCY  87  80.766   0.707  -7.459
  Start of MODEL   58
    1    HA   MET   1           HA       MET   1  54.063  -4.300  11.780
    2    HB2  MET   1           HB2      MET   1  55.082  -6.909  12.905
    3    HB3  MET   1           HB1      MET   1  53.606  -6.170  13.525
    4    HG2  MET   1           HG2      MET   1  53.987  -6.537  10.562
    5    HG3  MET   1           HG1      MET   1  53.417  -7.875  11.558
    6    HE1  MET   1           HE1      MET   1  51.963  -6.010   9.080
    7    HE2  MET   1           HE2      MET   1  52.818  -4.664   9.831
    8    HE3  MET   1           HE3      MET   1  51.060  -4.635   9.727
    9    H    ASN   2           HN       ASN   2  54.603  -2.370  12.842
   10    HA   ASN   2           HA       ASN   2  54.891  -2.536  15.722
   11    HB2  ASN   2           HB2      ASN   2  57.278  -2.052  14.022
   12    HB3  ASN   2           HB1      ASN   2  57.074  -0.933  15.369
   13   HD21  ASN   2          HD21      ASN   2  56.192  -2.368  17.462
   14   HD22  ASN   2          HD22      ASN   2  57.189  -3.699  17.803
   15    H    LEU   3           HN       LEU   3  55.616  -0.001  16.362
   16    HA   LEU   3           HA       LEU   3  53.357   1.551  15.424
   17    HG   LEU   3           HG       LEU   3  53.902   3.990  18.020
   18    HB2  LEU   3           HB2      LEU   3  54.705   1.622  17.714
   19    HB3  LEU   3           HB1      LEU   3  55.676   2.814  16.856
   20   HD11  LEU   3          HD11      LEU   3  54.506   4.570  15.584
   21   HD12  LEU   3          HD12      LEU   3  52.982   5.208  16.201
   22   HD13  LEU   3          HD13      LEU   3  52.984   3.793  15.148
   23   HD21  LEU   3          HD21      LEU   3  51.716   3.286  18.119
   24   HD22  LEU   3          HD22      LEU   3  52.459   1.719  17.796
   25   HD23  LEU   3          HD23      LEU   3  51.741   2.643  16.477
   26    H    GLU   4           HN       GLU   4  56.897   2.009  15.100
   27    HA   GLU   4           HA       GLU   4  56.882   4.229  13.404
   28    HB2  GLU   4           HB2      GLU   4  58.725   1.837  13.534
   29    HB3  GLU   4           HB1      GLU   4  59.028   3.184  12.437
   30    HG2  GLU   4           HG2      GLU   4  59.079   4.750  14.309
   31    HG3  GLU   4           HG1      GLU   4  58.664   3.456  15.434
   32    HA   PRO   5           HA       PRO   5  54.952   3.350   9.534
   33    HB2  PRO   5           HB2      PRO   5  57.680   3.813   8.369
   34    HB3  PRO   5           HB1      PRO   5  56.110   4.452   7.843
   35    HG2  PRO   5           HG2      PRO   5  57.841   5.914   9.278
   36    HG3  PRO   5           HG1      PRO   5  56.087   6.088   9.442
   37    HD2  PRO   5           HD2      PRO   5  58.022   4.962  11.360
   38    HD3  PRO   5           HD1      PRO   5  56.360   5.523  11.639
   39    HA   PRO   6           HA       PRO   6  56.635  -0.907   9.252
   40    HB2  PRO   6           HB2      PRO   6  54.259  -2.187   8.972
   41    HB3  PRO   6           HB1      PRO   6  54.852  -1.624  10.547
   42    HG2  PRO   6           HG2      PRO   6  52.785  -0.443   8.777
   43    HG3  PRO   6           HG1      PRO   6  52.864  -0.499  10.544
   44    HD2  PRO   6           HD2      PRO   6  53.538   1.716   8.975
   45    HD3  PRO   6           HD1      PRO   6  54.030   1.469  10.664
   46    H    LYS   7           HN       LYS   7  57.355  -1.776   7.346
   47    HA   LYS   7           HA       LYS   7  56.094  -0.883   4.821
   48    HB2  LYS   7           HB2      LYS   7  58.575  -0.797   5.114
   49    HB3  LYS   7           HB1      LYS   7  58.589  -2.553   5.260
   50    HG2  LYS   7           HG2      LYS   7  58.529  -2.790   3.020
   51    HG3  LYS   7           HG1      LYS   7  57.085  -1.782   2.916
   52    HD2  LYS   7           HD2      LYS   7  59.901  -0.687   3.162
   53    HD3  LYS   7           HD1      LYS   7  59.038  -0.862   1.633
   54    HE2  LYS   7           HE2      LYS   7  58.292   1.243   2.051
   55    HE3  LYS   7           HE1      LYS   7  57.179   0.451   3.167
   56    HZ1  LYS   7           HZ1      LYS   7  58.208   1.364   4.887
   57    HZ2  LYS   7           HZ2      LYS   7  59.111   2.304   3.798
   58    HZ3  LYS   7           HZ3      LYS   7  59.727   0.824   4.361
   59    H    ALA   8           HN       ALA   8  57.610  -3.750   4.199
   60    HA   ALA   8           HA       ALA   8  55.564  -5.647   4.965
   61    HB1  ALA   8           HB1      ALA   8  54.729  -6.072   2.637
   62    HB2  ALA   8           HB2      ALA   8  55.570  -4.612   2.113
   63    HB3  ALA   8           HB3      ALA   8  54.245  -4.500   3.272
   64    H    GLU   9           HN       GLU   9  56.894  -7.367   5.282
   65    HA   GLU   9           HA       GLU   9  59.354  -7.691   3.741
   66    HB2  GLU   9           HB2      GLU   9  57.987  -9.359   5.864
   67    HB3  GLU   9           HB1      GLU   9  59.479  -9.868   5.074
   68    HG2  GLU   9           HG2      GLU   9  59.221  -7.153   6.368
   69    HG3  GLU   9           HG1      GLU   9  59.718  -8.574   7.288
   70    H1U  RCY  10           H1U      RCY  10  57.612  -9.668  -4.740
   71    H1S  RCY  10           H1S      RCY  10  57.121 -11.806  -0.613
   72    HB1  RCY  10           HB1      RCY  10  54.930  -9.239   0.526
   73    HB2  RCY  10           HB2      RCY  10  55.358  -9.748   2.159
   74    HA   RCY  10           HA       RCY  10  57.621 -10.451   0.806
   75    HN1  RCY  10           HN1      RCY  10  57.567  -7.688   1.794
   76    H    ARG  11           HN       ARG  11  58.257  -7.369   0.283
   77    HA   ARG  11           HA       ARG  11  58.435  -5.994  -1.616
   78    HE   ARG  11           HE       ARG  11  63.077  -6.377  -3.280
   79    HB2  ARG  11           HB2      ARG  11  58.637  -8.795  -2.725
   80    HB3  ARG  11           HB1      ARG  11  58.775  -7.384  -3.773
   81    HG2  ARG  11           HG2      ARG  11  60.416  -7.470  -1.268
   82    HG3  ARG  11           HG1      ARG  11  60.933  -8.439  -2.648
   83    HD2  ARG  11           HD2      ARG  11  60.861  -6.416  -4.080
   84    HD3  ARG  11           HD1      ARG  11  60.392  -5.454  -2.678
   85   HH11  ARG  11          HH21      ARG  11  60.797  -5.616  -0.809
   86   HH12  ARG  11          HH22      ARG  11  62.004  -5.216   0.367
   87   HH21  ARG  11          HH11      ARG  11  64.667  -5.860  -1.759
   88   HH22  ARG  11          HH12      ARG  11  64.195  -5.354  -0.171
   89    H    SER  12           HN       SER  12  57.411  -5.846  -4.037
   90    HA   SER  12           HA       SER  12  55.417  -5.290  -5.151
   91    HG   SER  12           HG       SER  12  54.061  -6.863  -6.558
   92    HB2  SER  12           HB2      SER  12  55.500  -7.850  -5.259
   93    HB3  SER  12           HB1      SER  12  54.349  -7.840  -3.926
   94    H    ALA  13           HN       ALA  13  55.759  -4.586  -2.197
   95    HA   ALA  13           HA       ALA  13  52.952  -3.730  -1.801
   96    HB1  ALA  13           HB1      ALA  13  52.917  -5.735  -0.507
   97    HB2  ALA  13           HB2      ALA  13  53.160  -4.431   0.656
   98    HB3  ALA  13           HB3      ALA  13  54.525  -5.426   0.148
   99    H    THR  14           HN       THR  14  54.953  -2.062  -2.592
  100    HA   THR  14           HA       THR  14  55.168  -0.253  -0.294
  101    HB   THR  14           HB       THR  14  57.175  -1.389   0.201
  102    HG1  THR  14           HG1      THR  14  57.651   0.762   0.013
  103   HG21  THR  14          HG21      THR  14  58.796  -2.048  -1.587
  104   HG22  THR  14          HG22      THR  14  57.628  -1.508  -2.793
  105   HG23  THR  14          HG23      THR  14  57.238  -2.862  -1.732
  106    H    ARG  15           HN       ARG  15  55.188   1.863  -1.006
  107    HA   ARG  15           HA       ARG  15  54.945   2.293  -3.904
  108    HE   ARG  15           HE       ARG  15  53.132   7.418  -4.823
  109    HB2  ARG  15           HB2      ARG  15  53.532   3.430  -2.068
  110    HB3  ARG  15           HB1      ARG  15  54.948   4.440  -1.778
  111    HG2  ARG  15           HG2      ARG  15  54.927   4.930  -4.293
  112    HG3  ARG  15           HG1      ARG  15  53.317   4.210  -4.312
  113    HD2  ARG  15           HD2      ARG  15  52.773   5.837  -2.381
  114    HD3  ARG  15           HD1      ARG  15  54.243   6.687  -2.858
  115   HH11  ARG  15          HH21      ARG  15  51.415   4.938  -3.153
  116   HH12  ARG  15          HH22      ARG  15  49.981   5.102  -4.110
  117   HH21  ARG  15          HH11      ARG  15  51.269   7.647  -6.082
  118   HH22  ARG  15          HH12      ARG  15  49.898   6.636  -5.768
  119    H    VAL  16           HN       VAL  16  57.493   1.414  -3.420
  120    HA   VAL  16           HA       VAL  16  59.078   3.788  -4.173
  121    HB   VAL  16           HB       VAL  16  59.765   2.048  -1.785
  122   HG11  VAL  16          HG11      VAL  16  61.814   2.464  -2.936
  123   HG12  VAL  16          HG12      VAL  16  61.738   3.676  -1.657
  124   HG13  VAL  16          HG13      VAL  16  61.346   4.121  -3.318
  125   HG21  VAL  16          HG21      VAL  16  58.213   3.740  -1.125
  126   HG22  VAL  16          HG22      VAL  16  58.996   4.953  -2.138
  127   HG23  VAL  16          HG23      VAL  16  59.804   4.363  -0.686
  128    H    MET  17           HN       MET  17  58.694   0.323  -3.864
  129    HA   MET  17           HA       MET  17  60.926  -0.060  -5.830
  130    HB2  MET  17           HB2      MET  17  59.838  -1.905  -3.686
  131    HB3  MET  17           HB1      MET  17  60.946  -2.436  -4.951
  132    HG2  MET  17           HG2      MET  17  62.661  -0.934  -4.198
  133    HG3  MET  17           HG1      MET  17  61.546  -0.114  -3.105
  134    HE1  MET  17           HE1      MET  17  63.896  -0.529  -2.225
  135    HE2  MET  17           HE2      MET  17  64.490  -2.018  -1.493
  136    HE3  MET  17           HE3      MET  17  63.401  -0.971  -0.586
  137    H    GLY  18           HN       GLY  18  60.504  -2.101  -7.220
  138    HA2  GLY  18           HA2      GLY  18  59.173  -3.085  -8.885
  139    HA3  GLY  18           HA1      GLY  18  57.914  -3.152  -7.650
  140    H    GLY  19           HN       GLY  19  59.027  -1.507 -10.474
  141    HA2  GLY  19           HA2      GLY  19  57.079  -0.421 -11.722
  142    HA3  GLY  19           HA1      GLY  19  56.787   0.463 -10.223
  143    HA   PRO  20           HA       PRO  20  59.463   2.953 -13.283
  144    HB2  PRO  20           HB2      PRO  20  57.826   4.983 -11.800
  145    HB3  PRO  20           HB1      PRO  20  58.300   4.951 -13.510
  146    HG2  PRO  20           HG2      PRO  20  55.842   4.283 -12.728
  147    HG3  PRO  20           HG1      PRO  20  56.644   3.467 -14.079
  148    HD2  PRO  20           HD2      PRO  20  56.073   2.445 -11.347
  149    HD3  PRO  20           HD1      PRO  20  56.298   1.548 -12.864
  150    H1U  RCY  21           H1U      RCY  21  62.718   8.914  -8.171
  151    H1S  RCY  21           H1S      RCY  21  65.651   5.362  -9.743
  152    HB1  RCY  21           HB1      RCY  21  63.045   2.144 -10.945
  153    HB2  RCY  21           HB2      RCY  21  62.456   2.458  -9.314
  154    HA   RCY  21           HA       RCY  21  61.783   4.623  -9.827
  155    HN1  RCY  21           HN1      RCY  21  61.487   3.478 -12.565
  156    H    THR  22           HN       THR  22  62.489   6.642 -10.377
  157    HA   THR  22           HA       THR  22  64.878   6.812 -12.166
  158    HB   THR  22           HB       THR  22  63.263   7.794 -13.534
  159    HG1  THR  22           HG1      THR  22  63.533  10.054 -13.276
  160   HG21  THR  22          HG21      THR  22  61.359   7.590 -12.070
  161   HG22  THR  22          HG22      THR  22  61.451   9.275 -12.583
  162   HG23  THR  22          HG23      THR  22  62.006   8.812 -10.974
  163    HA   PRO  23           HA       PRO  23  66.946   8.514  -8.595
  164    HB2  PRO  23           HB2      PRO  23  67.964  10.439 -10.664
  165    HB3  PRO  23           HB1      PRO  23  68.859   9.565  -9.404
  166    HG2  PRO  23           HG2      PRO  23  68.861   8.766 -11.959
  167    HG3  PRO  23           HG1      PRO  23  68.922   7.618 -10.613
  168    HD2  PRO  23           HD2      PRO  23  66.709   8.155 -12.498
  169    HD3  PRO  23           HD1      PRO  23  66.994   6.732 -11.473
  170    H    ARG  24           HN       ARG  24  65.516   9.625  -7.277
  171    HA   ARG  24           HA       ARG  24  63.801  11.740  -8.062
  172    HE   ARG  24           HE       ARG  24  61.949  11.205  -7.311
  173    HB2  ARG  24           HB2      ARG  24  63.636  10.451  -5.915
  174    HB3  ARG  24           HB1      ARG  24  65.040  11.336  -5.321
  175    HG2  ARG  24           HG2      ARG  24  63.656  12.980  -4.642
  176    HG3  ARG  24           HG1      ARG  24  63.260  13.287  -6.333
  177    HD2  ARG  24           HD2      ARG  24  61.835  11.429  -4.415
  178    HD3  ARG  24           HD1      ARG  24  61.180  12.856  -5.218
  179   HH11  ARG  24          HH21      ARG  24  59.996  10.931  -4.483
  180   HH12  ARG  24          HH22      ARG  24  58.915   9.771  -5.180
  181   HH21  ARG  24          HH11      ARG  24  60.549   9.693  -8.238
  182   HH22  ARG  24          HH12      ARG  24  59.228   9.070  -7.306
  183    H    LYS  25           HN       LYS  25  65.675  12.958  -5.506
  184    HA   LYS  25           HA       LYS  25  66.296  15.401  -6.744
  185    HB2  LYS  25           HB2      LYS  25  67.627  13.913  -4.475
  186    HB3  LYS  25           HB1      LYS  25  68.164  15.515  -4.979
  187    HG2  LYS  25           HG2      LYS  25  66.074  16.507  -4.436
  188    HG3  LYS  25           HG1      LYS  25  65.272  14.940  -4.325
  189    HD2  LYS  25           HD2      LYS  25  65.612  15.489  -2.071
  190    HD3  LYS  25           HD1      LYS  25  67.004  14.465  -2.427
  191    HE2  LYS  25           HE2      LYS  25  68.031  16.849  -3.152
  192    HE3  LYS  25           HE1      LYS  25  66.887  17.396  -1.926
  193    HZ1  LYS  25           HZ1      LYS  25  69.271  16.674  -1.249
  194    HZ2  LYS  25           HZ2      LYS  25  68.630  15.104  -1.347
  195    HZ3  LYS  25           HZ3      LYS  25  67.949  16.237  -0.280
  196    H    GLY  26           HN       GLY  26  68.781  16.099  -6.995
  197    HA2  GLY  26           HA2      GLY  26  69.823  14.409  -9.155
  198    HA3  GLY  26           HA1      GLY  26  70.479  15.968  -8.652
  199    HA   PRO  27           HA       PRO  27  72.606  11.871  -6.828
  200    HB2  PRO  27           HB2      PRO  27  74.619  12.693  -8.889
  201    HB3  PRO  27           HB1      PRO  27  74.197  11.068  -8.311
  202    HG2  PRO  27           HG2      PRO  27  73.326  11.992 -10.658
  203    HG3  PRO  27           HG1      PRO  27  72.333  10.932  -9.645
  204    HD2  PRO  27           HD2      PRO  27  72.020  13.840 -10.185
  205    HD3  PRO  27           HD1      PRO  27  70.795  12.639  -9.721
  206    HA   PRO  28           HA       PRO  28  74.416  15.052  -4.151
  207    HB2  PRO  28           HB2      PRO  28  76.046  12.660  -3.354
  208    HB3  PRO  28           HB1      PRO  28  75.244  13.867  -2.329
  209    HG2  PRO  28           HG2      PRO  28  74.198  11.444  -2.717
  210    HG3  PRO  28           HG1      PRO  28  73.179  12.883  -2.560
  211    HD2  PRO  28           HD2      PRO  28  73.765  11.261  -4.979
  212    HD3  PRO  28           HD1      PRO  28  72.369  12.305  -4.631
  213    H    LYS  29           HN       LYS  29  76.162  16.397  -4.503
  214    HA   LYS  29           HA       LYS  29  77.884  16.106  -6.704
  215    HB2  LYS  29           HB2      LYS  29  79.331  17.815  -5.539
  216    HB3  LYS  29           HB1      LYS  29  77.629  18.263  -5.649
  217    HG2  LYS  29           HG2      LYS  29  77.227  17.669  -3.367
  218    HG3  LYS  29           HG1      LYS  29  78.789  16.860  -3.233
  219    HD2  LYS  29           HD2      LYS  29  79.951  19.001  -3.510
  220    HD3  LYS  29           HD1      LYS  29  78.407  19.830  -3.717
  221    HE2  LYS  29           HE2      LYS  29  79.406  19.955  -1.378
  222    HE3  LYS  29           HE1      LYS  29  77.749  19.358  -1.463
  223    HZ1  LYS  29           HZ1      LYS  29  78.413  17.198  -1.079
  224    HZ2  LYS  29           HZ2      LYS  29  79.469  18.072  -0.075
  225    HZ3  LYS  29           HZ3      LYS  29  80.013  17.477  -1.570
  226    H1U  RCY  30           H1U      RCY  30  82.361   5.804  -6.156
  227    H1S  RCY  30           H1S      RCY  30  80.921   9.575  -5.160
  228    HB1  RCY  30           HB1      RCY  30  80.578  12.313  -6.691
  229    HB2  RCY  30           HB2      RCY  30  79.765  12.574  -5.147
  230    HA   RCY  30           HA       RCY  30  81.562  14.335  -4.666
  231    HN1  RCY  30           HN1      RCY  30  80.088  15.455  -6.887
  232    H    LYS  31           HN       LYS  31  82.906  15.975  -5.863
  233    HA   LYS  31           HA       LYS  31  83.828  15.489  -8.534
  234    HB2  LYS  31           HB2      LYS  31  85.533  16.862  -6.469
  235    HB3  LYS  31           HB1      LYS  31  85.313  17.262  -8.173
  236    HG2  LYS  31           HG2      LYS  31  82.857  17.754  -7.551
  237    HG3  LYS  31           HG1      LYS  31  83.417  17.753  -5.878
  238    HD2  LYS  31           HD2      LYS  31  84.361  19.552  -8.124
  239    HD3  LYS  31           HD1      LYS  31  83.506  20.033  -6.657
  240    HE2  LYS  31           HE2      LYS  31  85.710  20.531  -6.083
  241    HE3  LYS  31           HE1      LYS  31  85.546  18.896  -5.443
  242    HZ1  LYS  31           HZ1      LYS  31  87.387  19.782  -7.295
  243    HZ2  LYS  31           HZ2      LYS  31  86.288  18.832  -8.176
  244    HZ3  LYS  31           HZ3      LYS  31  87.094  18.176  -6.832
  245    H    GLN  32           HN       GLN  32  84.103  13.048  -8.092
  246    HA   GLN  32           HA       GLN  32  86.729  12.434  -6.820
  247    HB2  GLN  32           HB2      GLN  32  84.527  11.135  -6.331
  248    HB3  GLN  32           HB1      GLN  32  84.793  10.391  -7.908
  249    HG2  GLN  32           HG2      GLN  32  85.848   8.942  -6.331
  250    HG3  GLN  32           HG1      GLN  32  87.156   9.846  -7.095
  251   HE21  GLN  32          HE21      GLN  32  88.537  10.982  -5.705
  252   HE22  GLN  32          HE22      GLN  32  88.213  11.295  -4.069
  253    H    ARG  33           HN       ARG  33  86.400   9.918  -8.729
  254    HA   ARG  33           HA       ARG  33  87.176  11.093 -11.303
  255    HE   ARG  33           HE       ARG  33  88.281  12.558 -11.451
  256    HB2  ARG  33           HB2      ARG  33  89.247  11.023  -9.756
  257    HB3  ARG  33           HB1      ARG  33  89.165   9.274  -9.948
  258    HG2  ARG  33           HG2      ARG  33  90.397   9.594 -11.825
  259    HG3  ARG  33           HG1      ARG  33  88.894  10.168 -12.548
  260    HD2  ARG  33           HD2      ARG  33  91.124  11.797 -11.327
  261    HD3  ARG  33           HD1      ARG  33  90.442  11.917 -12.949
  262   HH11  ARG  33          HH21      ARG  33  91.601  13.464 -11.251
  263   HH12  ARG  33          HH22      ARG  33  91.272  15.023 -10.572
  264   HH21  ARG  33          HH11      ARG  33  87.832  14.589 -10.565
  265   HH22  ARG  33          HH12      ARG  33  89.139  15.660 -10.183
  266    H    GLN  34           HN       GLN  34  88.081   7.944  -9.961
  267    HA   GLN  34           HA       GLN  34  85.801   6.606 -11.197
  268    HB2  GLN  34           HB2      GLN  34  88.197   7.025 -12.735
  269    HB3  GLN  34           HB1      GLN  34  88.040   5.302 -12.412
  270    HG2  GLN  34           HG2      GLN  34  85.746   6.989 -13.438
  271    HG3  GLN  34           HG1      GLN  34  86.853   6.127 -14.507
  272   HE21  GLN  34          HE21      GLN  34  85.769   4.908 -11.335
  273   HE22  GLN  34          HE22      GLN  34  84.902   3.587 -11.955
  274    H    THR  35           HN       THR  35  86.136   6.348  -8.671
  275    HA   THR  35           HA       THR  35  87.003   5.063  -6.845
  276    HB   THR  35           HB       THR  35  85.144   3.738  -7.213
  277    HG1  THR  35           HG1      THR  35  86.811   2.373  -6.486
  278   HG21  THR  35          HG21      THR  35  85.008   4.218  -9.620
  279   HG22  THR  35          HG22      THR  35  84.738   2.502  -9.317
  280   HG23  THR  35          HG23      THR  35  86.295   3.054  -9.934
  281    H    ARG  36           HN       ARG  36  89.309   5.410  -6.988
  282    HA   ARG  36           HA       ARG  36  90.826   3.002  -7.355
  283    HE   ARG  36           HE       ARG  36  92.301   6.642 -11.593
  284    HB2  ARG  36           HB2      ARG  36  92.255   3.840  -9.267
  285    HB3  ARG  36           HB1      ARG  36  90.616   3.387  -9.721
  286    HG2  ARG  36           HG2      ARG  36  90.767   5.456 -10.764
  287    HG3  ARG  36           HG1      ARG  36  90.120   5.945  -9.198
  288    HD2  ARG  36           HD2      ARG  36  91.924   7.261  -8.919
  289    HD3  ARG  36           HD1      ARG  36  92.925   5.809  -8.878
  290   HH11  ARG  36          HH21      ARG  36  94.302   7.116  -8.827
  291   HH12  ARG  36          HH22      ARG  36  95.639   7.738  -9.735
  292   HH21  ARG  36          HH11      ARG  36  94.035   7.452 -12.796
  293   HH22  ARG  36          HH12      ARG  36  95.488   7.928 -11.982
  294    H    GLN  37           HN       GLN  37  90.367   5.924  -6.024
  295    HA   GLN  37           HA       GLN  37  93.280   6.351  -5.462
  296    HB2  GLN  37           HB2      GLN  37  91.778   8.216  -6.536
  297    HB3  GLN  37           HB1      GLN  37  91.153   8.407  -4.898
  298    HG2  GLN  37           HG2      GLN  37  92.964   9.927  -5.001
  299    HG3  GLN  37           HG1      GLN  37  93.631   8.521  -4.171
  300   HE21  GLN  37          HE21      GLN  37  95.741   8.255  -4.927
  301   HE22  GLN  37          HE22      GLN  37  96.201   8.314  -6.560
  302    H1U  RCY  38           H1U      RCY  38  87.201  -0.343  -1.722
  303    H1S  RCY  38           H1S      RCY  38  86.706   4.177  -1.326
  304    HB1  RCY  38           HB1      RCY  38  89.650   3.721  -0.908
  305    HB2  RCY  38           HB2      RCY  38  89.807   3.219  -2.591
  306    HA   RCY  38           HA       RCY  38  91.074   5.716  -1.427
  307    HN1  RCY  38           HN1      RCY  38  91.116   4.557  -4.158
  308    H    LYS  39           HN       LYS  39  92.408   2.966  -3.225
  309    HA   LYS  39           HA       LYS  39  94.037   1.401  -2.625
  310    HB2  LYS  39           HB2      LYS  39  95.281   3.615  -2.446
  311    HB3  LYS  39           HB1      LYS  39  94.983   3.548  -0.715
  312    HG2  LYS  39           HG2      LYS  39  97.126   2.564  -0.979
  313    HG3  LYS  39           HG1      LYS  39  96.032   1.192  -0.802
  314    HD2  LYS  39           HD2      LYS  39  97.584   0.821  -2.676
  315    HD3  LYS  39           HD1      LYS  39  95.927   0.966  -3.264
  316    HE2  LYS  39           HE2      LYS  39  97.428   3.511  -3.077
  317    HE3  LYS  39           HE1      LYS  39  98.015   2.377  -4.293
  318    HZ1  LYS  39           HZ1      LYS  39  96.068   2.462  -5.453
  319    HZ2  LYS  39           HZ2      LYS  39  96.100   4.044  -4.834
  320    HZ3  LYS  39           HZ3      LYS  39  95.130   2.861  -4.096
  321    H    SER  40           HN       SER  40  94.033   2.923   0.574
  322    HA   SER  40           HA       SER  40  92.287   0.880   1.721
  323    HG   SER  40           HG       SER  40  93.660  -1.389   1.627
  324    HB2  SER  40           HB2      SER  40  95.275   0.806   2.213
  325    HB3  SER  40           HB1      SER  40  94.099  -0.023   3.228
  326    H    LYS  41           HN       LYS  41  92.589   1.068   4.291
  327    HA   LYS  41           HA       LYS  41  93.179   3.895   5.019
  328    HB2  LYS  41           HB2      LYS  41  90.834   2.892   6.437
  329    HB3  LYS  41           HB1      LYS  41  91.023   4.388   5.524
  330    HG2  LYS  41           HG2      LYS  41  90.591   3.211   3.428
  331    HG3  LYS  41           HG1      LYS  41  90.505   1.670   4.282
  332    HD2  LYS  41           HD2      LYS  41  88.254   2.169   4.200
  333    HD3  LYS  41           HD1      LYS  41  88.670   2.988   5.706
  334    HE2  LYS  41           HE2      LYS  41  88.706   4.344   2.998
  335    HE3  LYS  41           HE1      LYS  41  87.332   4.403   4.102
  336    HZ1  LYS  41           HZ1      LYS  41  89.979   5.631   4.356
  337    HZ2  LYS  41           HZ2      LYS  41  89.185   5.139   5.775
  338    HZ3  LYS  41           HZ3      LYS  41  88.452   6.265   4.736
  339    HA   PRO  42           HA       PRO  42  94.848   2.360   8.804
  340    HB2  PRO  42           HB2      PRO  42  92.830   3.682  10.529
  341    HB3  PRO  42           HB1      PRO  42  94.578   3.961  10.430
  342    HG2  PRO  42           HG2      PRO  42  92.783   5.715   9.487
  343    HG3  PRO  42           HG1      PRO  42  94.374   5.486   8.744
  344    HD2  PRO  42           HD2      PRO  42  91.699   4.519   7.803
  345    HD3  PRO  42           HD1      PRO  42  93.099   5.067   6.853
  346    HA   PRO  43           HA       PRO  43  92.640  -1.228  10.155
  347    HB2  PRO  43           HB2      PRO  43  93.522  -1.488  12.771
  348    HB3  PRO  43           HB1      PRO  43  94.456  -1.975  11.345
  349    HG2  PRO  43           HG2      PRO  43  94.678   0.482  12.999
  350    HG3  PRO  43           HG1      PRO  43  95.948  -0.481  12.226
  351    HD2  PRO  43           HD2      PRO  43  95.077   1.887  11.192
  352    HD3  PRO  43           HD1      PRO  43  95.676   0.562  10.169
  353    H    LYS  44           HN       LYS  44  90.499  -1.338  10.663
  354    HA   LYS  44           HA       LYS  44  89.515   0.125  13.073
  355    HB2  LYS  44           HB2      LYS  44  89.091   1.367  10.850
  356    HB3  LYS  44           HB1      LYS  44  87.962   0.063  10.482
  357    HG2  LYS  44           HG2      LYS  44  87.066   0.606  12.923
  358    HG3  LYS  44           HG1      LYS  44  87.788   2.181  12.591
  359    HD2  LYS  44           HD2      LYS  44  85.697   0.761  10.918
  360    HD3  LYS  44           HD1      LYS  44  85.468   2.229  11.869
  361    HE2  LYS  44           HE2      LYS  44  87.087   1.864   9.348
  362    HE3  LYS  44           HE1      LYS  44  85.791   3.019   9.661
  363    HZ1  LYS  44           HZ1      LYS  44  87.563   4.368   9.982
  364    HZ2  LYS  44           HZ2      LYS  44  88.597   3.107  10.458
  365    HZ3  LYS  44           HZ3      LYS  44  87.463   3.738  11.554
  366    H    LYS  45           HN       LYS  45  90.092  -2.659  12.850
  367    HA   LYS  45           HA       LYS  45  89.091  -4.744  13.242
  368    HB2  LYS  45           HB2      LYS  45  87.963  -3.290  15.014
  369    HB3  LYS  45           HB1      LYS  45  86.597  -3.161  13.906
  370    HG2  LYS  45           HG2      LYS  45  86.795  -5.786  13.818
  371    HG3  LYS  45           HG1      LYS  45  87.637  -5.577  15.354
  372    HD2  LYS  45           HD2      LYS  45  84.839  -4.626  14.680
  373    HD3  LYS  45           HD1      LYS  45  85.273  -5.909  15.810
  374    HE2  LYS  45           HE2      LYS  45  85.015  -4.145  17.289
  375    HE3  LYS  45           HE1      LYS  45  86.730  -3.980  16.911
  376    HZ1  LYS  45           HZ1      LYS  45  85.121  -2.644  14.989
  377    HZ2  LYS  45           HZ2      LYS  45  86.365  -2.026  15.966
  378    HZ3  LYS  45           HZ3      LYS  45  84.771  -2.084  16.551
  379    H    GLY  46           HN       GLY  46  86.147  -3.037  12.198
  380    HA2  GLY  46           HA2      GLY  46  84.667  -3.547  10.448
  381    HA3  GLY  46           HA1      GLY  46  86.131  -3.729   9.480
  382    H    VAL  47           HN       VAL  47  87.026  -5.837   9.214
  383    HA   VAL  47           HA       VAL  47  85.596  -8.125  10.421
  384    HB   VAL  47           HB       VAL  47  85.718  -7.649   7.427
  385   HG11  VAL  47          HG11      VAL  47  84.894 -10.047   9.080
  386   HG12  VAL  47          HG12      VAL  47  86.114  -9.982   7.807
  387   HG13  VAL  47          HG13      VAL  47  84.404  -9.832   7.399
  388   HG21  VAL  47          HG21      VAL  47  83.883  -6.426   8.351
  389   HG22  VAL  47          HG22      VAL  47  83.479  -7.736   9.462
  390   HG23  VAL  47          HG23      VAL  47  83.189  -7.925   7.732
  391    H    GLN  48           HN       GLN  48  87.579  -7.964   7.477
  392    HA   GLN  48           HA       GLN  48  90.059  -8.627   8.775
  393    HB2  GLN  48           HB2      GLN  48  88.472 -10.761   8.917
  394    HB3  GLN  48           HB1      GLN  48  89.000 -10.985   7.251
  395    HG2  GLN  48           HG2      GLN  48  90.612 -12.170   8.503
  396    HG3  GLN  48           HG1      GLN  48  91.395 -10.622   8.181
  397   HE21  GLN  48          HE21      GLN  48  91.366  -8.997   9.980
  398   HE22  GLN  48          HE22      GLN  48  91.226  -9.531  11.585
  399    H    GLY  49           HN       GLY  49  89.091  -6.866   6.697
  400    HA2  GLY  49           HA2      GLY  49  90.190  -6.043   4.747
  401    HA3  GLY  49           HA1      GLY  49  91.023  -7.591   4.592
  402    H1U  RCY  50           H1U      RCY  50  80.352  -7.308   1.974
  403    H1S  RCY  50           H1S      RCY  50  85.109  -6.664   2.219
  404    HB1  RCY  50           HB1      RCY  50  88.060  -5.908   0.343
  405    HB2  RCY  50           HB2      RCY  50  87.217  -5.954   1.892
  406    HA   RCY  50           HA       RCY  50  87.693  -8.508   1.827
  407    HN1  RCY  50           HN1      RCY  50  90.124  -6.842   2.259
  408    H    GLY  51           HN       GLY  51  87.851  -7.414  -1.043
  409    HA2  GLY  51           HA2      GLY  51  90.414  -8.598  -1.941
  410    HA3  GLY  51           HA1      GLY  51  88.934  -9.388  -2.486
  411    H    ASP  52           HN       ASP  52  89.032  -5.929  -2.002
  412    HA   ASP  52           HA       ASP  52  88.687  -4.176  -3.521
  413    HB2  ASP  52           HB2      ASP  52  90.568  -5.959  -5.091
  414    HB3  ASP  52           HB1      ASP  52  90.084  -4.351  -5.630
  415    H    ASP  53           HN       ASP  53  86.619  -4.052  -4.263
  416    HA   ASP  53           HA       ASP  53  85.219  -6.107  -5.640
  417    HB2  ASP  53           HB2      ASP  53  84.769  -3.107  -5.706
  418    HB3  ASP  53           HB1      ASP  53  83.608  -4.318  -6.253
  419    H    ILE  54           HN       ILE  54  84.206  -5.376  -7.968
  420    HA   ILE  54           HA       ILE  54  86.455  -5.568  -9.797
  421    HB   ILE  54           HB       ILE  54  84.251  -5.057 -11.391
  422   HG12  ILE  54          HG12      ILE  54  82.983  -4.954  -9.130
  423   HG13  ILE  54          HG11      ILE  54  82.307  -5.975 -10.399
  424   HG21  ILE  54          HG21      ILE  54  85.631  -6.949 -11.792
  425   HG22  ILE  54          HG22      ILE  54  84.053  -7.624 -11.386
  426   HG23  ILE  54          HG23      ILE  54  85.340  -7.602 -10.180
  427   HD11  ILE  54          HD11      ILE  54  84.292  -7.252  -8.590
  428   HD12  ILE  54          HD12      ILE  54  82.822  -7.921  -9.298
  429   HD13  ILE  54          HD13      ILE  54  82.721  -6.867  -7.887
  430    HA   PRO  55           HA       PRO  55  86.900  -1.198 -10.487
  431    HB2  PRO  55           HB2      PRO  55  88.250  -1.215 -12.846
  432    HB3  PRO  55           HB1      PRO  55  88.993  -1.750 -11.325
  433    HG2  PRO  55           HG2      PRO  55  87.848  -3.386 -13.535
  434    HG3  PRO  55           HG1      PRO  55  89.318  -3.648 -12.581
  435    HD2  PRO  55           HD2      PRO  55  86.946  -4.960 -12.098
  436    HD3  PRO  55           HD1      PRO  55  88.171  -4.655 -10.847
  437    H    GLY  56           HN       GLY  56  84.331  -1.579 -10.947
  438    HA2  GLY  56           HA2      GLY  56  83.577   0.204 -12.986
  439    HA3  GLY  56           HA1      GLY  56  83.454  -1.413 -13.681
  440    H    MET  57           HN       MET  57  81.850  -2.831 -12.899
  441    HA   MET  57           HA       MET  57  80.280  -2.545 -10.591
  442    HB2  MET  57           HB2      MET  57  79.659  -0.538 -12.584
  443    HB3  MET  57           HB1      MET  57  78.274  -1.608 -12.384
  444    HG2  MET  57           HG2      MET  57  78.161  -1.182 -10.034
  445    HG3  MET  57           HG1      MET  57  79.742  -0.400 -10.030
  446    HE1  MET  57           HE1      MET  57  79.144   1.810  -8.949
  447    HE2  MET  57           HE2      MET  57  78.957   3.105 -10.129
  448    HE3  MET  57           HE3      MET  57  80.213   1.889 -10.355
  449    H    GLU  58           HN       GLU  58  80.493  -4.828 -10.886
  450    HA   GLU  58           HA       GLU  58  78.492  -5.959 -12.792
  451    HB2  GLU  58           HB2      GLU  58  80.929  -6.176 -13.603
  452    HB3  GLU  58           HB1      GLU  58  81.149  -7.299 -12.260
  453    HG2  GLU  58           HG2      GLU  58  80.564  -8.654 -14.135
  454    HG3  GLU  58           HG1      GLU  58  79.103  -8.547 -13.154
  455    H    GLY  59           HN       GLY  59  80.422  -6.328  -9.851
  456    HA2  GLY  59           HA2      GLY  59  78.829  -8.652  -8.984
  457    HA3  GLY  59           HA1      GLY  59  80.151  -7.907  -8.081
  458    H1U  RCY  60           H1U      RCY  60  77.773  -4.828  -0.640
  459    H1S  RCY  60           H1S      RCY  60  79.979  -4.532  -4.002
  460    HB1  RCY  60           HB1      RCY  60  77.011  -3.626  -5.868
  461    HB2  RCY  60           HB2      RCY  60  77.833  -3.041  -7.315
  462    HA   RCY  60           HA       RCY  60  76.296  -5.590  -6.902
  463    HN1  RCY  60           HN1      RCY  60  78.209  -5.454  -9.169
  464    H    GLY  61           HN       GLY  61  75.606  -5.924  -9.540
  465    HA2  GLY  61           HA2      GLY  61  74.005  -3.480 -10.029
  466    HA3  GLY  61           HA1      GLY  61  75.041  -4.038 -11.347
  467    H    THR  62           HN       THR  62  73.831  -6.481  -9.285
  468    HA   THR  62           HA       THR  62  71.335  -6.983 -10.667
  469    HB   THR  62           HB       THR  62  73.841  -8.452 -11.487
  470    HG1  THR  62           HG1      THR  62  71.808  -7.989 -13.256
  471   HG21  THR  62          HG21      THR  62  72.171 -10.066 -12.610
  472   HG22  THR  62          HG22      THR  62  70.997  -9.457 -11.443
  473   HG23  THR  62          HG23      THR  62  72.457 -10.273 -10.882
  474    H    ASP  63           HN       ASP  63  73.931  -9.072  -9.342
  475    HA   ASP  63           HA       ASP  63  72.146 -10.668  -7.782
  476    HB2  ASP  63           HB2      ASP  63  74.151 -11.499  -6.667
  477    HB3  ASP  63           HB1      ASP  63  74.484 -11.325  -8.391
  478    H    ILE  64           HN       ILE  64  73.442  -7.515  -7.295
  479    HA   ILE  64           HA       ILE  64  73.406  -7.365  -4.450
  480    HB   ILE  64           HB       ILE  64  74.400  -5.475  -5.354
  481   HG12  ILE  64          HG12      ILE  64  71.531  -4.496  -5.332
  482   HG13  ILE  64          HG11      ILE  64  72.460  -4.792  -3.861
  483   HG21  ILE  64          HG21      ILE  64  72.300  -5.747  -7.503
  484   HG22  ILE  64          HG22      ILE  64  74.054  -5.840  -7.662
  485   HG23  ILE  64          HG23      ILE  64  73.276  -4.285  -7.365
  486   HD11  ILE  64          HD11      ILE  64  74.113  -3.142  -4.497
  487   HD12  ILE  64          HD12      ILE  64  72.521  -2.397  -4.638
  488   HD13  ILE  64          HD13      ILE  64  73.370  -2.944  -6.084
  489    H    THR  65           HN       THR  65  70.945  -8.044  -6.531
  490    HA   THR  65           HA       THR  65  68.575  -7.527  -6.481
  491    HB   THR  65           HB       THR  65  68.867  -9.735  -5.509
  492    HG1  THR  65           HG1      THR  65  66.833  -9.417  -5.116
  493   HG21  THR  65          HG21      THR  65  69.233 -10.004  -3.079
  494   HG22  THR  65          HG22      THR  65  69.365  -8.253  -2.911
  495   HG23  THR  65          HG23      THR  65  70.572  -9.144  -3.839
  496    H    VAL  66           HN       VAL  66  69.722  -5.140  -5.763
  497    HA   VAL  66           HA       VAL  66  69.123  -3.146  -4.672
  498    HB   VAL  66           HB       VAL  66  67.051  -4.605  -3.046
  499   HG11  VAL  66          HG11      VAL  66  67.107  -1.920  -4.459
  500   HG12  VAL  66          HG12      VAL  66  67.421  -2.176  -2.743
  501   HG13  VAL  66          HG13      VAL  66  65.819  -2.503  -3.404
  502   HG21  VAL  66          HG21      VAL  66  66.325  -5.537  -5.015
  503   HG22  VAL  66          HG22      VAL  66  67.166  -4.346  -6.007
  504   HG23  VAL  66          HG23      VAL  66  65.629  -3.933  -5.248
  505    H    ILE  67           HN       ILE  67  69.186  -6.092  -2.728
  506    HA   ILE  67           HA       ILE  67  71.025  -4.735  -0.819
  507    HB   ILE  67           HB       ILE  67  68.628  -6.456  -0.103
  508   HG12  ILE  67          HG12      ILE  67  68.915  -4.093   1.471
  509   HG13  ILE  67          HG11      ILE  67  69.105  -3.630  -0.221
  510   HG21  ILE  67          HG21      ILE  67  70.368  -7.249   1.304
  511   HG22  ILE  67          HG22      ILE  67  69.528  -6.040   2.275
  512   HG23  ILE  67          HG23      ILE  67  71.057  -5.637   1.495
  513   HD11  ILE  67          HD11      ILE  67  66.747  -3.528   0.314
  514   HD12  ILE  67          HD12      ILE  67  66.787  -5.152   1.003
  515   HD13  ILE  67          HD13      ILE  67  67.005  -4.924  -0.732
  516    H1U  RCY  68           H1U      RCY  68  70.394  -2.101  -0.662
  517    H1S  RCY  68           H1S      RCY  68  72.427  -5.477  -2.308
  518    HB1  RCY  68           HB1      RCY  68  74.922  -8.228  -2.990
  519    HB2  RCY  68           HB2      RCY  68  75.361  -7.661  -1.379
  520    HA   RCY  68           HA       RCY  68  72.771  -8.606  -2.386
  521    HN1  RCY  68           HN1      RCY  68  72.828  -5.851  -1.619
  522    HA   PRO  69           HA       PRO  69  72.595 -10.444   1.647
  523    HB2  PRO  69           HB2      PRO  69  73.396 -12.982   1.009
  524    HB3  PRO  69           HB1      PRO  69  71.791 -12.335   0.616
  525    HG2  PRO  69           HG2      PRO  69  74.183 -12.629  -1.130
  526    HG3  PRO  69           HG1      PRO  69  72.474 -12.913  -1.498
  527    HD2  PRO  69           HD2      PRO  69  73.801 -10.640  -2.259
  528    HD3  PRO  69           HD1      PRO  69  72.055 -10.676  -1.925
  529    H    TRP  70           HN       TRP  70  75.613 -10.599  -0.191
  530    HA   TRP  70           HA       TRP  70  77.127 -11.609   2.092
  531    HD1  TRP  70           HD1      TRP  70  76.060 -11.215  -1.696
  532    HE1  TRP  70           HE1      TRP  70  76.234  -9.394  -3.510
  533    HE3  TRP  70           HE3      TRP  70  80.273  -8.800  -0.118
  534    HZ2  TRP  70           HZ2      TRP  70  77.938  -7.197  -4.203
  535    HZ3  TRP  70           HZ3      TRP  70  81.148  -6.851  -1.370
  536    HH2  TRP  70           HH2      TRP  70  79.989  -6.046  -3.407
  537    HB2  TRP  70           HB2      TRP  70  79.125 -10.888   0.642
  538    HB3  TRP  70           HB1      TRP  70  78.084 -12.155  -0.001
  539    H    GLU  71           HN       GLU  71  75.678  -8.700   1.539
  540    HA   GLU  71           HA       GLU  71  77.300  -7.407   3.610
  541    HB2  GLU  71           HB2      GLU  71  77.368  -6.536   0.736
  542    HB3  GLU  71           HB1      GLU  71  77.389  -5.296   1.987
  543    HG2  GLU  71           HG2      GLU  71  79.296  -6.604   3.070
  544    HG3  GLU  71           HG1      GLU  71  79.370  -7.546   1.580
  545    H    ALA  72           HN       ALA  72  74.756  -8.191   3.914
  546    HA   ALA  72           HA       ALA  72  72.707  -6.424   3.038
  547    HB1  ALA  72           HB1      ALA  72  72.751  -7.805   5.729
  548    HB2  ALA  72           HB2      ALA  72  72.435  -8.671   4.226
  549    HB3  ALA  72           HB3      ALA  72  71.345  -7.387   4.750
  550    H1U  RCY  73           H1U      RCY  73  73.141   2.779   2.004
  551    H1S  RCY  73           H1S      RCY  73  71.001  -1.329   1.663
  552    HB1  RCY  73           HB1      RCY  73  73.238  -1.701   3.437
  553    HB2  RCY  73           HB2      RCY  73  72.588  -0.980   4.909
  554    HA   RCY  73           HA       RCY  73  74.185  -2.883   5.326
  555    HN1  RCY  73           HN1      RCY  73  72.579  -4.275   3.428
  556    H    ASN  74           HN       ASN  74  71.741  -5.000   5.956
  557    HA   ASN  74           HA       ASN  74  70.584  -3.505   8.236
  558    HB2  ASN  74           HB2      ASN  74  69.212  -4.997   6.684
  559    HB3  ASN  74           HB1      ASN  74  70.027  -6.370   7.435
  560   HD21  ASN  74          HD21      ASN  74  67.363  -6.422   7.870
  561   HD22  ASN  74          HD22      ASN  74  66.958  -5.882   9.427
  562    H    HIS  75           HN       HIS  75  72.618  -6.356   7.605
  563    HA   HIS  75           HA       HIS  75  72.962  -6.811  10.503
  564    HD1  HIS  75           HD1      HIS  75  73.422 -10.066  11.175
  565    HD2  HIS  75           HD2      HIS  75  70.920  -8.769   8.100
  566    HE1  HIS  75           HE1      HIS  75  71.240 -11.323  11.450
  567    HE2  HIS  75           HE2      HIS  75  69.708 -10.542   9.584
  568    HB2  HIS  75           HB2      HIS  75  73.813  -8.242   7.998
  569    HB3  HIS  75           HB1      HIS  75  74.632  -8.593   9.519
  570    H1U  RCY  76           H1U      RCY  76  75.985  -0.907   4.172
  571    H1S  RCY  76           H1S      RCY  76  77.757  -1.081   8.666
  572    HB1  RCY  76           HB1      RCY  76  76.050  -3.733   9.438
  573    HB2  RCY  76           HB2      RCY  76  76.501  -3.756   7.734
  574    HA   RCY  76           HA       RCY  76  77.611  -5.872   7.967
  575    HN1  RCY  76           HN1      RCY  76  75.474  -6.830   7.985
  576    H    GLU  77           HN       GLU  77  79.443  -6.186   9.189
  577    HA   GLU  77           HA       GLU  77  79.358  -7.545  11.638
  578    HB2  GLU  77           HB2      GLU  77  81.346  -7.011   9.959
  579    HB3  GLU  77           HB1      GLU  77  81.668  -5.707  11.101
  580    HG2  GLU  77           HG2      GLU  77  82.945  -7.557  11.890
  581    HG3  GLU  77           HG1      GLU  77  81.530  -7.491  12.940
  582    H    LEU  78           HN       LEU  78  79.728  -4.040  11.080
  583    HA   LEU  78           HA       LEU  78  79.816  -3.463  13.937
  584    HG   LEU  78           HG       LEU  78  81.546  -1.833  13.794
  585    HB2  LEU  78           HB2      LEU  78  79.643  -1.802  11.430
  586    HB3  LEU  78           HB1      LEU  78  79.357  -1.057  13.003
  587   HD11  LEU  78          HD11      LEU  78  81.658  -3.091  11.045
  588   HD12  LEU  78          HD12      LEU  78  81.834  -3.888  12.609
  589   HD13  LEU  78          HD13      LEU  78  83.102  -2.815  12.018
  590   HD21  LEU  78          HD21      LEU  78  82.975  -0.509  12.183
  591   HD22  LEU  78          HD22      LEU  78  81.530   0.339  12.732
  592   HD23  LEU  78          HD23      LEU  78  81.567  -0.391  11.127
  593    H    HIS  79           HN       HIS  79  77.678  -4.982  13.860
  594    HA   HIS  79           HA       HIS  79  75.191  -3.785  13.129
  595    HD1  HIS  79           HD1      HIS  79  74.240  -4.941  17.020
  596    HD2  HIS  79           HD2      HIS  79  77.662  -6.853  15.593
  597    HE1  HIS  79           HE1      HIS  79  75.542  -5.693  19.059
  598    HE2  HIS  79           HE2      HIS  79  77.627  -6.859  18.204
  599    HB2  HIS  79           HB2      HIS  79  74.158  -5.492  14.469
  600    HB3  HIS  79           HB1      HIS  79  75.595  -6.219  13.750
  601    H    GLU  80           HN       GLU  80  77.369  -2.510  15.157
  602    HA   GLU  80           HA       GLU  80  75.777  -1.848  17.475
  603    HB2  GLU  80           HB2      GLU  80  78.239  -1.771  17.519
  604    HB3  GLU  80           HB1      GLU  80  78.225  -0.475  16.323
  605    HG2  GLU  80           HG2      GLU  80  77.079   1.011  17.850
  606    HG3  GLU  80           HG1      GLU  80  76.856  -0.291  19.020
  607    H    LEU  81           HN       LEU  81  77.157   0.723  15.492
  608    HA   LEU  81           HA       LEU  81  74.779   2.342  15.832
  609    HG   LEU  81           HG       LEU  81  77.341   1.613  13.497
  610    HB2  LEU  81           HB2      LEU  81  75.998   3.890  14.215
  611    HB3  LEU  81           HB1      LEU  81  76.854   3.512  15.709
  612   HD11  LEU  81          HD11      LEU  81  78.916   3.152  12.350
  613   HD12  LEU  81          HD12      LEU  81  78.345   4.474  13.368
  614   HD13  LEU  81          HD13      LEU  81  77.248   3.709  12.219
  615   HD21  LEU  81          HD21      LEU  81  79.348   3.186  15.110
  616   HD22  LEU  81          HD22      LEU  81  79.510   1.567  14.430
  617   HD23  LEU  81          HD23      LEU  81  78.469   1.837  15.828
  618    H    ALA  82           HN       ALA  82  75.308  -0.223  13.807
  619    HA   ALA  82           HA       ALA  82  74.339   0.716  11.289
  620    HB1  ALA  82           HB1      ALA  82  73.918  -1.602  10.767
  621    HB2  ALA  82           HB2      ALA  82  73.848  -2.028  12.477
  622    HB3  ALA  82           HB3      ALA  82  75.382  -1.549  11.750
  623    H    GLN  83           HN       GLN  83  72.168  -1.673  12.061
  624    HA   GLN  83           HA       GLN  83  69.897  -1.691  12.671
  625    HB2  GLN  83           HB2      GLN  83  70.863   0.106  14.411
  626    HB3  GLN  83           HB1      GLN  83  69.904   1.206  13.422
  627    HG2  GLN  83           HG2      GLN  83  67.909  -0.163  13.772
  628    HG3  GLN  83           HG1      GLN  83  68.851  -1.344  14.683
  629   HE21  GLN  83          HE21      GLN  83  68.215  -1.087  16.840
  630   HE22  GLN  83          HE22      GLN  83  68.137   0.402  17.651
  631    H    TYR  84           HN       TYR  84  70.791   1.510  11.304
  632    HA   TYR  84           HA       TYR  84  68.849   0.977   9.097
  633    HD1  TYR  84           HD2      TYR  84  66.593   0.885   9.744
  634    HD2  TYR  84           HD1      TYR  84  68.189   3.512  12.744
  635    HE1  TYR  84           HE2      TYR  84  64.993  -0.035  11.401
  636    HE2  TYR  84           HE1      TYR  84  66.590   2.592  14.401
  637    HH   TYR  84           HH       TYR  84  65.304   0.285  14.628
  638    HB2  TYR  84           HB2      TYR  84  69.047   3.611  10.583
  639    HB3  TYR  84           HB1      TYR  84  67.925   3.211   9.281
  640    H    GLY  85           HN       GLY  85  71.840   2.295  10.198
  641    HA2  GLY  85           HA2      GLY  85  73.672   3.091   8.954
  642    HA3  GLY  85           HA1      GLY  85  72.812   2.596   7.494
  643    H    ILE  86           HN       ILE  86  74.244   5.186   8.419
  644    HA   ILE  86           HA       ILE  86  72.071   7.160   8.321
  645    HB   ILE  86           HB       ILE  86  74.881   8.050   7.920
  646   HG12  ILE  86          HG12      ILE  86  73.947   6.708  10.478
  647   HG13  ILE  86          HG11      ILE  86  75.223   6.124   9.409
  648   HG21  ILE  86          HG21      ILE  86  72.870   8.823  10.042
  649   HG22  ILE  86          HG22      ILE  86  72.812   9.481   8.407
  650   HG23  ILE  86          HG23      ILE  86  74.220   9.776   9.427
  651   HD11  ILE  86          HD11      ILE  86  76.421   8.321   9.800
  652   HD12  ILE  86          HD12      ILE  86  76.301   7.285  11.222
  653   HD13  ILE  86          HD13      ILE  86  75.224   8.671  11.047
  654    H1U  RCY  87           H1U      RCY  87  77.075   2.039   0.073
  655    H1S  RCY  87           H1S      RCY  87  74.174   1.904   3.758
  656    HB1  RCY  87           HB1      RCY  87  72.991   5.097   2.450
  657    HB2  RCY  87           HB2      RCY  87  71.421   5.130   3.243
  658    HA   RCY  87           HA       RCY  87  73.874   6.724   3.835
  659    HN1  RCY  87           HN1      RCY  87  72.683   5.299   5.966
  Start of MODEL   59
    1    HA   MET   1           HA       MET   1  59.258 -17.694   3.697
    2    HB2  MET   1           HB2      MET   1  56.851 -19.351   4.515
    3    HB3  MET   1           HB1      MET   1  57.319 -18.936   2.866
    4    HG2  MET   1           HG2      MET   1  59.557 -20.082   3.379
    5    HG3  MET   1           HG1      MET   1  58.766 -20.737   4.813
    6    HE1  MET   1           HE1      MET   1  56.986 -22.240   4.960
    7    HE2  MET   1           HE2      MET   1  56.119 -23.074   3.673
    8    HE3  MET   1           HE3      MET   1  55.788 -21.372   3.990
    9    H    ASN   2           HN       ASN   2  58.748 -15.805   5.757
   10    HA   ASN   2           HA       ASN   2  57.483 -13.868   6.135
   11    HB2  ASN   2           HB2      ASN   2  56.079 -14.438   3.524
   12    HB3  ASN   2           HB1      ASN   2  56.456 -12.876   4.249
   13   HD21  ASN   2          HD21      ASN   2  57.779 -15.536   2.352
   14   HD22  ASN   2          HD22      ASN   2  59.264 -14.791   2.002
   15    H    LEU   3           HN       LEU   3  55.943 -13.961   7.692
   16    HA   LEU   3           HA       LEU   3  53.266 -14.941   7.042
   17    HG   LEU   3           HG       LEU   3  52.853 -17.978   8.915
   18    HB2  LEU   3           HB2      LEU   3  54.880 -16.908   7.874
   19    HB3  LEU   3           HB1      LEU   3  54.469 -16.249   9.455
   20   HD11  LEU   3          HD11      LEU   3  51.427 -15.391   8.306
   21   HD12  LEU   3          HD12      LEU   3  52.127 -15.688   9.897
   22   HD13  LEU   3          HD13      LEU   3  50.867 -16.754   9.274
   23   HD21  LEU   3          HD21      LEU   3  51.793 -16.526   6.546
   24   HD22  LEU   3          HD22      LEU   3  51.890 -18.260   6.850
   25   HD23  LEU   3          HD23      LEU   3  53.321 -17.376   6.318
   26    H    GLU   4           HN       GLU   4  55.496 -13.898   9.620
   27    HA   GLU   4           HA       GLU   4  53.337 -12.801  11.235
   28    HB2  GLU   4           HB2      GLU   4  55.384 -11.667  12.406
   29    HB3  GLU   4           HB1      GLU   4  55.198 -13.417  12.525
   30    HG2  GLU   4           HG2      GLU   4  56.756 -12.261  10.233
   31    HG3  GLU   4           HG1      GLU   4  57.523 -12.400  11.816
   32    HA   PRO   5           HA       PRO   5  52.556  -8.958   9.162
   33    HB2  PRO   5           HB2      PRO   5  52.976  -7.802  11.900
   34    HB3  PRO   5           HB1      PRO   5  51.665  -7.501  10.742
   35    HG2  PRO   5           HG2      PRO   5  51.363  -9.122  12.856
   36    HG3  PRO   5           HG1      PRO   5  50.537  -9.404  11.317
   37    HD2  PRO   5           HD2      PRO   5  52.740 -10.937  12.549
   38    HD3  PRO   5           HD1      PRO   5  51.608 -11.425  11.270
   39    HA   PRO   6           HA       PRO   6  56.603  -7.194   8.560
   40    HB2  PRO   6           HB2      PRO   6  55.964  -4.828   7.380
   41    HB3  PRO   6           HB1      PRO   6  55.752  -6.388   6.559
   42    HG2  PRO   6           HG2      PRO   6  53.722  -4.684   7.917
   43    HG3  PRO   6           HG1      PRO   6  53.599  -5.600   6.406
   44    HD2  PRO   6           HD2      PRO   6  52.576  -6.490   8.801
   45    HD3  PRO   6           HD1      PRO   6  53.086  -7.574   7.488
   46    H    LYS   7           HN       LYS   7  58.027  -5.474   9.332
   47    HA   LYS   7           HA       LYS   7  57.015  -4.205  11.820
   48    HB2  LYS   7           HB2      LYS   7  59.486  -3.651  12.121
   49    HB3  LYS   7           HB1      LYS   7  59.084  -5.368  12.131
   50    HG2  LYS   7           HG2      LYS   7  59.826  -5.645   9.867
   51    HG3  LYS   7           HG1      LYS   7  59.959  -3.902   9.632
   52    HD2  LYS   7           HD2      LYS   7  62.182  -4.481  10.037
   53    HD3  LYS   7           HD1      LYS   7  61.634  -4.045  11.656
   54    HE2  LYS   7           HE2      LYS   7  61.048  -6.511  11.974
   55    HE3  LYS   7           HE1      LYS   7  61.953  -6.818  10.492
   56    HZ1  LYS   7           HZ1      LYS   7  63.352  -5.142  12.358
   57    HZ2  LYS   7           HZ2      LYS   7  63.884  -6.528  11.531
   58    HZ3  LYS   7           HZ3      LYS   7  63.012  -6.683  12.981
   59    H    ALA   8           HN       ALA   8  56.533  -3.283   8.921
   60    HA   ALA   8           HA       ALA   8  57.981  -0.831   8.544
   61    HB1  ALA   8           HB1      ALA   8  56.864  -1.739   6.640
   62    HB2  ALA   8           HB2      ALA   8  55.984  -0.265   7.043
   63    HB3  ALA   8           HB3      ALA   8  55.327  -1.837   7.499
   64    H    GLU   9           HN       GLU   9  55.583  -1.703  10.788
   65    HA   GLU   9           HA       GLU   9  54.082   0.686  11.064
   66    HB2  GLU   9           HB2      GLU   9  54.960  -1.395  13.076
   67    HB3  GLU   9           HB1      GLU   9  53.927  -0.036  13.521
   68    HG2  GLU   9           HG2      GLU   9  52.608  -2.065  12.939
   69    HG3  GLU   9           HG1      GLU   9  52.265  -0.714  11.857
   70    H1U  RCY  10           H1U      RCY  10  64.463   1.683  10.839
   71    H1S  RCY  10           H1S      RCY  10  61.822   2.727  13.771
   72    HB1  RCY  10           HB1      RCY  10  60.034   1.089  12.441
   73    HB2  RCY  10           HB2      RCY  10  59.158  -0.099  13.405
   74    HA   RCY  10           HA       RCY  10  57.671   2.094  13.950
   75    HN1  RCY  10           HN1      RCY  10  57.318  -0.155  12.212
   76    H    ARG  11           HN       ARG  11  56.852   3.948  12.854
   77    HA   ARG  11           HA       ARG  11  57.551   4.755  10.225
   78    HE   ARG  11           HE       ARG  11  55.993   6.932  15.567
   79    HB2  ARG  11           HB2      ARG  11  57.095   7.124  11.207
   80    HB3  ARG  11           HB1      ARG  11  55.775   5.954  11.207
   81    HG2  ARG  11           HG2      ARG  11  56.117   5.434  13.523
   82    HG3  ARG  11           HG1      ARG  11  57.642   6.319  13.560
   83    HD2  ARG  11           HD2      ARG  11  56.397   8.421  13.070
   84    HD3  ARG  11           HD1      ARG  11  54.886   7.515  13.144
   85   HH11  ARG  11          HH21      ARG  11  55.589   9.847  13.772
   86   HH12  ARG  11          HH22      ARG  11  55.455  10.851  15.177
   87   HH21  ARG  11          HH11      ARG  11  55.820   8.225  17.412
   88   HH22  ARG  11          HH12      ARG  11  55.586   9.933  17.238
   89    H    SER  12           HN       SER  12  59.418   5.584   9.395
   90    HA   SER  12           HA       SER  12  61.742   5.864  11.171
   91    HG   SER  12           HG       SER  12  63.798   5.279   9.392
   92    HB2  SER  12           HB2      SER  12  61.824   4.809   8.862
   93    HB3  SER  12           HB1      SER  12  61.589   6.425   8.199
   94    H    ALA  13           HN       ALA  13  59.406   7.818  11.188
   95    HA   ALA  13           HA       ALA  13  59.257  10.116  11.672
   96    HB1  ALA  13           HB1      ALA  13  61.814   9.638  12.291
   97    HB2  ALA  13           HB2      ALA  13  61.180  11.281  12.214
   98    HB3  ALA  13           HB3      ALA  13  62.089  10.622  10.853
   99    H    THR  14           HN       THR  14  58.416   9.198   9.219
  100    HA   THR  14           HA       THR  14  58.600  11.594   7.603
  101    HB   THR  14           HB       THR  14  59.712   9.121   6.274
  102    HG1  THR  14           HG1      THR  14  61.718   9.753   6.827
  103   HG21  THR  14          HG21      THR  14  58.791  11.154   5.008
  104   HG22  THR  14          HG22      THR  14  60.428  10.644   4.596
  105   HG23  THR  14          HG23      THR  14  60.177  12.038   5.646
  106    H    ARG  15           HN       ARG  15  58.214   9.367   5.302
  107    HA   ARG  15           HA       ARG  15  55.699   8.129   5.956
  108    HE   ARG  15           HE       ARG  15  54.101  13.167   5.511
  109    HB2  ARG  15           HB2      ARG  15  54.361   9.574   4.295
  110    HB3  ARG  15           HB1      ARG  15  54.684  10.274   5.882
  111    HG2  ARG  15           HG2      ARG  15  56.499  11.595   5.019
  112    HG3  ARG  15           HG1      ARG  15  56.452  10.751   3.470
  113    HD2  ARG  15           HD2      ARG  15  55.339  13.017   3.445
  114    HD3  ARG  15           HD1      ARG  15  54.290  11.690   2.945
  115   HH11  ARG  15          HH21      ARG  15  53.077  10.672   3.365
  116   HH12  ARG  15          HH22      ARG  15  51.563  10.419   4.168
  117   HH21  ARG  15          HH11      ARG  15  52.131  12.852   6.573
  118   HH22  ARG  15          HH12      ARG  15  51.028  11.653   5.984
  119    H    VAL  16           HN       VAL  16  57.481   6.680   4.917
  120    HA   VAL  16           HA       VAL  16  58.121   5.361   3.088
  121    HB   VAL  16           HB       VAL  16  55.789   6.576   1.600
  122   HG11  VAL  16          HG11      VAL  16  57.221   5.031   0.351
  123   HG12  VAL  16          HG12      VAL  16  55.666   4.265   0.680
  124   HG13  VAL  16          HG13      VAL  16  57.083   3.832   1.637
  125   HG21  VAL  16          HG21      VAL  16  55.793   4.544   3.844
  126   HG22  VAL  16          HG22      VAL  16  54.472   4.667   2.682
  127   HG23  VAL  16          HG23      VAL  16  54.852   6.031   3.734
  128    H    MET  17           HN       MET  17  59.366   5.564   1.168
  129    HA   MET  17           HA       MET  17  60.534   8.135   0.696
  130    HB2  MET  17           HB2      MET  17  60.584   5.564  -0.905
  131    HB3  MET  17           HB1      MET  17  61.513   6.992  -1.357
  132    HG2  MET  17           HG2      MET  17  63.024   5.704  -0.065
  133    HG3  MET  17           HG1      MET  17  62.431   6.931   1.055
  134    HE1  MET  17           HE1      MET  17  63.390   3.410   0.886
  135    HE2  MET  17           HE2      MET  17  62.118   3.419  -0.332
  136    HE3  MET  17           HE3      MET  17  61.928   2.444   1.123
  137    H    GLY  18           HN       GLY  18  58.898   9.630   0.160
  138    HA2  GLY  18           HA2      GLY  18  57.611   9.189  -2.509
  139    HA3  GLY  18           HA1      GLY  18  56.778  10.009  -1.187
  140    H    GLY  19           HN       GLY  19  57.561  11.014  -3.898
  141    HA2  GLY  19           HA2      GLY  19  57.975  13.649  -3.595
  142    HA3  GLY  19           HA1      GLY  19  59.606  13.056  -3.273
  143    HA   PRO  20           HA       PRO  20  57.928  12.634  -8.006
  144    HB2  PRO  20           HB2      PRO  20  58.454  15.587  -8.082
  145    HB3  PRO  20           HB1      PRO  20  57.298  14.625  -9.024
  146    HG2  PRO  20           HG2      PRO  20  56.517  16.100  -6.947
  147    HG3  PRO  20           HG1      PRO  20  55.772  14.534  -7.305
  148    HD2  PRO  20           HD2      PRO  20  57.627  15.265  -5.098
  149    HD3  PRO  20           HD1      PRO  20  56.414  13.968  -5.170
  150    H1U  RCY  21           H1U      RCY  21  66.793  12.855  -1.879
  151    H1S  RCY  21           H1S      RCY  21  64.413  12.359  -3.450
  152    HB1  RCY  21           HB1      RCY  21  62.487  14.807  -5.534
  153    HB2  RCY  21           HB2      RCY  21  63.985  14.552  -6.426
  154    HA   RCY  21           HA       RCY  21  62.428  14.458  -8.154
  155    HN1  RCY  21           HN1      RCY  21  60.495  13.893  -6.127
  156    H    THR  22           HN       THR  22  63.794  13.110  -9.307
  157    HA   THR  22           HA       THR  22  63.562  10.174  -8.777
  158    HB   THR  22           HB       THR  22  62.274  10.783 -10.788
  159    HG1  THR  22           HG1      THR  22  63.012   9.003 -11.575
  160   HG21  THR  22          HG21      THR  22  63.714  12.842 -11.237
  161   HG22  THR  22          HG22      THR  22  63.269  11.891 -12.654
  162   HG23  THR  22          HG23      THR  22  64.887  11.745 -11.966
  163    HA   PRO  23           HA       PRO  23  67.977  10.159  -8.224
  164    HB2  PRO  23           HB2      PRO  23  67.807   7.784 -10.051
  165    HB3  PRO  23           HB1      PRO  23  68.665   7.957  -8.507
  166    HG2  PRO  23           HG2      PRO  23  66.321   6.672  -8.703
  167    HG3  PRO  23           HG1      PRO  23  66.780   7.594  -7.263
  168    HD2  PRO  23           HD2      PRO  23  64.727   8.221  -9.294
  169    HD3  PRO  23           HD1      PRO  23  64.898   8.841  -7.639
  170    H    ARG  24           HN       ARG  24  69.546  11.274  -9.340
  171    HA   ARG  24           HA       ARG  24  69.141  12.351 -11.916
  172    HE   ARG  24           HE       ARG  24  70.480   9.939  -7.807
  173    HB2  ARG  24           HB2      ARG  24  71.949  12.103 -11.620
  174    HB3  ARG  24           HB1      ARG  24  70.961  13.507 -11.230
  175    HG2  ARG  24           HG2      ARG  24  72.205  12.888  -9.242
  176    HG3  ARG  24           HG1      ARG  24  70.509  12.481  -8.976
  177    HD2  ARG  24           HD2      ARG  24  71.295  10.155 -10.035
  178    HD3  ARG  24           HD1      ARG  24  72.851  10.675  -9.388
  179   HH11  ARG  24          HH21      ARG  24  73.565  11.466  -8.001
  180   HH12  ARG  24          HH22      ARG  24  73.868  11.370  -6.298
  181   HH21  ARG  24          HH11      ARG  24  70.857   9.805  -5.582
  182   HH22  ARG  24          HH12      ARG  24  72.335  10.430  -4.929
  183    H    LYS  25           HN       LYS  25  68.441  10.673 -13.328
  184    HA   LYS  25           HA       LYS  25  68.721   8.925 -14.870
  185    HB2  LYS  25           HB2      LYS  25  71.690   9.457 -14.656
  186    HB3  LYS  25           HB1      LYS  25  70.779   8.899 -16.058
  187    HG2  LYS  25           HG2      LYS  25  70.259  11.594 -14.796
  188    HG3  LYS  25           HG1      LYS  25  71.481  11.375 -16.049
  189    HD2  LYS  25           HD2      LYS  25  69.791  10.491 -17.585
  190    HD3  LYS  25           HD1      LYS  25  68.557  10.616 -16.330
  191    HE2  LYS  25           HE2      LYS  25  68.908  13.064 -16.238
  192    HE3  LYS  25           HE1      LYS  25  70.117  12.932 -17.515
  193    HZ1  LYS  25           HZ1      LYS  25  67.217  12.359 -17.688
  194    HZ2  LYS  25           HZ2      LYS  25  68.322  11.850 -18.875
  195    HZ3  LYS  25           HZ3      LYS  25  68.109  13.507 -18.564
  196    H    GLY  26           HN       GLY  26  68.088   7.314 -13.323
  197    HA2  GLY  26           HA2      GLY  26  70.346   5.847 -12.034
  198    HA3  GLY  26           HA1      GLY  26  68.681   5.801 -11.470
  199    HA   PRO  27           HA       PRO  27  67.234   2.892 -14.702
  200    HB2  PRO  27           HB2      PRO  27  68.453   4.234 -17.098
  201    HB3  PRO  27           HB1      PRO  27  66.880   3.423 -16.943
  202    HG2  PRO  27           HG2      PRO  27  67.074   6.074 -16.886
  203    HG3  PRO  27           HG1      PRO  27  65.925   5.219 -15.845
  204    HD2  PRO  27           HD2      PRO  27  68.461   6.592 -15.105
  205    HD3  PRO  27           HD1      PRO  27  67.015   6.284 -14.118
  206    HA   PRO  28           HA       PRO  28  70.644   0.051 -14.626
  207    HB2  PRO  28           HB2      PRO  28  69.484  -0.894 -17.228
  208    HB3  PRO  28           HB1      PRO  28  70.003  -1.839 -15.818
  209    HG2  PRO  28           HG2      PRO  28  67.421  -1.302 -16.313
  210    HG3  PRO  28           HG1      PRO  28  68.066  -1.443 -14.670
  211    HD2  PRO  28           HD2      PRO  28  67.117   0.964 -16.089
  212    HD3  PRO  28           HD1      PRO  28  67.355   0.706 -14.348
  213    H    LYS  29           HN       LYS  29  72.716   0.400 -15.240
  214    HA   LYS  29           HA       LYS  29  73.985   0.374 -17.618
  215    HB2  LYS  29           HB2      LYS  29  72.715   1.964 -18.789
  216    HB3  LYS  29           HB1      LYS  29  72.526   3.001 -17.374
  217    HG2  LYS  29           HG2      LYS  29  74.715   3.845 -17.545
  218    HG3  LYS  29           HG1      LYS  29  75.253   2.501 -18.553
  219    HD2  LYS  29           HD2      LYS  29  73.716   3.313 -20.360
  220    HD3  LYS  29           HD1      LYS  29  73.356   4.722 -19.362
  221    HE2  LYS  29           HE2      LYS  29  75.690   5.405 -19.395
  222    HE3  LYS  29           HE1      LYS  29  76.144   3.933 -20.253
  223    HZ1  LYS  29           HZ1      LYS  29  75.449   4.759 -22.192
  224    HZ2  LYS  29           HZ2      LYS  29  75.519   6.275 -21.427
  225    HZ3  LYS  29           HZ3      LYS  29  74.044   5.437 -21.527
  226    H1U  RCY  30           H1U      RCY  30  76.070   5.036 -12.712
  227    H1S  RCY  30           H1S      RCY  30  77.102   0.899 -12.972
  228    HB1  RCY  30           HB1      RCY  30  78.602   0.146 -16.055
  229    HB2  RCY  30           HB2      RCY  30  77.529  -0.721 -14.958
  230    HA   RCY  30           HA       RCY  30  76.675   1.599 -14.237
  231    HN1  RCY  30           HN1      RCY  30  75.936   0.108 -16.605
  232    H    LYS  31           HN       LYS  31  77.539   3.617 -14.168
  233    HA   LYS  31           HA       LYS  31  78.230   4.956 -16.696
  234    HB2  LYS  31           HB2      LYS  31  78.847   6.604 -14.427
  235    HB3  LYS  31           HB1      LYS  31  77.525   6.786 -15.577
  236    HG2  LYS  31           HG2      LYS  31  77.434   4.904 -13.202
  237    HG3  LYS  31           HG1      LYS  31  76.772   6.539 -13.182
  238    HD2  LYS  31           HD2      LYS  31  75.934   4.883 -15.484
  239    HD3  LYS  31           HD1      LYS  31  75.342   4.334 -13.916
  240    HE2  LYS  31           HE2      LYS  31  73.782   5.950 -14.976
  241    HE3  LYS  31           HE1      LYS  31  74.428   6.562 -13.453
  242    HZ1  LYS  31           HZ1      LYS  31  74.431   8.094 -15.491
  243    HZ2  LYS  31           HZ2      LYS  31  75.763   7.177 -16.009
  244    HZ3  LYS  31           HZ3      LYS  31  75.832   8.023 -14.538
  245    H    GLN  32           HN       GLN  32  80.279   6.649 -15.984
  246    HA   GLN  32           HA       GLN  32  82.489   5.310 -14.698
  247    HB2  GLN  32           HB2      GLN  32  83.838   5.051 -16.849
  248    HB3  GLN  32           HB1      GLN  32  82.547   3.872 -16.616
  249    HG2  GLN  32           HG2      GLN  32  81.058   5.188 -18.059
  250    HG3  GLN  32           HG1      GLN  32  82.318   6.405 -18.269
  251   HE21  GLN  32          HE21      GLN  32  81.047   3.522 -19.589
  252   HE22  GLN  32          HE22      GLN  32  82.345   3.139 -20.613
  253    H    ARG  33           HN       ARG  33  81.579   7.817 -14.277
  254    HA   ARG  33           HA       ARG  33  83.075   9.723 -15.960
  255    HE   ARG  33           HE       ARG  33  79.725  13.206 -15.318
  256    HB2  ARG  33           HB2      ARG  33  81.438  10.220 -13.454
  257    HB3  ARG  33           HB1      ARG  33  82.003  11.440 -14.597
  258    HG2  ARG  33           HG2      ARG  33  80.663  10.396 -16.383
  259    HG3  ARG  33           HG1      ARG  33  80.097   9.172 -15.246
  260    HD2  ARG  33           HD2      ARG  33  78.357  10.652 -15.013
  261    HD3  ARG  33           HD1      ARG  33  79.458  11.380 -13.844
  262   HH11  ARG  33          HH21      ARG  33  78.357  10.453 -16.878
  263   HH12  ARG  33          HH22      ARG  33  78.022  11.291 -18.356
  264   HH21  ARG  33          HH11      ARG  33  79.295  14.316 -17.240
  265   HH22  ARG  33          HH12      ARG  33  78.553  13.478 -18.561
  266    H    GLN  34           HN       GLN  34  82.947  10.607 -12.666
  267    HA   GLN  34           HA       GLN  34  85.879  10.579 -12.518
  268    HB2  GLN  34           HB2      GLN  34  85.274  11.537 -10.138
  269    HB3  GLN  34           HB1      GLN  34  85.015  12.532 -11.569
  270    HG2  GLN  34           HG2      GLN  34  83.052  12.492  -9.994
  271    HG3  GLN  34           HG1      GLN  34  82.665  11.948 -11.627
  272   HE21  GLN  34          HE21      GLN  34  82.305   9.627 -11.958
  273   HE22  GLN  34          HE22      GLN  34  82.007   8.591 -10.647
  274    H    THR  35           HN       THR  35  86.221  10.112  -9.743
  275    HA   THR  35           HA       THR  35  86.762   8.281  -8.374
  276    HB   THR  35           HB       THR  35  84.743   6.724  -8.012
  277    HG1  THR  35           HG1      THR  35  83.089   8.559  -9.143
  278   HG21  THR  35          HG21      THR  35  85.078   8.480  -6.450
  279   HG22  THR  35          HG22      THR  35  83.405   8.657  -6.976
  280   HG23  THR  35          HG23      THR  35  84.652   9.718  -7.631
  281    H    ARG  36           HN       ARG  36  88.378   7.245  -9.577
  282    HA   ARG  36           HA       ARG  36  87.461   4.982 -11.319
  283    HE   ARG  36           HE       ARG  36  90.946   8.002 -12.623
  284    HB2  ARG  36           HB2      ARG  36  90.120   6.432 -11.474
  285    HB3  ARG  36           HB1      ARG  36  89.487   5.241 -12.609
  286    HG2  ARG  36           HG2      ARG  36  88.839   7.116 -13.760
  287    HG3  ARG  36           HG1      ARG  36  87.459   7.031 -12.664
  288    HD2  ARG  36           HD2      ARG  36  88.441   9.305 -12.705
  289    HD3  ARG  36           HD1      ARG  36  88.580   8.570 -11.108
  290   HH11  ARG  36          HH21      ARG  36  89.219  10.532 -11.039
  291   HH12  ARG  36          HH22      ARG  36  90.640  11.449 -10.666
  292   HH21  ARG  36          HH11      ARG  36  92.811   9.186 -12.145
  293   HH22  ARG  36          HH12      ARG  36  92.674  10.687 -11.292
  294    H    GLN  37           HN       GLN  37  89.049   5.877  -8.453
  295    HA   GLN  37           HA       GLN  37  90.806   3.519  -8.350
  296    HB2  GLN  37           HB2      GLN  37  90.110   5.512  -6.172
  297    HB3  GLN  37           HB1      GLN  37  91.443   4.356  -6.148
  298    HG2  GLN  37           HG2      GLN  37  92.558   5.468  -7.956
  299    HG3  GLN  37           HG1      GLN  37  91.146   6.471  -8.292
  300   HE21  GLN  37          HE21      GLN  37  93.985   6.151  -6.271
  301   HE22  GLN  37          HE22      GLN  37  93.758   7.581  -5.386
  302    H1U  RCY  38           H1U      RCY  38  84.408   0.177  -3.065
  303    H1S  RCY  38           H1S      RCY  38  85.042   3.185  -6.809
  304    HB1  RCY  38           HB1      RCY  38  86.144  -0.130  -7.640
  305    HB2  RCY  38           HB2      RCY  38  87.277   0.265  -8.931
  306    HA   RCY  38           HA       RCY  38  87.186   1.718  -6.272
  307    HN1  RCY  38           HN1      RCY  38  88.958   1.980  -8.636
  308    H    LYS  39           HN       LYS  39  88.991  -0.674  -8.229
  309    HA   LYS  39           HA       LYS  39  89.351  -2.355  -5.861
  310    HB2  LYS  39           HB2      LYS  39  90.000  -2.589  -8.787
  311    HB3  LYS  39           HB1      LYS  39  90.788  -3.672  -7.639
  312    HG2  LYS  39           HG2      LYS  39  88.674  -4.626  -8.569
  313    HG3  LYS  39           HG1      LYS  39  88.625  -4.442  -6.816
  314    HD2  LYS  39           HD2      LYS  39  87.307  -2.440  -6.979
  315    HD3  LYS  39           HD1      LYS  39  87.542  -2.357  -8.725
  316    HE2  LYS  39           HE2      LYS  39  86.207  -4.317  -9.086
  317    HE3  LYS  39           HE1      LYS  39  86.171  -4.685  -7.361
  318    HZ1  LYS  39           HZ1      LYS  39  84.931  -2.651  -6.984
  319    HZ2  LYS  39           HZ2      LYS  39  84.115  -3.647  -8.093
  320    HZ3  LYS  39           HZ3      LYS  39  84.973  -2.286  -8.640
  321    H    SER  40           HN       SER  40  91.359  -2.847  -4.913
  322    HA   SER  40           HA       SER  40  93.917  -2.023  -5.713
  323    HG   SER  40           HG       SER  40  94.454   0.985  -3.763
  324    HB2  SER  40           HB2      SER  40  93.522   0.266  -5.627
  325    HB3  SER  40           HB1      SER  40  92.308   0.112  -4.360
  326    H    LYS  41           HN       LYS  41  92.354  -1.299  -2.590
  327    HA   LYS  41           HA       LYS  41  93.873  -3.590  -1.395
  328    HB2  LYS  41           HB2      LYS  41  94.087  -2.198   0.659
  329    HB3  LYS  41           HB1      LYS  41  94.915  -1.484  -0.725
  330    HG2  LYS  41           HG2      LYS  41  92.407  -0.409  -0.986
  331    HG3  LYS  41           HG1      LYS  41  92.565  -0.503   0.768
  332    HD2  LYS  41           HD2      LYS  41  94.713   0.699   0.647
  333    HD3  LYS  41           HD1      LYS  41  94.569   0.786  -1.109
  334    HE2  LYS  41           HE2      LYS  41  92.665   2.022   0.903
  335    HE3  LYS  41           HE1      LYS  41  93.814   2.892  -0.113
  336    HZ1  LYS  41           HZ1      LYS  41  91.359   1.463  -0.903
  337    HZ2  LYS  41           HZ2      LYS  41  92.605   1.721  -2.029
  338    HZ3  LYS  41           HZ3      LYS  41  91.842   3.044  -1.284
  339    HA   PRO  42           HA       PRO  42  89.387  -4.026  -0.422
  340    HB2  PRO  42           HB2      PRO  42  89.113  -6.618  -1.171
  341    HB3  PRO  42           HB1      PRO  42  89.074  -5.285  -2.341
  342    HG2  PRO  42           HG2      PRO  42  91.256  -7.197  -1.729
  343    HG3  PRO  42           HG1      PRO  42  90.791  -6.467  -3.273
  344    HD2  PRO  42           HD2      PRO  42  92.915  -5.615  -1.660
  345    HD3  PRO  42           HD1      PRO  42  92.158  -4.659  -2.953
  346    HA   PRO  43           HA       PRO  43  89.924  -5.945   3.534
  347    HB2  PRO  43           HB2      PRO  43  87.440  -7.034   3.969
  348    HB3  PRO  43           HB1      PRO  43  87.779  -5.296   4.076
  349    HG2  PRO  43           HG2      PRO  43  86.542  -6.843   1.856
  350    HG3  PRO  43           HG1      PRO  43  86.128  -5.239   2.484
  351    HD2  PRO  43           HD2      PRO  43  87.580  -5.597   0.195
  352    HD3  PRO  43           HD1      PRO  43  87.779  -4.179   1.249
  353    H    LYS  44           HN       LYS  44  89.849  -8.082   4.686
  354    HA   LYS  44           HA       LYS  44  91.072 -10.173   3.357
  355    HB2  LYS  44           HB2      LYS  44  90.797 -10.158   5.789
  356    HB3  LYS  44           HB1      LYS  44  89.059 -10.399   5.615
  357    HG2  LYS  44           HG2      LYS  44  89.331 -12.596   4.773
  358    HG3  LYS  44           HG1      LYS  44  91.042 -12.340   4.428
  359    HD2  LYS  44           HD2      LYS  44  90.960 -13.661   6.423
  360    HD3  LYS  44           HD1      LYS  44  91.371 -12.024   6.936
  361    HE2  LYS  44           HE2      LYS  44  88.525 -12.219   6.846
  362    HE3  LYS  44           HE1      LYS  44  89.133 -13.614   7.737
  363    HZ1  LYS  44           HZ1      LYS  44  89.864 -10.784   8.261
  364    HZ2  LYS  44           HZ2      LYS  44  90.422 -12.133   9.129
  365    HZ3  LYS  44           HZ3      LYS  44  88.779 -11.705   9.183
  366    H    LYS  45           HN       LYS  45  87.736 -10.829   4.367
  367    HA   LYS  45           HA       LYS  45  86.775 -11.212   1.649
  368    HB2  LYS  45           HB2      LYS  45  88.300 -13.242   2.180
  369    HB3  LYS  45           HB1      LYS  45  87.016 -13.741   3.280
  370    HG2  LYS  45           HG2      LYS  45  85.592 -13.117   1.014
  371    HG3  LYS  45           HG1      LYS  45  87.079 -13.778   0.333
  372    HD2  LYS  45           HD2      LYS  45  85.356 -15.132   2.429
  373    HD3  LYS  45           HD1      LYS  45  85.409 -15.559   0.719
  374    HE2  LYS  45           HE2      LYS  45  86.980 -17.058   1.459
  375    HE3  LYS  45           HE1      LYS  45  88.046 -15.665   1.273
  376    HZ1  LYS  45           HZ1      LYS  45  87.473 -17.069   3.602
  377    HZ2  LYS  45           HZ2      LYS  45  86.764 -15.535   3.774
  378    HZ3  LYS  45           HZ3      LYS  45  88.424 -15.673   3.439
  379    H    GLY  46           HN       GLY  46  86.338 -10.816   4.943
  380    HA2  GLY  46           HA2      GLY  46  84.400 -10.568   6.245
  381    HA3  GLY  46           HA1      GLY  46  83.506 -10.479   4.726
  382    H    VAL  47           HN       VAL  47  81.875 -11.957   4.874
  383    HA   VAL  47           HA       VAL  47  82.608 -14.788   5.290
  384    HB   VAL  47           HB       VAL  47  80.817 -15.118   6.978
  385   HG11  VAL  47          HG11      VAL  47  83.246 -14.596   7.575
  386   HG12  VAL  47          HG12      VAL  47  82.060 -14.282   8.842
  387   HG13  VAL  47          HG13      VAL  47  82.713 -12.946   7.895
  388   HG21  VAL  47          HG21      VAL  47  79.327 -13.307   6.531
  389   HG22  VAL  47          HG22      VAL  47  80.613 -12.112   6.697
  390   HG23  VAL  47          HG23      VAL  47  80.013 -12.966   8.119
  391    H    GLN  48           HN       GLN  48  80.211 -12.342   4.440
  392    HA   GLN  48           HA       GLN  48  78.362 -14.285   3.280
  393    HB2  GLN  48           HB2      GLN  48  78.531 -11.290   3.423
  394    HB3  GLN  48           HB1      GLN  48  77.459 -12.025   2.230
  395    HG2  GLN  48           HG2      GLN  48  77.410 -12.846   5.138
  396    HG3  GLN  48           HG1      GLN  48  76.435 -11.508   4.530
  397   HE21  GLN  48          HE21      GLN  48  76.770 -13.671   1.994
  398   HE22  GLN  48          HE22      GLN  48  75.344 -14.565   2.214
  399    H    GLY  49           HN       GLY  49  79.172 -11.513   1.344
  400    HA2  GLY  49           HA2      GLY  49  81.076 -12.760  -0.405
  401    HA3  GLY  49           HA1      GLY  49  79.450 -12.963  -1.059
  402    H1U  RCY  50           H1U      RCY  50  79.733  -2.302  -3.909
  403    H1S  RCY  50           H1S      RCY  50  82.081  -6.345  -3.081
  404    HB1  RCY  50           HB1      RCY  50  79.651  -8.490   0.050
  405    HB2  RCY  50           HB2      RCY  50  79.113  -7.117  -0.912
  406    HA   RCY  50           HA       RCY  50  77.910  -8.709  -2.026
  407    HN1  RCY  50           HN1      RCY  50  78.155 -10.924  -1.298
  408    H    GLY  51           HN       GLY  51  81.144 -10.090  -2.626
  409    HA2  GLY  51           HA2      GLY  51  80.787  -9.843  -5.493
  410    HA3  GLY  51           HA1      GLY  51  81.926  -8.648  -4.870
  411    H    ASP  52           HN       ASP  52  82.337 -10.981  -2.722
  412    HA   ASP  52           HA       ASP  52  84.847 -11.865  -3.741
  413    HB2  ASP  52           HB2      ASP  52  83.181 -13.403  -1.739
  414    HB3  ASP  52           HB1      ASP  52  84.940 -13.304  -1.845
  415    H    ASP  53           HN       ASP  53  81.839 -12.605  -4.887
  416    HA   ASP  53           HA       ASP  53  82.874 -14.999  -6.279
  417    HB2  ASP  53           HB2      ASP  53  80.380 -15.007  -4.556
  418    HB3  ASP  53           HB1      ASP  53  80.739 -16.247  -5.758
  419    H    ILE  54           HN       ILE  54  79.935 -13.016  -5.772
  420    HA   ILE  54           HA       ILE  54  79.797 -12.619  -8.717
  421    HB   ILE  54           HB       ILE  54  77.570 -13.649  -6.940
  422   HG12  ILE  54          HG12      ILE  54  79.114 -15.313  -7.967
  423   HG13  ILE  54          HG11      ILE  54  77.476 -15.446  -8.608
  424   HG21  ILE  54          HG21      ILE  54  76.518 -11.956  -8.232
  425   HG22  ILE  54          HG22      ILE  54  76.222 -13.448  -9.125
  426   HG23  ILE  54          HG23      ILE  54  77.482 -12.335  -9.659
  427   HD11  ILE  54          HD11      ILE  54  78.540 -13.628 -10.335
  428   HD12  ILE  54          HD12      ILE  54  78.530 -15.367 -10.629
  429   HD13  ILE  54          HD13      ILE  54  79.967 -14.594  -9.961
  430    HA   PRO  55           HA       PRO  55  79.108  -8.593  -6.735
  431    HB2  PRO  55           HB2      PRO  55  79.758  -7.047  -8.867
  432    HB3  PRO  55           HB1      PRO  55  80.987  -7.860  -7.877
  433    HG2  PRO  55           HG2      PRO  55  79.908  -8.618 -10.541
  434    HG3  PRO  55           HG1      PRO  55  81.559  -8.742  -9.912
  435    HD2  PRO  55           HD2      PRO  55  79.773 -10.866 -10.058
  436    HD3  PRO  55           HD1      PRO  55  81.174 -10.801  -8.967
  437    H    GLY  56           HN       GLY  56  76.789  -8.847  -6.588
  438    HA2  GLY  56           HA2      GLY  56  75.008  -7.159  -7.523
  439    HA3  GLY  56           HA1      GLY  56  75.224  -8.089  -9.007
  440    H    MET  57           HN       MET  57  75.642 -10.007  -6.251
  441    HA   MET  57           HA       MET  57  73.333 -11.618  -6.843
  442    HB2  MET  57           HB2      MET  57  75.572 -12.235  -5.624
  443    HB3  MET  57           HB1      MET  57  74.730 -11.687  -4.176
  444    HG2  MET  57           HG2      MET  57  72.799 -13.236  -5.001
  445    HG3  MET  57           HG1      MET  57  74.047 -13.988  -5.996
  446    HE1  MET  57           HE1      MET  57  76.437 -14.296  -4.984
  447    HE2  MET  57           HE2      MET  57  76.771 -14.820  -3.335
  448    HE3  MET  57           HE3      MET  57  76.491 -13.113  -3.671
  449    H    GLU  58           HN       GLU  58  73.320  -8.616  -5.654
  450    HA   GLU  58           HA       GLU  58  71.078  -9.144  -3.734
  451    HB2  GLU  58           HB2      GLU  58  72.896  -6.722  -3.929
  452    HB3  GLU  58           HB1      GLU  58  71.607  -6.953  -2.747
  453    HG2  GLU  58           HG2      GLU  58  72.752  -8.713  -1.664
  454    HG3  GLU  58           HG1      GLU  58  73.834  -8.968  -3.034
  455    H    GLY  59           HN       GLY  59  72.211  -6.961  -6.321
  456    HA2  GLY  59           HA2      GLY  59  70.932  -5.907  -8.004
  457    HA3  GLY  59           HA1      GLY  59  69.514  -6.770  -7.404
  458    H1U  RCY  60           H1U      RCY  60  71.130   3.011  -5.187
  459    H1S  RCY  60           H1S      RCY  60  70.911  -0.628  -7.729
  460    HB1  RCY  60           HB1      RCY  60  67.843  -1.431  -6.088
  461    HB2  RCY  60           HB2      RCY  60  67.057  -2.529  -7.222
  462    HA   RCY  60           HA       RCY  60  68.772  -3.217  -4.833
  463    HN1  RCY  60           HN1      RCY  60  67.984  -5.380  -6.678
  464    H    GLY  61           HN       GLY  61  67.436  -3.577  -3.159
  465    HA2  GLY  61           HA2      GLY  61  64.778  -3.193  -2.901
  466    HA3  GLY  61           HA1      GLY  61  64.797  -4.822  -3.584
  467    H    THR  62           HN       THR  62  67.265  -5.627  -2.309
  468    HA   THR  62           HA       THR  62  66.181  -6.227   0.373
  469    HB   THR  62           HB       THR  62  68.261  -7.694   0.494
  470    HG1  THR  62           HG1      THR  62  68.870  -6.236  -1.615
  471   HG21  THR  62          HG21      THR  62  67.381  -9.261  -1.341
  472   HG22  THR  62          HG22      THR  62  66.195  -8.002  -1.687
  473   HG23  THR  62          HG23      THR  62  66.229  -8.770  -0.100
  474    H    ASP  63           HN       ASP  63  66.450  -3.932   1.083
  475    HA   ASP  63           HA       ASP  63  69.046  -2.709   1.245
  476    HB2  ASP  63           HB2      ASP  63  66.651  -2.232   3.042
  477    HB3  ASP  63           HB1      ASP  63  67.999  -1.127   2.765
  478    H    ILE  64           HN       ILE  64  68.438  -5.554   2.438
  479    HA   ILE  64           HA       ILE  64  69.824  -5.053   5.049
  480    HB   ILE  64           HB       ILE  64  67.760  -7.135   4.290
  481   HG12  ILE  64          HG12      ILE  64  67.865  -5.243   6.653
  482   HG13  ILE  64          HG11      ILE  64  67.083  -4.822   5.128
  483   HG21  ILE  64          HG21      ILE  64  68.194  -7.907   6.717
  484   HG22  ILE  64          HG22      ILE  64  69.729  -7.049   6.578
  485   HG23  ILE  64          HG23      ILE  64  69.367  -8.393   5.494
  486   HD11  ILE  64          HD11      ILE  64  65.493  -6.590   5.343
  487   HD12  ILE  64          HD12      ILE  64  65.561  -5.816   6.927
  488   HD13  ILE  64          HD13      ILE  64  66.402  -7.342   6.655
  489    H    THR  65           HN       THR  65  69.809  -6.699   2.015
  490    HA   THR  65           HA       THR  65  71.103  -8.528   1.235
  491    HB   THR  65           HB       THR  65  72.431  -6.226   1.199
  492    HG1  THR  65           HG1      THR  65  74.233  -8.222   0.833
  493   HG21  THR  65          HG21      THR  65  73.207  -6.961   3.648
  494   HG22  THR  65          HG22      THR  65  74.276  -6.061   2.572
  495   HG23  THR  65          HG23      THR  65  74.449  -7.809   2.726
  496    H    VAL  66           HN       VAL  66  70.096  -9.021   3.876
  497    HA   VAL  66           HA       VAL  66  70.374 -10.645   5.535
  498    HB   VAL  66           HB       VAL  66  73.033 -11.396   4.325
  499   HG11  VAL  66          HG11      VAL  66  72.367 -13.627   5.077
  500   HG12  VAL  66          HG12      VAL  66  70.786 -13.015   5.562
  501   HG13  VAL  66          HG13      VAL  66  72.235 -12.488   6.418
  502   HG21  VAL  66          HG21      VAL  66  71.753 -11.357   2.358
  503   HG22  VAL  66          HG22      VAL  66  70.267 -11.790   3.204
  504   HG23  VAL  66          HG23      VAL  66  71.512 -13.009   2.928
  505    H    ILE  67           HN       ILE  67  73.338  -8.853   4.694
  506    HA   ILE  67           HA       ILE  67  73.682  -8.291   7.605
  507    HB   ILE  67           HB       ILE  67  75.968  -8.997   5.745
  508   HG12  ILE  67          HG12      ILE  67  74.437 -10.641   7.774
  509   HG13  ILE  67          HG11      ILE  67  74.730 -11.020   6.077
  510   HG21  ILE  67          HG21      ILE  67  76.311  -7.451   7.772
  511   HG22  ILE  67          HG22      ILE  67  77.335  -8.885   7.688
  512   HG23  ILE  67          HG23      ILE  67  75.938  -8.861   8.764
  513   HD11  ILE  67          HD11      ILE  67  77.240 -10.956   6.701
  514   HD12  ILE  67          HD12      ILE  67  76.303 -12.353   7.231
  515   HD13  ILE  67          HD13      ILE  67  76.687 -11.064   8.372
  516    H1U  RCY  68           H1U      RCY  68  72.851   1.071   4.651
  517    H1S  RCY  68           H1S      RCY  68  73.287  -2.726   3.083
  518    HB1  RCY  68           HB1      RCY  68  72.730  -2.801   5.844
  519    HB2  RCY  68           HB2      RCY  68  71.826  -4.165   6.492
  520    HA   RCY  68           HA       RCY  68  74.707  -4.427   5.610
  521    HN1  RCY  68           HN1      RCY  68  73.041  -6.141   7.417
  522    HA   PRO  69           HA       PRO  69  76.607  -2.084   8.813
  523    HB2  PRO  69           HB2      PRO  69  74.667   0.110   8.187
  524    HB3  PRO  69           HB1      PRO  69  76.430   0.183   8.363
  525    HG2  PRO  69           HG2      PRO  69  75.076   0.078   5.964
  526    HG3  PRO  69           HG1      PRO  69  76.780  -0.327   6.200
  527    HD2  PRO  69           HD2      PRO  69  74.657  -2.104   5.443
  528    HD3  PRO  69           HD1      PRO  69  76.356  -2.519   5.758
  529    H    TRP  70           HN       TRP  70  73.064  -2.070   8.689
  530    HA   TRP  70           HA       TRP  70  72.724  -1.304  11.463
  531    HD1  TRP  70           HD1      TRP  70  72.696   0.321   9.675
  532    HE1  TRP  70           HE1      TRP  70  71.988   1.603   7.555
  533    HE3  TRP  70           HE3      TRP  70  68.662  -2.472   8.262
  534    HZ2  TRP  70           HZ2      TRP  70  69.973   1.463   5.524
  535    HZ3  TRP  70           HZ3      TRP  70  67.369  -1.878   6.236
  536    HH2  TRP  70           HH2      TRP  70  68.016   0.083   4.866
  537    HB2  TRP  70           HB2      TRP  70  70.683  -2.889   9.917
  538    HB3  TRP  70           HB1      TRP  70  70.428  -1.600  11.094
  539    H    GLU  71           HN       GLU  71  74.382  -3.809  10.540
  540    HA   GLU  71           HA       GLU  71  73.397  -5.521  12.759
  541    HB2  GLU  71           HB2      GLU  71  73.740  -6.393   9.885
  542    HB3  GLU  71           HB1      GLU  71  73.808  -7.543  11.220
  543    HG2  GLU  71           HG2      GLU  71  71.497  -5.633  10.783
  544    HG3  GLU  71           HG1      GLU  71  71.517  -7.290  10.177
  545    H    ALA  72           HN       ALA  72  75.794  -6.055  10.164
  546    HA   ALA  72           HA       ALA  72  77.797  -6.841  12.128
  547    HB1  ALA  72           HB1      ALA  72  79.288  -7.005  10.110
  548    HB2  ALA  72           HB2      ALA  72  77.953  -6.391   9.135
  549    HB3  ALA  72           HB3      ALA  72  77.798  -7.937   9.969
  550    H1U  RCY  73           H1U      RCY  73  78.173  -1.073   3.156
  551    H1S  RCY  73           H1S      RCY  73  80.243  -0.189   7.098
  552    HB1  RCY  73           HB1      RCY  73  78.676  -1.248   9.252
  553    HB2  RCY  73           HB2      RCY  73  78.823  -2.790   8.413
  554    HA   RCY  73           HA       RCY  73  80.363  -3.048  10.769
  555    HN1  RCY  73           HN1      RCY  73  78.357  -4.516   9.492
  556    H    ASN  74           HN       ASN  74  77.084  -3.250  11.629
  557    HA   ASN  74           HA       ASN  74  75.806  -2.129  13.238
  558    HB2  ASN  74           HB2      ASN  74  78.007  -2.656  14.500
  559    HB3  ASN  74           HB1      ASN  74  78.390  -0.950  14.262
  560   HD21  ASN  74          HD21      ASN  74  77.670   0.378  15.926
  561   HD22  ASN  74          HD22      ASN  74  76.354   0.044  16.945
  562    H    HIS  75           HN       HIS  75  76.492   0.443  14.447
  563    HA   HIS  75           HA       HIS  75  75.378   2.180  12.449
  564    HD1  HIS  75           HD1      HIS  75  74.787   4.248  12.176
  565    HD2  HIS  75           HD2      HIS  75  76.841   5.563  15.560
  566    HE1  HIS  75           HE1      HIS  75  74.888   6.774  12.015
  567    HE2  HIS  75           HE2      HIS  75  76.136   7.587  14.069
  568    HB2  HIS  75           HB2      HIS  75  75.026   2.617  14.821
  569    HB3  HIS  75           HB1      HIS  75  76.762   2.804  15.074
  570    H1U  RCY  76           H1U      RCY  76  77.735   1.246   3.409
  571    H1S  RCY  76           H1S      RCY  76  78.042   3.422   7.474
  572    HB1  RCY  76           HB1      RCY  76  80.113   3.075   9.524
  573    HB2  RCY  76           HB2      RCY  76  79.118   4.134  10.522
  574    HA   RCY  76           HA       RCY  76  80.271   1.437  11.177
  575    HN1  RCY  76           HN1      RCY  76  78.367   0.879  12.422
  576    H    GLU  77           HN       GLU  77  82.112   2.926  11.355
  577    HA   GLU  77           HA       GLU  77  82.748   3.640  13.983
  578    HB2  GLU  77           HB2      GLU  77  83.978   3.879  11.428
  579    HB3  GLU  77           HB1      GLU  77  84.076   5.470  12.178
  580    HG2  GLU  77           HG2      GLU  77  84.880   2.901  13.573
  581    HG3  GLU  77           HG1      GLU  77  86.016   3.958  12.734
  582    H    LEU  78           HN       LEU  78  82.796   5.672  15.089
  583    HA   LEU  78           HA       LEU  78  80.526   7.197  15.193
  584    HG   LEU  78           HG       LEU  78  83.955   7.803  14.541
  585    HB2  LEU  78           HB2      LEU  78  81.824   8.963  16.249
  586    HB3  LEU  78           HB1      LEU  78  82.438   7.392  16.762
  587   HD11  LEU  78          HD11      LEU  78  83.924  10.524  15.815
  588   HD12  LEU  78          HD12      LEU  78  82.777  10.154  14.527
  589   HD13  LEU  78          HD13      LEU  78  84.511  10.049  14.221
  590   HD21  LEU  78          HD21      LEU  78  84.903   7.156  16.651
  591   HD22  LEU  78          HD22      LEU  78  84.424   8.678  17.403
  592   HD23  LEU  78          HD23      LEU  78  85.702   8.659  16.187
  593    H    HIS  79           HN       HIS  79  83.173   7.670  12.881
  594    HA   HIS  79           HA       HIS  79  82.691  10.158  11.815
  595    HD1  HIS  79           HD1      HIS  79  85.254  10.454   9.558
  596    HD2  HIS  79           HD2      HIS  79  85.260   7.499  12.502
  597    HE1  HIS  79           HE1      HIS  79  87.556  10.501  10.613
  598    HE2  HIS  79           HE2      HIS  79  87.573   8.707  12.407
  599    HB2  HIS  79           HB2      HIS  79  83.186   7.551  10.361
  600    HB3  HIS  79           HB1      HIS  79  83.142   9.104   9.527
  601    H    GLU  80           HN       GLU  80  81.238  11.015  10.186
  602    HA   GLU  80           HA       GLU  80  78.723   9.434   9.834
  603    HB2  GLU  80           HB2      GLU  80  78.760  11.413  11.585
  604    HB3  GLU  80           HB1      GLU  80  78.627  12.424  10.150
  605    HG2  GLU  80           HG2      GLU  80  76.680  10.881   9.457
  606    HG3  GLU  80           HG1      GLU  80  76.708  10.307  11.125
  607    H    LEU  81           HN       LEU  81  78.141  12.387   8.559
  608    HA   LEU  81           HA       LEU  81  78.420  11.465   5.837
  609    HG   LEU  81           HG       LEU  81  78.703  14.391   7.852
  610    HB2  LEU  81           HB2      LEU  81  77.856  13.931   5.327
  611    HB3  LEU  81           HB1      LEU  81  76.649  12.998   6.211
  612   HD11  LEU  81          HD11      LEU  81  76.529  15.817   6.299
  613   HD12  LEU  81          HD12      LEU  81  78.258  16.168   6.296
  614   HD13  LEU  81          HD13      LEU  81  77.293  16.500   7.735
  615   HD21  LEU  81          HD21      LEU  81  76.996  14.416   9.440
  616   HD22  LEU  81          HD22      LEU  81  76.577  12.971   8.519
  617   HD23  LEU  81          HD23      LEU  81  75.725  14.486   8.219
  618    H    ALA  82           HN       ALA  82  80.891  11.896   7.657
  619    HA   ALA  82           HA       ALA  82  82.489  14.012   6.720
  620    HB1  ALA  82           HB1      ALA  82  83.336  11.177   7.396
  621    HB2  ALA  82           HB2      ALA  82  83.203  12.517   8.535
  622    HB3  ALA  82           HB3      ALA  82  84.428  12.556   7.266
  623    H    GLN  83           HN       GLN  83  83.424  14.442   4.752
  624    HA   GLN  83           HA       GLN  83  82.765  12.893   2.434
  625    HB2  GLN  83           HB2      GLN  83  84.408  15.270   3.040
  626    HB3  GLN  83           HB1      GLN  83  84.999  14.330   1.673
  627    HG2  GLN  83           HG2      GLN  83  82.803  14.439   0.602
  628    HG3  GLN  83           HG1      GLN  83  82.141  15.294   1.996
  629   HE21  GLN  83          HE21      GLN  83  81.662  17.030   0.284
  630   HE22  GLN  83          HE22      GLN  83  82.898  18.131  -0.092
  631    H    TYR  84           HN       TYR  84  86.075  13.495   3.628
  632    HA   TYR  84           HA       TYR  84  86.816  10.767   2.681
  633    HD1  TYR  84           HD1      TYR  84  88.013  13.613   5.143
  634    HD2  TYR  84           HD2      TYR  84  88.394  14.282   0.917
  635    HE1  TYR  84           HE1      TYR  84  87.831  16.058   5.514
  636    HE2  TYR  84           HE2      TYR  84  88.212  16.728   1.288
  637    HH   TYR  84           HH       TYR  84  88.794  18.257   3.767
  638    HB2  TYR  84           HB2      TYR  84  89.198  11.923   3.295
  639    HB3  TYR  84           HB1      TYR  84  88.424  12.106   1.722
  640    H    GLY  85           HN       GLY  85  85.476  10.325   4.840
  641    HA2  GLY  85           HA2      GLY  85  87.518   9.855   6.949
  642    HA3  GLY  85           HA1      GLY  85  86.004  10.637   7.407
  643    H    ILE  86           HN       ILE  86  84.639   8.954   5.244
  644    HA   ILE  86           HA       ILE  86  84.383   6.488   6.911
  645    HB   ILE  86           HB       ILE  86  82.193   6.294   5.449
  646   HG12  ILE  86          HG12      ILE  86  81.323   8.616   4.936
  647   HG13  ILE  86          HG11      ILE  86  82.958   9.219   5.212
  648   HG21  ILE  86          HG21      ILE  86  82.512   6.859   7.963
  649   HG22  ILE  86          HG22      ILE  86  80.987   7.313   7.202
  650   HG23  ILE  86          HG23      ILE  86  82.234   8.530   7.472
  651   HD11  ILE  86          HD11      ILE  86  83.804   8.199   3.311
  652   HD12  ILE  86          HD12      ILE  86  82.158   8.531   2.773
  653   HD13  ILE  86          HD13      ILE  86  82.594   6.916   3.334
  654    H1U  RCY  87           H1U      RCY  87  81.857   3.212  -1.896
  655    H1S  RCY  87           H1S      RCY  87  84.367   0.348   1.089
  656    HB1  RCY  87           HB1      RCY  87  83.318   2.481   3.857
  657    HB2  RCY  87           HB2      RCY  87  84.577   2.223   5.064
  658    HA   RCY  87           HA       RCY  87  85.982   3.920   3.784
  659    HN1  RCY  87           HN1      RCY  87  83.958   4.454   5.666
  Start of MODEL   60
    1    HA   MET   1           HA       MET   1  58.963  10.414  21.600
    2    HB2  MET   1           HB2      MET   1  61.182  11.489  21.963
    3    HB3  MET   1           HB1      MET   1  61.668  10.981  20.346
    4    HG2  MET   1           HG2      MET   1  60.204  12.455  19.293
    5    HG3  MET   1           HG1      MET   1  59.119  12.529  20.682
    6    HE1  MET   1           HE1      MET   1  61.862  14.343  18.745
    7    HE2  MET   1           HE2      MET   1  62.715  13.042  19.572
    8    HE3  MET   1           HE3      MET   1  63.066  14.719  19.983
    9    H    ASN   2           HN       ASN   2  60.036   7.864  19.842
   10    HA   ASN   2           HA       ASN   2  58.387   8.661  17.511
   11    HB2  ASN   2           HB2      ASN   2  60.866   9.164  17.062
   12    HB3  ASN   2           HB1      ASN   2  61.114   7.418  17.100
   13   HD21  ASN   2          HD21      ASN   2  58.019   7.762  15.976
   14   HD22  ASN   2          HD22      ASN   2  58.320   7.799  14.306
   15    H    LEU   3           HN       LEU   3  59.709   6.313  19.649
   16    HA   LEU   3           HA       LEU   3  59.270   4.028  19.935
   17    HG   LEU   3           HG       LEU   3  57.097   6.316  20.126
   18    HB2  LEU   3           HB2      LEU   3  56.765   4.630  18.341
   19    HB3  LEU   3           HB1      LEU   3  56.996   3.345  19.527
   20   HD11  LEU   3          HD11      LEU   3  54.818   5.716  19.709
   21   HD12  LEU   3          HD12      LEU   3  55.008   5.715  21.462
   22   HD13  LEU   3          HD13      LEU   3  54.992   4.190  20.576
   23   HD21  LEU   3          HD21      LEU   3  57.517   3.819  21.762
   24   HD22  LEU   3          HD22      LEU   3  56.933   5.300  22.523
   25   HD23  LEU   3          HD23      LEU   3  58.499   5.283  21.712
   26    H    GLU   4           HN       GLU   4  61.080   4.276  17.991
   27    HA   GLU   4           HA       GLU   4  60.470   3.479  15.367
   28    HB2  GLU   4           HB2      GLU   4  62.767   2.603  15.263
   29    HB3  GLU   4           HB1      GLU   4  62.742   4.129  16.147
   30    HG2  GLU   4           HG2      GLU   4  62.565   2.772  18.281
   31    HG3  GLU   4           HG1      GLU   4  62.883   1.337  17.307
   32    HA   PRO   5           HA       PRO   5  58.664  -0.550  15.245
   33    HB2  PRO   5           HB2      PRO   5  61.238  -1.306  13.887
   34    HB3  PRO   5           HB1      PRO   5  59.570  -1.728  13.446
   35    HG2  PRO   5           HG2      PRO   5  60.936   0.254  12.238
   36    HG3  PRO   5           HG1      PRO   5  59.180   0.291  12.455
   37    HD2  PRO   5           HD2      PRO   5  61.215   1.976  13.722
   38    HD3  PRO   5           HD1      PRO   5  59.450   2.178  13.708
   39    HA   PRO   6           HA       PRO   6  61.239  -2.144  18.696
   40    HB2  PRO   6           HB2      PRO   6  59.274  -2.413  20.520
   41    HB3  PRO   6           HB1      PRO   6  59.972  -0.828  20.135
   42    HG2  PRO   6           HG2      PRO   6  57.375  -1.992  19.315
   43    HG3  PRO   6           HG1      PRO   6  57.805  -0.309  19.656
   44    HD2  PRO   6           HD2      PRO   6  57.593  -1.486  17.094
   45    HD3  PRO   6           HD1      PRO   6  58.313   0.094  17.468
   46    H    LYS   7           HN       LYS   7  61.610  -4.305  19.203
   47    HA   LYS   7           HA       LYS   7  61.350  -6.632  19.146
   48    HB2  LYS   7           HB2      LYS   7  58.935  -5.567  20.129
   49    HB3  LYS   7           HB1      LYS   7  58.447  -6.737  18.905
   50    HG2  LYS   7           HG2      LYS   7  60.443  -7.339  21.106
   51    HG3  LYS   7           HG1      LYS   7  58.724  -7.726  21.208
   52    HD2  LYS   7           HD2      LYS   7  58.881  -9.440  19.699
   53    HD3  LYS   7           HD1      LYS   7  60.116  -8.621  18.742
   54    HE2  LYS   7           HE2      LYS   7  60.864 -10.707  20.046
   55    HE3  LYS   7           HE1      LYS   7  61.850  -9.257  20.235
   56    HZ1  LYS   7           HZ1      LYS   7  61.537  -9.855  22.401
   57    HZ2  LYS   7           HZ2      LYS   7  59.990 -10.502  22.130
   58    HZ3  LYS   7           HZ3      LYS   7  60.210  -8.819  22.194
   59    H    ALA   8           HN       ALA   8  61.594  -7.979  17.420
   60    HA   ALA   8           HA       ALA   8  61.250  -7.192  14.761
   61    HB1  ALA   8           HB1      ALA   8  60.945 -10.056  15.694
   62    HB2  ALA   8           HB2      ALA   8  62.504  -9.233  15.630
   63    HB3  ALA   8           HB3      ALA   8  61.579  -9.487  14.150
   64    H    GLU   9           HN       GLU   9  59.234  -6.245  14.331
   65    HA   GLU   9           HA       GLU   9  56.723  -7.488  15.050
   66    HB2  GLU   9           HB2      GLU   9  57.175  -5.009  14.477
   67    HB3  GLU   9           HB1      GLU   9  57.103  -5.518  12.790
   68    HG2  GLU   9           HG2      GLU   9  54.887  -4.820  13.367
   69    HG3  GLU   9           HG1      GLU   9  54.853  -6.583  13.337
   70    H1U  RCY  10           H1U      RCY  10  61.306 -12.738  13.280
   71    H1S  RCY  10           H1S      RCY  10  56.817 -12.729  13.610
   72    HB1  RCY  10           HB1      RCY  10  55.593 -10.204  10.741
   73    HB2  RCY  10           HB2      RCY  10  55.197  -9.868  12.425
   74    HA   RCY  10           HA       RCY  10  57.691 -11.269  12.382
   75    HN1  RCY  10           HN1      RCY  10  57.797  -9.634  14.060
   76    H    ARG  11           HN       ARG  11  59.310  -8.802  11.981
   77    HA   ARG  11           HA       ARG  11  60.770  -8.101  10.280
   78    HE   ARG  11           HE       ARG  11  59.932  -8.946   6.321
   79    HB2  ARG  11           HB2      ARG  11  59.952 -10.549   9.363
   80    HB3  ARG  11           HB1      ARG  11  59.360  -9.504   8.075
   81    HG2  ARG  11           HG2      ARG  11  62.194  -9.406   9.145
   82    HG3  ARG  11           HG1      ARG  11  61.716 -10.330   7.720
   83    HD2  ARG  11           HD2      ARG  11  61.312  -7.343   8.058
   84    HD3  ARG  11           HD1      ARG  11  62.614  -8.084   7.127
   85   HH11  ARG  11          HH21      ARG  11  62.517  -6.690   5.982
   86   HH12  ARG  11          HH22      ARG  11  62.070  -6.216   4.377
   87   HH21  ARG  11          HH11      ARG  11  59.333  -8.340   4.227
   88   HH22  ARG  11          HH12      ARG  11  60.267  -7.150   3.384
   89    H    SER  12           HN       SER  12  57.846  -8.552   8.287
   90    HA   SER  12           HA       SER  12  57.002  -5.789   8.557
   91    HG   SER  12           HG       SER  12  59.372  -5.050   7.952
   92    HB2  SER  12           HB2      SER  12  58.152  -6.515   5.858
   93    HB3  SER  12           HB1      SER  12  57.655  -4.928   6.438
   94    H    ALA  13           HN       ALA  13  55.154  -5.337   7.017
   95    HA   ALA  13           HA       ALA  13  54.016  -7.376   5.373
   96    HB1  ALA  13           HB1      ALA  13  53.181  -7.340   8.270
   97    HB2  ALA  13           HB2      ALA  13  53.586  -8.726   7.259
   98    HB3  ALA  13           HB3      ALA  13  52.062  -7.873   7.016
   99    H    THR  14           HN       THR  14  52.438  -5.359   7.858
  100    HA   THR  14           HA       THR  14  51.043  -3.900   5.657
  101    HB   THR  14           HB       THR  14  49.280  -3.505   7.159
  102    HG1  THR  14           HG1      THR  14  49.757  -4.031   9.490
  103   HG21  THR  14          HG21      THR  14  50.437  -6.112   8.176
  104   HG22  THR  14          HG22      THR  14  49.618  -5.945   6.623
  105   HG23  THR  14          HG23      THR  14  48.736  -5.651   8.122
  106    H    ARG  15           HN       ARG  15  53.683  -3.135   6.072
  107    HA   ARG  15           HA       ARG  15  53.386  -0.330   6.657
  108    HE   ARG  15           HE       ARG  15  54.181  -1.052  11.411
  109    HB2  ARG  15           HB2      ARG  15  54.873  -0.245   8.647
  110    HB3  ARG  15           HB1      ARG  15  53.376  -1.115   8.981
  111    HG2  ARG  15           HG2      ARG  15  54.873  -3.187   8.150
  112    HG3  ARG  15           HG1      ARG  15  56.162  -2.152   8.767
  113    HD2  ARG  15           HD2      ARG  15  53.718  -3.096  10.293
  114    HD3  ARG  15           HD1      ARG  15  55.387  -3.592  10.569
  115   HH11  ARG  15          HH21      ARG  15  57.019  -2.872  10.690
  116   HH12  ARG  15          HH22      ARG  15  58.061  -1.882  11.656
  117   HH21  ARG  15          HH11      ARG  15  55.525   0.251  12.677
  118   HH22  ARG  15          HH12      ARG  15  57.215  -0.114  12.782
  119    H    VAL  16           HN       VAL  16  54.510   0.039   4.747
  120    HA   VAL  16           HA       VAL  16  57.176  -1.227   4.403
  121    HB   VAL  16           HB       VAL  16  57.041  -0.017   2.150
  122   HG11  VAL  16          HG11      VAL  16  55.039  -2.117   3.004
  123   HG12  VAL  16          HG12      VAL  16  56.589  -2.361   2.198
  124   HG13  VAL  16          HG13      VAL  16  55.242  -1.637   1.319
  125   HG21  VAL  16          HG21      VAL  16  55.284   1.609   3.010
  126   HG22  VAL  16          HG22      VAL  16  54.131   0.277   2.940
  127   HG23  VAL  16          HG23      VAL  16  54.905   0.852   1.464
  128    H    MET  17           HN       MET  17  57.490   0.348   6.477
  129    HA   MET  17           HA       MET  17  58.692   2.184   7.302
  130    HB2  MET  17           HB2      MET  17  59.533   2.694   4.440
  131    HB3  MET  17           HB1      MET  17  60.410   3.090   5.918
  132    HG2  MET  17           HG2      MET  17  60.356   0.526   6.367
  133    HG3  MET  17           HG1      MET  17  59.988   0.392   4.647
  134    HE1  MET  17           HE1      MET  17  61.931   0.124   2.906
  135    HE2  MET  17           HE2      MET  17  62.927   1.569   2.751
  136    HE3  MET  17           HE3      MET  17  61.178   1.724   2.902
  137    H    GLY  18           HN       GLY  18  58.103   4.288   7.766
  138    HA2  GLY  18           HA2      GLY  18  57.192   6.256   5.988
  139    HA3  GLY  18           HA1      GLY  18  55.752   5.372   6.496
  140    H    GLY  19           HN       GLY  19  54.892   7.097   7.726
  141    HA2  GLY  19           HA2      GLY  19  54.669   8.518   9.584
  142    HA3  GLY  19           HA1      GLY  19  55.512   7.236  10.454
  143    HA   PRO  20           HA       PRO  20  57.981  11.263  10.656
  144    HB2  PRO  20           HB2      PRO  20  58.719   9.761  13.144
  145    HB3  PRO  20           HB1      PRO  20  58.418  11.496  12.924
  146    HG2  PRO  20           HG2      PRO  20  56.607   9.904  14.048
  147    HG3  PRO  20           HG1      PRO  20  56.135  11.244  12.989
  148    HD2  PRO  20           HD2      PRO  20  56.082   8.315  12.448
  149    HD3  PRO  20           HD1      PRO  20  55.071   9.608  11.766
  150    H1U  RCY  21           H1U      RCY  21  62.927   7.062   1.941
  151    H1S  RCY  21           H1S      RCY  21  62.273   9.071   6.100
  152    HB1  RCY  21           HB1      RCY  21  60.603   8.864   7.087
  153    HB2  RCY  21           HB2      RCY  21  60.177   7.733   8.372
  154    HA   RCY  21           HA       RCY  21  61.770   9.046   9.874
  155    HN1  RCY  21           HN1      RCY  21  59.449  10.695   8.987
  156    H    THR  22           HN       THR  22  63.132  10.834  10.073
  157    HA   THR  22           HA       THR  22  63.477  12.535   7.636
  158    HB   THR  22           HB       THR  22  62.811  13.770   9.671
  159    HG1  THR  22           HG1      THR  22  65.263  14.731   9.692
  160   HG21  THR  22          HG21      THR  22  64.097  11.981  11.119
  161   HG22  THR  22          HG22      THR  22  63.969  13.647  11.684
  162   HG23  THR  22          HG23      THR  22  65.454  13.089  10.914
  163    HA   PRO  23           HA       PRO  23  67.266  10.157   6.997
  164    HB2  PRO  23           HB2      PRO  23  68.024  12.778   5.744
  165    HB3  PRO  23           HB1      PRO  23  68.241  11.129   5.122
  166    HG2  PRO  23           HG2      PRO  23  66.283  12.711   4.238
  167    HG3  PRO  23           HG1      PRO  23  66.054  10.965   4.426
  168    HD2  PRO  23           HD2      PRO  23  64.939  13.184   6.056
  169    HD3  PRO  23           HD1      PRO  23  64.320  11.535   5.821
  170    H    ARG  24           HN       ARG  24  69.131  10.006   8.228
  171    HA   ARG  24           HA       ARG  24  69.572  11.992  10.317
  172    HE   ARG  24           HE       ARG  24  72.195   8.546  12.073
  173    HB2  ARG  24           HB2      ARG  24  71.448   9.731   9.614
  174    HB3  ARG  24           HB1      ARG  24  71.181  10.482  11.188
  175    HG2  ARG  24           HG2      ARG  24  68.724   9.651  10.897
  176    HG3  ARG  24           HG1      ARG  24  69.410   8.562   9.691
  177    HD2  ARG  24           HD2      ARG  24  69.889   8.653  12.651
  178    HD3  ARG  24           HD1      ARG  24  69.592   7.260  11.612
  179   HH11  ARG  24          HH21      ARG  24  70.209   6.478  10.159
  180   HH12  ARG  24          HH22      ARG  24  71.543   5.626   9.456
  181   HH21  ARG  24          HH11      ARG  24  73.949   7.446  11.166
  182   HH22  ARG  24          HH12      ARG  24  73.661   6.175  10.026
  183    H    LYS  25           HN       LYS  25  71.882  12.838  10.662
  184    HA   LYS  25           HA       LYS  25  73.605  14.228   9.885
  185    HB2  LYS  25           HB2      LYS  25  73.609  12.512   7.397
  186    HB3  LYS  25           HB1      LYS  25  74.969  13.348   8.148
  187    HG2  LYS  25           HG2      LYS  25  73.457  10.981   9.288
  188    HG3  LYS  25           HG1      LYS  25  75.112  10.975   8.679
  189    HD2  LYS  25           HD2      LYS  25  75.583  12.795  10.438
  190    HD3  LYS  25           HD1      LYS  25  74.040  12.330  11.155
  191    HE2  LYS  25           HE2      LYS  25  75.745  11.047  12.268
  192    HE3  LYS  25           HE1      LYS  25  74.889   9.943  11.191
  193    HZ1  LYS  25           HZ1      LYS  25  76.985   9.461  10.558
  194    HZ2  LYS  25           HZ2      LYS  25  77.607  10.972  11.024
  195    HZ3  LYS  25           HZ3      LYS  25  76.770  10.811   9.554
  196    H    GLY  26           HN       GLY  26  74.133  15.824   8.131
  197    HA2  GLY  26           HA2      GLY  26  71.619  16.868   6.980
  198    HA3  GLY  26           HA1      GLY  26  73.152  17.736   7.071
  199    HA   PRO  27           HA       PRO  27  72.518  16.596   2.612
  200    HB2  PRO  27           HB2      PRO  27  74.516  18.809   2.425
  201    HB3  PRO  27           HB1      PRO  27  73.021  18.558   1.503
  202    HG2  PRO  27           HG2      PRO  27  73.201  20.398   3.427
  203    HG3  PRO  27           HG1      PRO  27  71.705  19.502   3.117
  204    HD2  PRO  27           HD2      PRO  27  73.649  19.196   5.361
  205    HD3  PRO  27           HD1      PRO  27  71.895  18.912   5.339
  206    HA   PRO  28           HA       PRO  28  76.125  14.232   1.630
  207    HB2  PRO  28           HB2      PRO  28  77.085  16.218  -0.391
  208    HB3  PRO  28           HB1      PRO  28  76.796  14.476  -0.571
  209    HG2  PRO  28           HG2      PRO  28  75.104  16.269  -1.565
  210    HG3  PRO  28           HG1      PRO  28  74.526  14.752  -0.854
  211    HD2  PRO  28           HD2      PRO  28  74.427  17.520   0.278
  212    HD3  PRO  28           HD1      PRO  28  73.287  16.172   0.490
  213    H    LYS  29           HN       LYS  29  78.301  14.031   2.289
  214    HA   LYS  29           HA       LYS  29  79.845  16.488   2.870
  215    HB2  LYS  29           HB2      LYS  29  80.320  15.629   5.205
  216    HB3  LYS  29           HB1      LYS  29  78.677  16.215   4.957
  217    HG2  LYS  29           HG2      LYS  29  79.146  13.335   4.381
  218    HG3  LYS  29           HG1      LYS  29  79.210  13.814   6.078
  219    HD2  LYS  29           HD2      LYS  29  76.996  14.930   5.810
  220    HD3  LYS  29           HD1      LYS  29  76.923  14.327   4.154
  221    HE2  LYS  29           HE2      LYS  29  75.678  12.822   5.627
  222    HE3  LYS  29           HE1      LYS  29  77.117  12.002   5.021
  223    HZ1  LYS  29           HZ1      LYS  29  77.372  13.491   7.519
  224    HZ2  LYS  29           HZ2      LYS  29  78.107  12.035   7.041
  225    HZ3  LYS  29           HZ3      LYS  29  76.493  12.040   7.573
  226    H1U  RCY  30           H1U      RCY  30  78.892  10.727  -4.727
  227    H1S  RCY  30           H1S      RCY  30  81.728  12.847  -2.808
  228    HB1  RCY  30           HB1      RCY  30  83.535  13.401  -0.588
  229    HB2  RCY  30           HB2      RCY  30  83.493  15.082  -0.064
  230    HA   RCY  30           HA       RCY  30  82.097  12.705   1.167
  231    HN1  RCY  30           HN1      RCY  30  80.814  15.165   0.939
  232    H    LYS  31           HN       LYS  31  83.078  12.172   3.113
  233    HA   LYS  31           HA       LYS  31  84.800  14.063   4.507
  234    HB2  LYS  31           HB2      LYS  31  83.374  11.870   5.308
  235    HB3  LYS  31           HB1      LYS  31  84.999  11.197   5.225
  236    HG2  LYS  31           HG2      LYS  31  84.951  12.043   7.403
  237    HG3  LYS  31           HG1      LYS  31  85.676  13.384   6.515
  238    HD2  LYS  31           HD2      LYS  31  83.312  14.302   6.231
  239    HD3  LYS  31           HD1      LYS  31  82.802  13.099   7.417
  240    HE2  LYS  31           HE2      LYS  31  84.823  15.320   7.825
  241    HE3  LYS  31           HE1      LYS  31  83.248  15.159   8.603
  242    HZ1  LYS  31           HZ1      LYS  31  85.055  14.423  10.043
  243    HZ2  LYS  31           HZ2      LYS  31  85.510  13.257   8.894
  244    HZ3  LYS  31           HZ3      LYS  31  84.004  13.144   9.672
  245    H    GLN  32           HN       GLN  32  85.674  10.755   3.631
  246    HA   GLN  32           HA       GLN  32  87.973  11.716   2.048
  247    HB2  GLN  32           HB2      GLN  32  88.682  11.676   4.490
  248    HB3  GLN  32           HB1      GLN  32  88.437   9.930   4.449
  249    HG2  GLN  32           HG2      GLN  32  90.015   9.838   2.482
  250    HG3  GLN  32           HG1      GLN  32  90.370  11.543   2.765
  251   HE21  GLN  32          HE21      GLN  32  89.715  10.211   5.764
  252   HE22  GLN  32          HE22      GLN  32  91.298   9.830   6.242
  253    H    ARG  33           HN       ARG  33  86.776  10.540   0.388
  254    HA   ARG  33           HA       ARG  33  87.670   7.829   0.066
  255    HE   ARG  33           HE       ARG  33  83.684   5.629   1.841
  256    HB2  ARG  33           HB2      ARG  33  85.286   6.848   0.008
  257    HB3  ARG  33           HB1      ARG  33  85.998   7.128   1.596
  258    HG2  ARG  33           HG2      ARG  33  84.845   9.363   1.647
  259    HG3  ARG  33           HG1      ARG  33  84.021   8.916   0.152
  260    HD2  ARG  33           HD2      ARG  33  83.722   7.733   2.901
  261    HD3  ARG  33           HD1      ARG  33  82.469   8.264   1.779
  262   HH11  ARG  33          HH21      ARG  33  82.298   8.095  -0.130
  263   HH12  ARG  33          HH22      ARG  33  81.768   6.998  -1.361
  264   HH21  ARG  33          HH11      ARG  33  82.999   4.183   0.245
  265   HH22  ARG  33          HH12      ARG  33  82.164   4.783  -1.149
  266    H    GLN  34           HN       GLN  34  88.297   9.027  -1.889
  267    HA   GLN  34           HA       GLN  34  87.963   9.794  -4.090
  268    HB2  GLN  34           HB2      GLN  34  85.832   7.640  -3.929
  269    HB3  GLN  34           HB1      GLN  34  86.470   8.333  -5.420
  270    HG2  GLN  34           HG2      GLN  34  87.692   6.310  -5.076
  271    HG3  GLN  34           HG1      GLN  34  88.782   7.613  -4.603
  272   HE21  GLN  34          HE21      GLN  34  89.566   7.589  -2.465
  273   HE22  GLN  34          HE22      GLN  34  89.017   6.525  -1.262
  274    H    THR  35           HN       THR  35  87.177  11.906  -3.727
  275    HA   THR  35           HA       THR  35  84.422  12.450  -3.041
  276    HB   THR  35           HB       THR  35  86.212  14.073  -2.577
  277    HG1  THR  35           HG1      THR  35  84.457  15.235  -2.761
  278   HG21  THR  35          HG21      THR  35  87.483  13.453  -4.708
  279   HG22  THR  35          HG22      THR  35  87.434  15.170  -4.305
  280   HG23  THR  35          HG23      THR  35  86.374  14.528  -5.560
  281    H    ARG  36           HN       ARG  36  86.173  12.037  -6.064
  282    HA   ARG  36           HA       ARG  36  83.568  12.081  -7.497
  283    HE   ARG  36           HE       ARG  36  83.581  14.212 -10.441
  284    HB2  ARG  36           HB2      ARG  36  85.928  13.872  -8.036
  285    HB3  ARG  36           HB1      ARG  36  84.905  13.355  -9.374
  286    HG2  ARG  36           HG2      ARG  36  82.921  14.141  -7.919
  287    HG3  ARG  36           HG1      ARG  36  84.132  14.980  -6.949
  288    HD2  ARG  36           HD2      ARG  36  83.176  16.451  -8.707
  289    HD3  ARG  36           HD1      ARG  36  84.907  16.201  -8.929
  290   HH11  ARG  36          HH21      ARG  36  83.906  17.639 -10.251
  291   HH12  ARG  36          HH22      ARG  36  83.670  17.889 -11.948
  292   HH21  ARG  36          HH11      ARG  36  83.271  14.518 -12.659
  293   HH22  ARG  36          HH12      ARG  36  83.311  16.122 -13.312
  294    H    GLN  37           HN       GLN  37  86.523  10.631  -6.884
  295    HA   GLN  37           HA       GLN  37  87.155   9.565  -9.479
  296    HB2  GLN  37           HB2      GLN  37  88.194   9.370  -6.830
  297    HB3  GLN  37           HB1      GLN  37  87.913   7.724  -7.395
  298    HG2  GLN  37           HG2      GLN  37  89.412   9.839  -8.968
  299    HG3  GLN  37           HG1      GLN  37  90.185   8.586  -7.996
  300   HE21  GLN  37          HE21      GLN  37  88.327   9.169 -10.955
  301   HE22  GLN  37          HE22      GLN  37  88.563   7.624 -11.617
  302    H1U  RCY  38           H1U      RCY  38  84.148   1.260  -5.985
  303    H1S  RCY  38           H1S      RCY  38  83.776   4.370  -8.564
  304    HB1  RCY  38           HB1      RCY  38  82.436   7.810 -10.162
  305    HB2  RCY  38           HB2      RCY  38  83.156   7.794  -8.552
  306    HA   RCY  38           HA       RCY  38  84.681   5.901  -9.574
  307    HN1  RCY  38           HN1      RCY  38  85.609   8.454 -10.589
  308    H    LYS  39           HN       LYS  39  86.125   6.382 -11.814
  309    HA   LYS  39           HA       LYS  39  84.332   6.683 -14.130
  310    HB2  LYS  39           HB2      LYS  39  87.297   6.348 -13.740
  311    HB3  LYS  39           HB1      LYS  39  86.591   6.044 -15.325
  312    HG2  LYS  39           HG2      LYS  39  87.262   8.364 -15.262
  313    HG3  LYS  39           HG1      LYS  39  85.501   8.318 -15.184
  314    HD2  LYS  39           HD2      LYS  39  86.652   8.142 -12.527
  315    HD3  LYS  39           HD1      LYS  39  87.226   9.584 -13.365
  316    HE2  LYS  39           HE2      LYS  39  84.983  10.337 -13.783
  317    HE3  LYS  39           HE1      LYS  39  84.305   8.799 -13.248
  318    HZ1  LYS  39           HZ1      LYS  39  85.993  10.005 -11.277
  319    HZ2  LYS  39           HZ2      LYS  39  84.401   9.429 -11.134
  320    HZ3  LYS  39           HZ3      LYS  39  84.689  11.005 -11.699
  321    H    SER  40           HN       SER  40  86.888   4.260 -13.985
  322    HA   SER  40           HA       SER  40  84.922   2.232 -14.878
  323    HG   SER  40           HG       SER  40  86.037   0.620 -16.252
  324    HB2  SER  40           HB2      SER  40  87.139   2.559 -16.049
  325    HB3  SER  40           HB1      SER  40  87.924   1.948 -14.596
  326    H    LYS  41           HN       LYS  41  84.611   0.257 -13.769
  327    HA   LYS  41           HA       LYS  41  85.935  -0.103 -11.142
  328    HB2  LYS  41           HB2      LYS  41  83.688  -0.473 -10.061
  329    HB3  LYS  41           HB1      LYS  41  83.995   1.200 -10.522
  330    HG2  LYS  41           HG2      LYS  41  82.804  -0.250 -12.730
  331    HG3  LYS  41           HG1      LYS  41  81.794  -0.383 -11.290
  332    HD2  LYS  41           HD2      LYS  41  82.898   2.239 -12.334
  333    HD3  LYS  41           HD1      LYS  41  81.284   1.635 -12.710
  334    HE2  LYS  41           HE2      LYS  41  80.568   2.590 -10.800
  335    HE3  LYS  41           HE1      LYS  41  81.524   1.396  -9.921
  336    HZ1  LYS  41           HZ1      LYS  41  83.458   2.963 -10.295
  337    HZ2  LYS  41           HZ2      LYS  41  82.281   3.461  -9.176
  338    HZ3  LYS  41           HZ3      LYS  41  82.308   4.129 -10.738
  339    HA   PRO  42           HA       PRO  42  85.109  -4.050 -13.362
  340    HB2  PRO  42           HB2      PRO  42  87.642  -5.002 -13.402
  341    HB3  PRO  42           HB1      PRO  42  87.071  -3.797 -14.573
  342    HG2  PRO  42           HG2      PRO  42  88.784  -3.439 -12.180
  343    HG3  PRO  42           HG1      PRO  42  88.826  -2.601 -13.739
  344    HD2  PRO  42           HD2      PRO  42  87.662  -1.608 -11.381
  345    HD3  PRO  42           HD1      PRO  42  87.381  -0.981 -13.020
  346    HA   PRO  43           HA       PRO  43  85.064  -6.418  -9.568
  347    HB2  PRO  43           HB2      PRO  43  84.402  -8.856 -10.519
  348    HB3  PRO  43           HB1      PRO  43  83.266  -7.493 -10.583
  349    HG2  PRO  43           HG2      PRO  43  84.972  -8.619 -12.748
  350    HG3  PRO  43           HG1      PRO  43  83.297  -8.043 -12.814
  351    HD2  PRO  43           HD2      PRO  43  85.482  -6.548 -13.629
  352    HD3  PRO  43           HD1      PRO  43  83.931  -5.850 -13.116
  353    H    LYS  44           HN       LYS  44  86.741  -7.248  -8.371
  354    HA   LYS  44           HA       LYS  44  88.997  -8.545  -9.810
  355    HB2  LYS  44           HB2      LYS  44  89.403  -6.653  -8.178
  356    HB3  LYS  44           HB1      LYS  44  88.845  -7.725  -6.894
  357    HG2  LYS  44           HG2      LYS  44  90.700  -9.109  -7.050
  358    HG3  LYS  44           HG1      LYS  44  90.972  -8.724  -8.750
  359    HD2  LYS  44           HD2      LYS  44  91.264  -6.537  -6.725
  360    HD3  LYS  44           HD1      LYS  44  92.559  -7.726  -6.876
  361    HE2  LYS  44           HE2      LYS  44  91.413  -6.092  -9.161
  362    HE3  LYS  44           HE1      LYS  44  92.945  -5.771  -8.349
  363    HZ1  LYS  44           HZ1      LYS  44  92.208  -8.043 -10.076
  364    HZ2  LYS  44           HZ2      LYS  44  93.470  -8.193  -8.948
  365    HZ3  LYS  44           HZ3      LYS  44  93.559  -7.022 -10.176
  366    H    LYS  45           HN       LYS  45  86.587 -10.043  -9.560
  367    HA   LYS  45           HA       LYS  45  85.791 -12.112  -8.780
  368    HB2  LYS  45           HB2      LYS  45  88.790 -12.459  -8.495
  369    HB3  LYS  45           HB1      LYS  45  87.637 -13.773  -8.275
  370    HG2  LYS  45           HG2      LYS  45  88.062 -14.059 -10.524
  371    HG3  LYS  45           HG1      LYS  45  86.759 -12.875 -10.646
  372    HD2  LYS  45           HD2      LYS  45  88.551 -11.071 -10.589
  373    HD3  LYS  45           HD1      LYS  45  89.738 -12.361 -10.789
  374    HE2  LYS  45           HE2      LYS  45  87.553 -11.525 -12.700
  375    HE3  LYS  45           HE1      LYS  45  89.290 -11.607 -12.996
  376    HZ1  LYS  45           HZ1      LYS  45  87.746 -14.017 -12.273
  377    HZ2  LYS  45           HZ2      LYS  45  89.254 -13.913 -13.049
  378    HZ3  LYS  45           HZ3      LYS  45  87.836 -13.487 -13.882
  379    H    GLY  46           HN       GLY  46  85.398 -10.245  -6.876
  380    HA2  GLY  46           HA2      GLY  46  85.030 -10.018  -4.570
  381    HA3  GLY  46           HA1      GLY  46  85.366 -11.746  -4.444
  382    H    VAL  47           HN       VAL  47  86.279  -9.274  -2.857
  383    HA   VAL  47           HA       VAL  47  89.084 -10.169  -2.603
  384    HB   VAL  47           HB       VAL  47  89.586  -7.532  -2.486
  385   HG11  VAL  47          HG11      VAL  47  90.381  -7.692  -4.821
  386   HG12  VAL  47          HG12      VAL  47  89.393  -9.134  -5.056
  387   HG13  VAL  47          HG13      VAL  47  90.745  -9.167  -3.924
  388   HG21  VAL  47          HG21      VAL  47  87.539  -7.682  -4.703
  389   HG22  VAL  47          HG22      VAL  47  88.295  -6.247  -4.011
  390   HG23  VAL  47          HG23      VAL  47  87.102  -7.152  -3.079
  391    H    GLN  48           HN       GLN  48  87.794  -7.110  -1.427
  392    HA   GLN  48           HA       GLN  48  86.962  -8.202   1.143
  393    HB2  GLN  48           HB2      GLN  48  89.727  -7.481   0.760
  394    HB3  GLN  48           HB1      GLN  48  88.997  -6.349   1.897
  395    HG2  GLN  48           HG2      GLN  48  88.136  -8.247   3.229
  396    HG3  GLN  48           HG1      GLN  48  88.891  -9.374   2.100
  397   HE21  GLN  48          HE21      GLN  48  90.633  -6.419   2.705
  398   HE22  GLN  48          HE22      GLN  48  91.813  -7.084   3.727
  399    H    GLY  49           HN       GLY  49  86.353  -6.221  -1.187
  400    HA2  GLY  49           HA2      GLY  49  84.765  -4.434  -1.148
  401    HA3  GLY  49           HA1      GLY  49  85.101  -4.203   0.568
  402    H1U  RCY  50           H1U      RCY  50  82.139   2.795  -2.702
  403    H1S  RCY  50           H1S      RCY  50  84.338  -0.323  -1.414
  404    HB1  RCY  50           HB1      RCY  50  85.921  -0.226  -2.682
  405    HB2  RCY  50           HB2      RCY  50  87.503   0.428  -2.260
  406    HA   RCY  50           HA       RCY  50  87.614  -1.776  -3.458
  407    HN1  RCY  50           HN1      RCY  50  85.937  -3.237  -2.639
  408    H    GLY  51           HN       GLY  51  89.625  -2.752  -3.202
  409    HA2  GLY  51           HA2      GLY  51  91.017  -3.276  -0.827
  410    HA3  GLY  51           HA1      GLY  51  91.812  -2.921  -2.360
  411    H    ASP  52           HN       ASP  52  90.014  -0.251  -1.861
  412    HA   ASP  52           HA       ASP  52  92.125   1.508  -1.360
  413    HB2  ASP  52           HB2      ASP  52  89.883   2.246  -2.082
  414    HB3  ASP  52           HB1      ASP  52  89.238   1.845  -0.490
  415    H    ASP  53           HN       ASP  53  89.818   1.831   1.193
  416    HA   ASP  53           HA       ASP  53  91.264   0.413   3.246
  417    HB2  ASP  53           HB2      ASP  53  92.283   2.299   4.403
  418    HB3  ASP  53           HB1      ASP  53  92.900   2.246   2.751
  419    H    ILE  54           HN       ILE  54  88.590   0.502   2.616
  420    HA   ILE  54           HA       ILE  54  87.418   2.045   4.902
  421    HB   ILE  54           HB       ILE  54  86.165   1.446   2.204
  422   HG12  ILE  54          HG12      ILE  54  87.856   3.246   2.140
  423   HG13  ILE  54          HG11      ILE  54  86.233   3.903   1.928
  424   HG21  ILE  54          HG21      ILE  54  84.458   1.386   3.903
  425   HG22  ILE  54          HG22      ILE  54  84.348   2.959   3.113
  426   HG23  ILE  54          HG23      ILE  54  85.117   2.818   4.694
  427   HD11  ILE  54          HD11      ILE  54  86.978   5.352   3.555
  428   HD12  ILE  54          HD12      ILE  54  88.103   4.177   4.235
  429   HD13  ILE  54          HD13      ILE  54  86.382   4.064   4.602
  430    HA   PRO  55           HA       PRO  55  86.392  -2.367   5.570
  431    HB2  PRO  55           HB2      PRO  55  86.778  -2.410   8.246
  432    HB3  PRO  55           HB1      PRO  55  88.132  -2.462   7.100
  433    HG2  PRO  55           HG2      PRO  55  87.137  -0.204   8.744
  434    HG3  PRO  55           HG1      PRO  55  88.790  -0.607   8.255
  435    HD2  PRO  55           HD2      PRO  55  87.149   1.331   7.043
  436    HD3  PRO  55           HD1      PRO  55  88.638   0.652   6.353
  437    H    GLY  56           HN       GLY  56  84.152  -1.399   4.979
  438    HA2  GLY  56           HA2      GLY  56  81.869  -1.285   5.513
  439    HA3  GLY  56           HA1      GLY  56  82.278  -2.031   7.057
  440    H    MET  57           HN       MET  57  84.264   0.478   7.118
  441    HA   MET  57           HA       MET  57  84.204   2.639   8.032
  442    HB2  MET  57           HB2      MET  57  81.220   2.794   7.754
  443    HB3  MET  57           HB1      MET  57  82.435   4.044   7.505
  444    HG2  MET  57           HG2      MET  57  83.100   2.156   5.589
  445    HG3  MET  57           HG1      MET  57  81.336   2.113   5.590
  446    HE1  MET  57           HE1      MET  57  80.186   5.602   5.051
  447    HE2  MET  57           HE2      MET  57  81.063   5.588   6.579
  448    HE3  MET  57           HE3      MET  57  80.092   4.193   6.115
  449    H    GLU  58           HN       GLU  58  81.730   0.329   9.022
  450    HA   GLU  58           HA       GLU  58  81.128  -0.355  11.184
  451    HB2  GLU  58           HB2      GLU  58  83.671   0.354  11.574
  452    HB3  GLU  58           HB1      GLU  58  82.921   1.671  12.475
  453    HG2  GLU  58           HG2      GLU  58  81.557  -0.078  13.701
  454    HG3  GLU  58           HG1      GLU  58  82.573  -1.301  12.936
  455    H    GLY  59           HN       GLY  59  79.289   1.105  10.141
  456    HA2  GLY  59           HA2      GLY  59  78.445   2.955  12.296
  457    HA3  GLY  59           HA1      GLY  59  78.508   3.612  10.659
  458    H1U  RCY  60           H1U      RCY  60  74.474   5.167   3.473
  459    H1S  RCY  60           H1S      RCY  60  75.702   4.375   7.973
  460    HB1  RCY  60           HB1      RCY  60  74.411   0.238   8.149
  461    HB2  RCY  60           HB2      RCY  60  76.016   0.889   7.820
  462    HA   RCY  60           HA       RCY  60  74.943   0.624  10.635
  463    HN1  RCY  60           HN1      RCY  60  77.813   0.649   9.886
  464    H    GLY  61           HN       GLY  61  76.398  -1.195  11.737
  465    HA2  GLY  61           HA2      GLY  61  76.189  -3.597  11.903
  466    HA3  GLY  61           HA1      GLY  61  75.925  -3.667  10.157
  467    H    THR  62           HN       THR  62  77.687  -3.745   8.786
  468    HA   THR  62           HA       THR  62  80.312  -3.038   9.133
  469    HB   THR  62           HB       THR  62  81.070  -5.599   9.826
  470    HG1  THR  62           HG1      THR  62  79.198  -5.013  11.789
  471   HG21  THR  62          HG21      THR  62  81.163  -4.394  12.242
  472   HG22  THR  62          HG22      THR  62  80.853  -2.987  11.224
  473   HG23  THR  62          HG23      THR  62  82.271  -3.992  10.930
  474    H    ASP  63           HN       ASP  63  81.107  -6.050   8.497
  475    HA   ASP  63           HA       ASP  63  80.960  -5.720   5.632
  476    HB2  ASP  63           HB2      ASP  63  81.909  -8.060   5.610
  477    HB3  ASP  63           HB1      ASP  63  82.843  -6.906   6.563
  478    H    ILE  64           HN       ILE  64  78.325  -5.824   7.004
  479    HA   ILE  64           HA       ILE  64  77.086  -7.775   5.201
  480    HB   ILE  64           HB       ILE  64  77.624  -9.258   7.036
  481   HG12  ILE  64          HG12      ILE  64  74.715  -8.486   7.354
  482   HG13  ILE  64          HG11      ILE  64  75.320  -9.312   5.918
  483   HG21  ILE  64          HG21      ILE  64  76.146  -7.273   8.791
  484   HG22  ILE  64          HG22      ILE  64  77.897  -7.479   8.755
  485   HG23  ILE  64          HG23      ILE  64  76.865  -8.794   9.318
  486   HD11  ILE  64          HD11      ILE  64  75.553 -10.323   8.768
  487   HD12  ILE  64          HD12      ILE  64  76.184 -11.142   7.340
  488   HD13  ILE  64          HD13      ILE  64  74.444 -10.940   7.543
  489    H    THR  65           HN       THR  65  76.822  -5.233   7.603
  490    HA   THR  65           HA       THR  65  74.961  -3.863   8.176
  491    HB   THR  65           HB       THR  65  74.094  -2.688   6.275
  492    HG1  THR  65           HG1      THR  65  75.024  -4.848   4.694
  493   HG21  THR  65          HG21      THR  65  76.884  -3.716   5.692
  494   HG22  THR  65          HG22      THR  65  76.464  -2.282   6.629
  495   HG23  THR  65          HG23      THR  65  76.149  -2.326   4.894
  496    H    VAL  66           HN       VAL  66  74.586  -6.736   8.177
  497    HA   VAL  66           HA       VAL  66  72.802  -8.199   8.620
  498    HB   VAL  66           HB       VAL  66  70.863  -6.065   7.714
  499   HG11  VAL  66          HG11      VAL  66  69.379  -7.171   9.286
  500   HG12  VAL  66          HG12      VAL  66  70.697  -8.183   9.878
  501   HG13  VAL  66          HG13      VAL  66  70.090  -8.397   8.236
  502   HG21  VAL  66          HG21      VAL  66  70.899  -5.622  10.343
  503   HG22  VAL  66          HG22      VAL  66  71.993  -4.762   9.261
  504   HG23  VAL  66          HG23      VAL  66  72.570  -6.158  10.170
  505    H    ILE  67           HN       ILE  67  72.586  -6.144   5.762
  506    HA   ILE  67           HA       ILE  67  72.237  -8.581   4.103
  507    HB   ILE  67           HB       ILE  67  70.576  -6.087   3.670
  508   HG12  ILE  67          HG12      ILE  67  69.806  -8.754   4.901
  509   HG13  ILE  67          HG11      ILE  67  69.893  -7.212   5.753
  510   HG21  ILE  67          HG21      ILE  67  69.391  -7.483   2.062
  511   HG22  ILE  67          HG22      ILE  67  70.370  -8.880   2.505
  512   HG23  ILE  67          HG23      ILE  67  71.112  -7.509   1.681
  513   HD11  ILE  67          HD11      ILE  67  67.967  -8.024   3.570
  514   HD12  ILE  67          HD12      ILE  67  68.210  -6.338   4.027
  515   HD13  ILE  67          HD13      ILE  67  67.592  -7.492   5.209
  516    H1U  RCY  68           H1U      RCY  68  73.901  -0.888   3.951
  517    H1S  RCY  68           H1S      RCY  68  77.334  -3.766   2.943
  518    HB1  RCY  68           HB1      RCY  68  77.181  -6.910   1.559
  519    HB2  RCY  68           HB2      RCY  68  76.577  -8.049   2.758
  520    HA   RCY  68           HA       RCY  68  74.817  -5.843   1.690
  521    HN1  RCY  68           HN1      RCY  68  74.162  -8.469   2.976
  522    HA   PRO  69           HA       PRO  69  74.164  -7.330  -2.393
  523    HB2  PRO  69           HB2      PRO  69  77.020  -7.132  -3.075
  524    HB3  PRO  69           HB1      PRO  69  75.643  -6.237  -3.734
  525    HG2  PRO  69           HG2      PRO  69  77.543  -5.383  -1.786
  526    HG3  PRO  69           HG1      PRO  69  76.193  -4.478  -2.480
  527    HD2  PRO  69           HD2      PRO  69  76.374  -5.307   0.182
  528    HD3  PRO  69           HD1      PRO  69  74.874  -4.823  -0.640
  529    H    TRP  70           HN       TRP  70  77.325  -8.555  -1.193
  530    HA   TRP  70           HA       TRP  70  77.151 -11.009  -2.666
  531    HD1  TRP  70           HD1      TRP  70  77.467 -10.663   1.430
  532    HE1  TRP  70           HE1      TRP  70  78.339  -8.755   2.925
  533    HE3  TRP  70           HE3      TRP  70  80.829  -8.514  -1.756
  534    HZ2  TRP  70           HZ2      TRP  70  80.218  -6.597   2.789
  535    HZ3  TRP  70           HZ3      TRP  70  82.144  -6.539  -1.051
  536    HH2  TRP  70           HH2      TRP  70  81.845  -5.577   1.213
  537    HB2  TRP  70           HB2      TRP  70  78.880 -11.766  -0.869
  538    HB3  TRP  70           HB1      TRP  70  79.323 -10.464  -1.972
  539    H    GLU  71           HN       GLU  71  74.771 -10.299  -0.922
  540    HA   GLU  71           HA       GLU  71  74.507 -12.997   0.270
  541    HB2  GLU  71           HB2      GLU  71  74.970 -12.075   2.316
  542    HB3  GLU  71           HB1      GLU  71  74.607 -10.442   1.778
  543    HG2  GLU  71           HG2      GLU  71  72.972 -11.338   3.476
  544    HG3  GLU  71           HG1      GLU  71  72.222 -10.838   1.959
  545    H    ALA  72           HN       ALA  72  72.788  -9.873  -0.202
  546    HA   ALA  72           HA       ALA  72  70.232 -11.254  -0.490
  547    HB1  ALA  72           HB1      ALA  72  69.817  -9.127   0.287
  548    HB2  ALA  72           HB2      ALA  72  69.675  -8.800  -1.438
  549    HB3  ALA  72           HB3      ALA  72  71.177  -8.427  -0.589
  550    H1U  RCY  73           H1U      RCY  73  73.050  -3.182  -1.735
  551    H1S  RCY  73           H1S      RCY  73  71.327  -5.212  -5.203
  552    HB1  RCY  73           HB1      RCY  73  69.723  -8.087  -4.852
  553    HB2  RCY  73           HB2      RCY  73  70.300  -8.683  -6.407
  554    HA   RCY  73           HA       RCY  73  70.226 -10.603  -5.006
  555    HN1  RCY  73           HN1      RCY  73  70.990  -8.803  -2.841
  556    H    ASN  74           HN       ASN  74  72.688 -11.284  -3.531
  557    HA   ASN  74           HA       ASN  74  74.974 -11.754  -3.926
  558    HB2  ASN  74           HB2      ASN  74  75.286 -12.994  -6.039
  559    HB3  ASN  74           HB1      ASN  74  73.789 -13.473  -5.237
  560   HD21  ASN  74          HD21      ASN  74  71.748 -12.762  -6.197
  561   HD22  ASN  74          HD22      ASN  74  71.683 -12.152  -7.779
  562    H    HIS  75           HN       HIS  75  75.729 -11.533  -6.992
  563    HA   HIS  75           HA       HIS  75  76.922  -8.851  -6.699
  564    HD1  HIS  75           HD1      HIS  75  78.771 -12.701  -7.644
  565    HD2  HIS  75           HD2      HIS  75  79.499  -8.812  -6.325
  566    HE1  HIS  75           HE1      HIS  75  80.687 -12.852  -5.995
  567    HE2  HIS  75           HE2      HIS  75  81.140 -10.491  -5.184
  568    HB2  HIS  75           HB2      HIS  75  77.231 -11.078  -8.723
  569    HB3  HIS  75           HB1      HIS  75  77.981  -9.499  -8.947
  570    H1U  RCY  76           H1U      RCY  76  74.533  -2.417  -3.921
  571    H1S  RCY  76           H1S      RCY  76  75.355  -4.755  -7.091
  572    HB1  RCY  76           HB1      RCY  76  74.603  -5.411 -10.664
  573    HB2  RCY  76           HB2      RCY  76  75.991  -5.598  -9.592
  574    HA   RCY  76           HA       RCY  76  74.189  -7.918 -10.313
  575    HN1  RCY  76           HN1      RCY  76  77.018  -8.153  -9.457
  576    H    GLU  77           HN       GLU  77  74.130  -8.256 -12.487
  577    HA   GLU  77           HA       GLU  77  76.578  -8.490 -14.015
  578    HB2  GLU  77           HB2      GLU  77  73.660  -8.487 -14.833
  579    HB3  GLU  77           HB1      GLU  77  74.988  -8.782 -15.956
  580    HG2  GLU  77           HG2      GLU  77  75.691 -10.734 -14.721
  581    HG3  GLU  77           HG1      GLU  77  74.549 -10.384 -13.423
  582    H    LEU  78           HN       LEU  78  74.044  -6.796 -15.650
  583    HA   LEU  78           HA       LEU  78  75.891  -4.530 -16.107
  584    HG   LEU  78           HG       LEU  78  75.957  -5.918 -18.014
  585    HB2  LEU  78           HB2      LEU  78  73.390  -5.559 -17.404
  586    HB3  LEU  78           HB1      LEU  78  73.817  -3.862 -17.627
  587   HD11  LEU  78          HD11      LEU  78  75.242  -6.075 -20.431
  588   HD12  LEU  78          HD12      LEU  78  73.719  -5.318 -19.967
  589   HD13  LEU  78          HD13      LEU  78  74.160  -6.891 -19.303
  590   HD21  LEU  78          HD21      LEU  78  75.273  -3.392 -19.544
  591   HD22  LEU  78          HD22      LEU  78  76.798  -4.276 -19.570
  592   HD23  LEU  78          HD23      LEU  78  76.306  -3.409 -18.115
  593    H    HIS  79           HN       HIS  79  74.724  -2.289 -16.167
  594    HA   HIS  79           HA       HIS  79  73.555  -1.883 -13.504
  595    HD1  HIS  79           HD1      HIS  79  72.672   2.031 -15.440
  596    HD2  HIS  79           HD2      HIS  79  74.770  -0.873 -17.576
  597    HE1  HIS  79           HE1      HIS  79  72.384   2.599 -17.891
  598    HE2  HIS  79           HE2      HIS  79  73.656   0.838 -19.203
  599    HB2  HIS  79           HB2      HIS  79  73.849   0.453 -13.915
  600    HB3  HIS  79           HB1      HIS  79  75.260  -0.335 -14.621
  601    H    GLU  80           HN       GLU  80  72.341  -2.645 -16.538
  602    HA   GLU  80           HA       GLU  80  69.869  -1.067 -16.309
  603    HB2  GLU  80           HB2      GLU  80  70.592  -3.300 -18.234
  604    HB3  GLU  80           HB1      GLU  80  69.221  -2.200 -18.386
  605    HG2  GLU  80           HG2      GLU  80  70.917  -0.294 -18.358
  606    HG3  GLU  80           HG1      GLU  80  72.164  -1.526 -18.560
  607    H    LEU  81           HN       LEU  81  71.065  -4.089 -15.201
  608    HA   LEU  81           HA       LEU  81  68.377  -5.283 -14.912
  609    HG   LEU  81           HG       LEU  81  70.591  -8.008 -15.819
  610    HB2  LEU  81           HB2      LEU  81  71.189  -6.201 -14.324
  611    HB3  LEU  81           HB1      LEU  81  69.817  -7.051 -13.618
  612   HD11  LEU  81          HD11      LEU  81  68.116  -7.876 -14.826
  613   HD12  LEU  81          HD12      LEU  81  68.432  -8.575 -16.414
  614   HD13  LEU  81          HD13      LEU  81  67.848  -6.916 -16.281
  615   HD21  LEU  81          HD21      LEU  81  71.081  -5.657 -16.741
  616   HD22  LEU  81          HD22      LEU  81  69.345  -5.531 -17.026
  617   HD23  LEU  81          HD23      LEU  81  70.283  -6.783 -17.839
  618    H    ALA  82           HN       ALA  82  69.890  -2.871 -13.381
  619    HA   ALA  82           HA       ALA  82  69.715  -3.625 -10.606
  620    HB1  ALA  82           HB1      ALA  82  69.406  -0.879 -10.625
  621    HB2  ALA  82           HB2      ALA  82  70.209  -1.173 -12.166
  622    HB3  ALA  82           HB3      ALA  82  70.956  -1.717 -10.665
  623    H    GLN  83           HN       GLN  83  67.393  -4.554 -11.766
  624    HA   GLN  83           HA       GLN  83  65.062  -4.528 -11.549
  625    HB2  GLN  83           HB2      GLN  83  65.947  -2.930  -9.141
  626    HB3  GLN  83           HB1      GLN  83  64.255  -3.328  -9.437
  627    HG2  GLN  83           HG2      GLN  83  65.359  -4.991  -7.954
  628    HG3  GLN  83           HG1      GLN  83  64.790  -5.716  -9.458
  629   HE21  GLN  83          HE21      GLN  83  66.358  -7.331  -9.839
  630   HE22  GLN  83          HE22      GLN  83  68.025  -7.028  -9.947
  631    H    TYR  84           HN       TYR  84  65.267  -1.332 -10.107
  632    HA   TYR  84           HA       TYR  84  63.767  -0.269 -12.450
  633    HD1  TYR  84           HD2      TYR  84  62.074   1.826 -12.487
  634    HD2  TYR  84           HD1      TYR  84  61.774  -0.945  -9.218
  635    HE1  TYR  84           HE2      TYR  84  59.666   1.503 -12.982
  636    HE2  TYR  84           HE1      TYR  84  59.366  -1.268  -9.714
  637    HH   TYR  84           HH       TYR  84  57.554   0.715 -11.397
  638    HB2  TYR  84           HB2      TYR  84  63.775   0.234  -9.552
  639    HB3  TYR  84           HB1      TYR  84  63.772   1.716 -10.509
  640    H    GLY  85           HN       GLY  85  66.871  -0.594 -11.886
  641    HA2  GLY  85           HA2      GLY  85  68.804   0.649 -12.390
  642    HA3  GLY  85           HA1      GLY  85  67.777   1.455 -13.577
  643    H    ILE  86           HN       ILE  86  67.483   1.472 -10.040
  644    HA   ILE  86           HA       ILE  86  66.826   4.183  -9.771
  645    HB   ILE  86           HB       ILE  86  68.357   2.373  -7.882
  646   HG12  ILE  86          HG12      ILE  86  65.465   3.255  -7.778
  647   HG13  ILE  86          HG11      ILE  86  65.972   1.794  -8.626
  648   HG21  ILE  86          HG21      ILE  86  67.180   5.134  -7.517
  649   HG22  ILE  86          HG22      ILE  86  68.816   4.591  -7.143
  650   HG23  ILE  86          HG23      ILE  86  67.459   4.047  -6.156
  651   HD11  ILE  86          HD11      ILE  86  66.691   2.328  -5.737
  652   HD12  ILE  86          HD12      ILE  86  66.810   0.805  -6.618
  653   HD13  ILE  86          HD13      ILE  86  65.227   1.464  -6.208
  654    H1U  RCY  87           H1U      RCY  87  70.755   0.061  -6.511
  655    H1S  RCY  87           H1S      RCY  87  74.002   3.240  -8.246
  656    HB1  RCY  87           HB1      RCY  87  72.378   4.023 -12.389
  657    HB2  RCY  87           HB2      RCY  87  71.757   2.633 -11.501
  658    HA   RCY  87           HA       RCY  87  71.612   4.817  -9.713
  659    HN1  RCY  87           HN1      RCY  87  69.792   2.902 -10.820
  Start of MODEL   61
    1    HA   MET   1           HA       MET   1  68.189 -13.614 -17.900
    2    HB2  MET   1           HB2      MET   1  70.114 -15.277 -17.962
    3    HB3  MET   1           HB1      MET   1  71.164 -13.919 -18.368
    4    HG2  MET   1           HG2      MET   1  71.298 -14.128 -15.998
    5    HG3  MET   1           HG1      MET   1  70.222 -12.761 -16.285
    6    HE1  MET   1           HE1      MET   1  68.638 -14.178 -13.161
    7    HE2  MET   1           HE2      MET   1  68.556 -12.725 -14.154
    8    HE3  MET   1           HE3      MET   1  70.123 -13.422 -13.751
    9    H    ASN   2           HN       ASN   2  68.187 -11.531 -17.132
   10    HA   ASN   2           HA       ASN   2  70.135  -9.552 -18.000
   11    HB2  ASN   2           HB2      ASN   2  68.484  -9.744 -19.946
   12    HB3  ASN   2           HB1      ASN   2  67.274  -9.067 -18.855
   13   HD21  ASN   2          HD21      ASN   2  70.438  -8.356 -20.377
   14   HD22  ASN   2          HD22      ASN   2  70.306  -6.669 -20.232
   15    H    LEU   3           HN       LEU   3  67.613  -7.640 -17.598
   16    HA   LEU   3           HA       LEU   3  68.183  -7.034 -14.853
   17    HG   LEU   3           HG       LEU   3  66.437  -5.640 -13.792
   18    HB2  LEU   3           HB2      LEU   3  67.158  -5.518 -16.699
   19    HB3  LEU   3           HB1      LEU   3  65.621  -6.252 -16.243
   20   HD11  LEU   3          HD11      LEU   3  68.645  -4.793 -14.796
   21   HD12  LEU   3          HD12      LEU   3  67.831  -3.714 -13.664
   22   HD13  LEU   3          HD13      LEU   3  67.715  -3.421 -15.399
   23   HD21  LEU   3          HD21      LEU   3  64.390  -4.773 -14.752
   24   HD22  LEU   3          HD22      LEU   3  65.292  -3.699 -15.822
   25   HD23  LEU   3          HD23      LEU   3  65.288  -3.411 -14.082
   26    H    GLU   4           HN       GLU   4  65.103  -6.727 -14.408
   27    HA   GLU   4           HA       GLU   4  64.800  -9.410 -13.157
   28    HB2  GLU   4           HB2      GLU   4  63.408  -6.764 -12.678
   29    HB3  GLU   4           HB1      GLU   4  62.943  -8.269 -11.882
   30    HG2  GLU   4           HG2      GLU   4  65.064  -8.459 -10.795
   31    HG3  GLU   4           HG1      GLU   4  65.767  -7.187 -11.794
   32    HA   PRO   5           HA       PRO   5  62.094 -10.630 -16.535
   33    HB2  PRO   5           HB2      PRO   5  60.804 -12.136 -14.284
   34    HB3  PRO   5           HB1      PRO   5  61.254 -12.704 -15.904
   35    HG2  PRO   5           HG2      PRO   5  62.732 -13.272 -13.753
   36    HG3  PRO   5           HG1      PRO   5  63.463 -12.975 -15.339
   37    HD2  PRO   5           HD2      PRO   5  63.492 -11.259 -12.916
   38    HD3  PRO   5           HD1      PRO   5  64.626 -11.300 -14.283
   39    HA   PRO   6           HA       PRO   6  58.591  -7.904 -16.414
   40    HB2  PRO   6           HB2      PRO   6  56.991 -10.320 -17.185
   41    HB3  PRO   6           HB1      PRO   6  57.003  -8.700 -17.909
   42    HG2  PRO   6           HG2      PRO   6  58.273 -10.770 -19.035
   43    HG3  PRO   6           HG1      PRO   6  58.890  -9.114 -19.136
   44    HD2  PRO   6           HD2      PRO   6  59.948 -11.408 -17.590
   45    HD3  PRO   6           HD1      PRO   6  60.778  -9.933 -18.128
   46    H    LYS   7           HN       LYS   7  56.773  -7.420 -15.088
   47    HA   LYS   7           HA       LYS   7  56.005  -7.425 -12.810
   48    HB2  LYS   7           HB2      LYS   7  53.962  -8.659 -12.796
   49    HB3  LYS   7           HB1      LYS   7  54.235  -8.174 -14.467
   50    HG2  LYS   7           HG2      LYS   7  55.488 -10.505 -14.605
   51    HG3  LYS   7           HG1      LYS   7  54.463 -10.895 -13.224
   52    HD2  LYS   7           HD2      LYS   7  53.063 -11.526 -14.960
   53    HD3  LYS   7           HD1      LYS   7  52.570  -9.845 -14.759
   54    HE2  LYS   7           HE2      LYS   7  52.931 -10.033 -17.081
   55    HE3  LYS   7           HE1      LYS   7  54.430  -9.315 -16.490
   56    HZ1  LYS   7           HZ1      LYS   7  53.997 -12.217 -16.953
   57    HZ2  LYS   7           HZ2      LYS   7  55.449 -11.481 -16.463
   58    HZ3  LYS   7           HZ3      LYS   7  54.818 -11.176 -18.011
   59    H    ALA   8           HN       ALA   8  57.455  -7.984 -11.225
   60    HA   ALA   8           HA       ALA   8  58.284 -10.796 -10.901
   61    HB1  ALA   8           HB1      ALA   8  58.910  -8.384  -9.170
   62    HB2  ALA   8           HB2      ALA   8  59.890  -8.914 -10.538
   63    HB3  ALA   8           HB3      ALA   8  59.721  -9.949  -9.120
   64    H    GLU   9           HN       GLU   9  58.363 -10.073  -7.867
   65    HA   GLU   9           HA       GLU   9  55.482 -10.375  -7.216
   66    HB2  GLU   9           HB2      GLU   9  56.700 -12.664  -7.523
   67    HB3  GLU   9           HB1      GLU   9  57.482 -12.273  -5.992
   68    HG2  GLU   9           HG2      GLU   9  55.296 -12.024  -4.909
   69    HG3  GLU   9           HG1      GLU   9  54.483 -12.346  -6.442
   70    H1U  RCY  10           H1U      RCY  10  58.824 -11.877   0.145
   71    H1S  RCY  10           H1S      RCY  10  60.299 -11.399  -3.596
   72    HB1  RCY  10           HB1      RCY  10  59.419  -7.942  -3.343
   73    HB2  RCY  10           HB2      RCY  10  59.908  -7.296  -4.910
   74    HA   RCY  10           HA       RCY  10  57.191  -7.982  -3.903
   75    HN1  RCY  10           HN1      RCY  10  57.539  -8.285  -6.826
   76    H    ARG  11           HN       ARG  11  55.978  -6.666  -6.161
   77    HA   ARG  11           HA       ARG  11  57.225  -4.188  -6.822
   78    HE   ARG  11           HE       ARG  11  57.002  -4.533  -8.775
   79    HB2  ARG  11           HB2      ARG  11  55.158  -5.263  -7.898
   80    HB3  ARG  11           HB1      ARG  11  54.240  -4.593  -6.551
   81    HG2  ARG  11           HG2      ARG  11  54.102  -2.668  -7.722
   82    HG3  ARG  11           HG1      ARG  11  55.834  -2.467  -7.453
   83    HD2  ARG  11           HD2      ARG  11  54.468  -3.762  -9.821
   84    HD3  ARG  11           HD1      ARG  11  55.518  -2.345  -9.821
   85   HH11  ARG  11          HH21      ARG  11  55.478  -3.437 -11.667
   86   HH12  ARG  11          HH22      ARG  11  56.579  -4.262 -12.719
   87   HH21  ARG  11          HH11      ARG  11  58.449  -5.617 -10.132
   88   HH22  ARG  11          HH12      ARG  11  58.261  -5.497 -11.849
   89    H    SER  12           HN       SER  12  54.727  -2.632  -5.904
   90    HA   SER  12           HA       SER  12  54.835  -2.502  -3.028
   91    HG   SER  12           HG       SER  12  55.295   0.421  -2.669
   92    HB2  SER  12           HB2      SER  12  57.089  -1.576  -3.555
   93    HB3  SER  12           HB1      SER  12  56.323  -0.320  -4.523
   94    H    ALA  13           HN       ALA  13  54.750   0.653  -3.838
   95    HA   ALA  13           HA       ALA  13  53.025   2.183  -4.262
   96    HB1  ALA  13           HB1      ALA  13  51.431   0.024  -5.617
   97    HB2  ALA  13           HB2      ALA  13  52.910   0.616  -6.373
   98    HB3  ALA  13           HB3      ALA  13  51.583   1.729  -6.041
   99    H    THR  14           HN       THR  14  52.616  -0.678  -2.521
  100    HA   THR  14           HA       THR  14  49.865  -0.004  -1.634
  101    HB   THR  14           HB       THR  14  50.237  -2.122  -0.211
  102    HG1  THR  14           HG1      THR  14  52.160  -2.907  -2.005
  103   HG21  THR  14          HG21      THR  14  50.224  -2.112  -3.232
  104   HG22  THR  14          HG22      THR  14  48.851  -2.286  -2.139
  105   HG23  THR  14          HG23      THR  14  50.025  -3.593  -2.295
  106    H    ARG  15           HN       ARG  15  52.582  -1.204   0.320
  107    HA   ARG  15           HA       ARG  15  53.003   1.246   1.762
  108    HE   ARG  15           HE       ARG  15  49.115  -3.008   4.771
  109    HB2  ARG  15           HB2      ARG  15  51.943   0.543   3.914
  110    HB3  ARG  15           HB1      ARG  15  50.763   0.846   2.639
  111    HG2  ARG  15           HG2      ARG  15  50.989  -1.698   2.136
  112    HG3  ARG  15           HG1      ARG  15  51.697  -1.796   3.749
  113    HD2  ARG  15           HD2      ARG  15  49.682  -0.719   4.695
  114    HD3  ARG  15           HD1      ARG  15  48.971  -0.643   3.083
  115   HH11  ARG  15          HH21      ARG  15  49.067  -1.759   1.558
  116   HH12  ARG  15          HH22      ARG  15  48.402  -3.201   0.865
  117   HH21  ARG  15          HH11      ARG  15  48.248  -4.898   3.885
  118   HH22  ARG  15          HH12      ARG  15  47.938  -4.978   2.183
  119    H    VAL  16           HN       VAL  16  54.178  -1.416   0.660
  120    HA   VAL  16           HA       VAL  16  55.950  -2.848   1.217
  121    HB   VAL  16           HB       VAL  16  56.546  -0.656   3.229
  122   HG11  VAL  16          HG11      VAL  16  57.950  -2.469   3.763
  123   HG12  VAL  16          HG12      VAL  16  58.937  -1.511   2.660
  124   HG13  VAL  16          HG13      VAL  16  58.114  -2.958   2.077
  125   HG21  VAL  16          HG21      VAL  16  58.106   0.107   1.354
  126   HG22  VAL  16          HG22      VAL  16  56.385   0.368   1.068
  127   HG23  VAL  16          HG23      VAL  16  57.213  -0.983   0.294
  128    H    MET  17           HN       MET  17  56.940  -4.089   3.145
  129    HA   MET  17           HA       MET  17  54.920  -5.427   4.580
  130    HB2  MET  17           HB2      MET  17  57.192  -6.336   4.285
  131    HB3  MET  17           HB1      MET  17  57.835  -5.087   5.350
  132    HG2  MET  17           HG2      MET  17  56.539  -5.942   7.221
  133    HG3  MET  17           HG1      MET  17  55.734  -7.111   6.174
  134    HE1  MET  17           HE1      MET  17  58.949  -5.697   7.428
  135    HE2  MET  17           HE2      MET  17  59.984  -7.074   7.796
  136    HE3  MET  17           HE3      MET  17  58.536  -6.787   8.757
  137    H    GLY  18           HN       GLY  18  57.367  -3.845   6.557
  138    HA2  GLY  18           HA2      GLY  18  57.145  -2.264   8.295
  139    HA3  GLY  18           HA1      GLY  18  55.525  -1.899   7.698
  140    H    GLY  19           HN       GLY  19  53.787  -2.809   8.742
  141    HA2  GLY  19           HA2      GLY  19  52.610  -3.975  10.400
  142    HA3  GLY  19           HA1      GLY  19  53.785  -5.269  10.161
  143    HA   PRO  20           HA       PRO  20  54.936  -4.157  14.350
  144    HB2  PRO  20           HB2      PRO  20  56.849  -6.059  14.726
  145    HB3  PRO  20           HB1      PRO  20  55.113  -6.428  14.740
  146    HG2  PRO  20           HG2      PRO  20  57.108  -6.835  12.570
  147    HG3  PRO  20           HG1      PRO  20  55.767  -7.872  13.081
  148    HD2  PRO  20           HD2      PRO  20  55.657  -6.207  10.885
  149    HD3  PRO  20           HD1      PRO  20  54.225  -6.733  11.797
  150    H1U  RCY  21           H1U      RCY  21  58.289  -2.093   4.423
  151    H1S  RCY  21           H1S      RCY  21  59.950  -2.863   8.181
  152    HB1  RCY  21           HB1      RCY  21  58.731  -3.677  11.017
  153    HB2  RCY  21           HB2      RCY  21  60.131  -2.865  11.715
  154    HA   RCY  21           HA       RCY  21  58.777  -2.099  13.352
  155    HN1  RCY  21           HN1      RCY  21  56.280  -2.874  11.923
  156    H    THR  22           HN       THR  22  59.153   0.099  13.284
  157    HA   THR  22           HA       THR  22  57.062   1.761  12.021
  158    HB   THR  22           HB       THR  22  58.321   3.613  13.259
  159    HG1  THR  22           HG1      THR  22  59.902   1.428  13.713
  160   HG21  THR  22          HG21      THR  22  57.511   2.756  15.512
  161   HG22  THR  22          HG22      THR  22  57.111   1.244  14.698
  162   HG23  THR  22          HG23      THR  22  56.310   2.741  14.221
  163    HA   PRO  23           HA       PRO  23  60.144   2.439   8.748
  164    HB2  PRO  23           HB2      PRO  23  58.435   3.334   6.844
  165    HB3  PRO  23           HB1      PRO  23  58.562   1.615   7.266
  166    HG2  PRO  23           HG2      PRO  23  56.484   3.593   8.024
  167    HG3  PRO  23           HG1      PRO  23  56.326   1.866   7.667
  168    HD2  PRO  23           HD2      PRO  23  56.395   2.977  10.234
  169    HD3  PRO  23           HD1      PRO  23  56.697   1.270   9.848
  170    H    ARG  24           HN       ARG  24  60.215   4.501   7.065
  171    HA   ARG  24           HA       ARG  24  60.647   6.797   6.888
  172    HE   ARG  24           HE       ARG  24  56.770   8.033   6.557
  173    HB2  ARG  24           HB2      ARG  24  58.118   6.761   7.466
  174    HB3  ARG  24           HB1      ARG  24  58.628   7.243   9.084
  175    HG2  ARG  24           HG2      ARG  24  59.856   9.170   8.092
  176    HG3  ARG  24           HG1      ARG  24  59.241   8.712   6.503
  177    HD2  ARG  24           HD2      ARG  24  57.491   9.373   8.889
  178    HD3  ARG  24           HD1      ARG  24  57.877  10.504   7.591
  179   HH11  ARG  24          HH21      ARG  24  56.079  11.052   8.072
  180   HH12  ARG  24          HH22      ARG  24  54.473  11.157   7.432
  181   HH21  ARG  24          HH11      ARG  24  54.676   8.152   5.713
  182   HH22  ARG  24          HH12      ARG  24  53.678   9.515   6.097
  183    H    LYS  25           HN       LYS  25  62.262   8.029   7.753
  184    HA   LYS  25           HA       LYS  25  63.185   7.338  10.489
  185    HB2  LYS  25           HB2      LYS  25  64.646   9.192   8.620
  186    HB3  LYS  25           HB1      LYS  25  65.303   8.107   9.844
  187    HG2  LYS  25           HG2      LYS  25  63.859   7.087   7.390
  188    HG3  LYS  25           HG1      LYS  25  65.602   7.360   7.415
  189    HD2  LYS  25           HD2      LYS  25  65.902   5.767   9.199
  190    HD3  LYS  25           HD1      LYS  25  64.160   5.622   9.434
  191    HE2  LYS  25           HE2      LYS  25  65.439   4.967   6.781
  192    HE3  LYS  25           HE1      LYS  25  65.333   3.766   8.068
  193    HZ1  LYS  25           HZ1      LYS  25  63.284   3.371   7.360
  194    HZ2  LYS  25           HZ2      LYS  25  63.301   4.711   6.316
  195    HZ3  LYS  25           HZ3      LYS  25  62.841   4.903   7.940
  196    H    GLY  26           HN       GLY  26  62.745   8.686  12.161
  197    HA2  GLY  26           HA2      GLY  26  61.247  11.099  11.850
  198    HA3  GLY  26           HA1      GLY  26  62.071  10.607  13.330
  199    HA   PRO  27           HA       PRO  27  64.950  13.943  13.111
  200    HB2  PRO  27           HB2      PRO  27  67.061  11.818  13.258
  201    HB3  PRO  27           HB1      PRO  27  66.890  13.302  14.215
  202    HG2  PRO  27           HG2      PRO  27  66.217  10.889  15.177
  203    HG3  PRO  27           HG1      PRO  27  65.366  12.371  15.641
  204    HD2  PRO  27           HD2      PRO  27  64.422  10.135  13.953
  205    HD3  PRO  27           HD1      PRO  27  63.481  11.370  14.816
  206    HA   PRO  28           HA       PRO  28  66.229  14.516   8.899
  207    HB2  PRO  28           HB2      PRO  28  68.925  15.192  10.027
  208    HB3  PRO  28           HB1      PRO  28  67.944  16.081   8.845
  209    HG2  PRO  28           HG2      PRO  28  68.111  16.832  11.410
  210    HG3  PRO  28           HG1      PRO  28  66.637  17.048  10.453
  211    HD2  PRO  28           HD2      PRO  28  67.157  15.160  12.672
  212    HD3  PRO  28           HD1      PRO  28  65.608  15.760  12.043
  213    H    LYS  29           HN       LYS  29  66.847  12.948   7.448
  214    HA   LYS  29           HA       LYS  29  68.502  10.707   8.397
  215    HB2  LYS  29           HB2      LYS  29  67.987   9.728   6.166
  216    HB3  LYS  29           HB1      LYS  29  66.531  10.207   7.039
  217    HG2  LYS  29           HG2      LYS  29  66.478  12.333   5.778
  218    HG3  LYS  29           HG1      LYS  29  67.920  11.838   4.891
  219    HD2  LYS  29           HD2      LYS  29  66.767  10.003   3.865
  220    HD3  LYS  29           HD1      LYS  29  65.376  10.199   4.932
  221    HE2  LYS  29           HE2      LYS  29  66.295  12.348   3.008
  222    HE3  LYS  29           HE1      LYS  29  65.073  11.145   2.596
  223    HZ1  LYS  29           HZ1      LYS  29  63.654  11.927   4.277
  224    HZ2  LYS  29           HZ2      LYS  29  64.231  13.321   3.497
  225    HZ3  LYS  29           HZ3      LYS  29  64.872  12.860   5.001
  226    H1U  RCY  30           H1U      RCY  30  72.118  12.628  -0.847
  227    H1S  RCY  30           H1S      RCY  30  73.308  14.375   2.679
  228    HB1  RCY  30           HB1      RCY  30  70.500  15.508   6.044
  229    HB2  RCY  30           HB2      RCY  30  69.841  14.921   4.518
  230    HA   RCY  30           HA       RCY  30  71.091  12.795   4.820
  231    HN1  RCY  30           HN1      RCY  30  68.828  13.528   6.344
  232    H    LYS  31           HN       LYS  31  71.466  15.047   7.535
  233    HA   LYS  31           HA       LYS  31  74.101  13.854   8.115
  234    HB2  LYS  31           HB2      LYS  31  72.621  16.279   9.168
  235    HB3  LYS  31           HB1      LYS  31  74.140  15.731   9.872
  236    HG2  LYS  31           HG2      LYS  31  74.973  17.198   8.293
  237    HG3  LYS  31           HG1      LYS  31  74.904  15.733   7.314
  238    HD2  LYS  31           HD2      LYS  31  72.519  16.462   6.690
  239    HD3  LYS  31           HD1      LYS  31  72.948  18.034   7.366
  240    HE2  LYS  31           HE2      LYS  31  74.879  18.164   5.826
  241    HE3  LYS  31           HE1      LYS  31  74.426  16.605   5.136
  242    HZ1  LYS  31           HZ1      LYS  31  72.768  17.513   3.969
  243    HZ2  LYS  31           HZ2      LYS  31  73.581  18.983   4.221
  244    HZ3  LYS  31           HZ3      LYS  31  72.288  18.541   5.230
  245    H    GLN  32           HN       GLN  32  73.566  14.784  11.041
  246    HA   GLN  32           HA       GLN  32  73.181  13.577  13.023
  247    HB2  GLN  32           HB2      GLN  32  70.680  13.647  11.439
  248    HB3  GLN  32           HB1      GLN  32  70.714  12.412  12.695
  249    HG2  GLN  32           HG2      GLN  32  69.819  14.469  13.642
  250    HG3  GLN  32           HG1      GLN  32  71.413  14.169  14.337
  251   HE21  GLN  32          HE21      GLN  32  70.113  16.814  14.066
  252   HE22  GLN  32          HE22      GLN  32  71.122  17.745  13.068
  253    H    ARG  33           HN       ARG  33  74.897  12.013  12.483
  254    HA   ARG  33           HA       ARG  33  73.848   9.282  12.449
  255    HE   ARG  33           HE       ARG  33  74.355   9.772   7.911
  256    HB2  ARG  33           HB2      ARG  33  75.400   8.661  10.500
  257    HB3  ARG  33           HB1      ARG  33  73.912   9.511  10.081
  258    HG2  ARG  33           HG2      ARG  33  75.033  11.547   9.704
  259    HG3  ARG  33           HG1      ARG  33  76.451  11.041  10.622
  260    HD2  ARG  33           HD2      ARG  33  76.766  11.025   8.110
  261    HD3  ARG  33           HD1      ARG  33  77.105   9.486   8.902
  262   HH11  ARG  33          HH21      ARG  33  77.607   8.772   7.353
  263   HH12  ARG  33          HH22      ARG  33  77.187   7.642   6.109
  264   HH21  ARG  33          HH11      ARG  33  73.788   8.302   6.290
  265   HH22  ARG  33          HH12      ARG  33  75.025   7.376   5.508
  266    H    GLN  34           HN       GLN  34  75.842  11.472  13.673
  267    HA   GLN  34           HA       GLN  34  77.792  11.370  14.967
  268    HB2  GLN  34           HB2      GLN  34  76.443   9.360  15.856
  269    HB3  GLN  34           HB1      GLN  34  77.511   8.364  14.866
  270    HG2  GLN  34           HG2      GLN  34  79.459   9.557  16.014
  271    HG3  GLN  34           HG1      GLN  34  78.271  10.186  17.156
  272   HE21  GLN  34          HE21      GLN  34  79.060   6.981  15.669
  273   HE22  GLN  34          HE22      GLN  34  78.885   6.110  17.115
  274    H    THR  35           HN       THR  35  78.971  12.093  13.022
  275    HA   THR  35           HA       THR  35  81.211  10.374  12.437
  276    HB   THR  35           HB       THR  35  80.180  10.841   9.809
  277    HG1  THR  35           HG1      THR  35  78.137  10.556  10.097
  278   HG21  THR  35          HG21      THR  35  81.728   9.061  10.358
  279   HG22  THR  35          HG22      THR  35  80.245   8.331   9.744
  280   HG23  THR  35          HG23      THR  35  80.570   8.343  11.478
  281    H    ARG  36           HN       ARG  36  79.581  12.719  10.295
  282    HA   ARG  36           HA       ARG  36  80.437  14.718   9.387
  283    HE   ARG  36           HE       ARG  36  80.474  15.643  14.086
  284    HB2  ARG  36           HB2      ARG  36  81.349  15.102  12.255
  285    HB3  ARG  36           HB1      ARG  36  81.033  16.370  11.070
  286    HG2  ARG  36           HG2      ARG  36  78.657  15.530  10.928
  287    HG3  ARG  36           HG1      ARG  36  79.018  14.463  12.285
  288    HD2  ARG  36           HD2      ARG  36  79.122  17.490  12.265
  289    HD3  ARG  36           HD1      ARG  36  78.016  16.469  13.184
  290   HH11  ARG  36          HH21      ARG  36  78.952  18.702  13.626
  291   HH12  ARG  36          HH22      ARG  36  79.798  19.468  14.929
  292   HH21  ARG  36          HH11      ARG  36  81.587  16.625  15.791
  293   HH22  ARG  36          HH12      ARG  36  81.289  18.292  16.155
  294    H    GLN  37           HN       GLN  37  82.238  12.376   9.356
  295    HA   GLN  37           HA       GLN  37  84.790  13.872   9.028
  296    HB2  GLN  37           HB2      GLN  37  84.767  12.709  11.274
  297    HB3  GLN  37           HB1      GLN  37  84.636  11.178  10.412
  298    HG2  GLN  37           HG2      GLN  37  86.737  11.721   9.187
  299    HG3  GLN  37           HG1      GLN  37  86.885  13.195  10.145
  300   HE21  GLN  37          HE21      GLN  37  89.021  11.712  10.585
  301   HE22  GLN  37          HE22      GLN  37  88.922  10.777  11.998
  302    H1U  RCY  38           H1U      RCY  38  78.339  11.419   5.203
  303    H1S  RCY  38           H1S      RCY  38  81.840   8.241   4.362
  304    HB1  RCY  38           HB1      RCY  38  83.652  10.142   5.147
  305    HB2  RCY  38           HB2      RCY  38  82.881  10.411   6.708
  306    HA   RCY  38           HA       RCY  38  85.357   9.003   7.121
  307    HN1  RCY  38           HN1      RCY  38  85.067  10.477   8.923
  308    H    LYS  39           HN       LYS  39  87.391   9.320   6.281
  309    HA   LYS  39           HA       LYS  39  87.864  11.698   4.553
  310    HB2  LYS  39           HB2      LYS  39  89.481  11.130   6.407
  311    HB3  LYS  39           HB1      LYS  39  89.872   9.648   5.536
  312    HG2  LYS  39           HG2      LYS  39  91.524  11.121   4.765
  313    HG3  LYS  39           HG1      LYS  39  90.292  11.253   3.509
  314    HD2  LYS  39           HD2      LYS  39  90.444  13.488   3.902
  315    HD3  LYS  39           HD1      LYS  39  89.434  13.136   5.305
  316    HE2  LYS  39           HE2      LYS  39  91.260  14.334   6.209
  317    HE3  LYS  39           HE1      LYS  39  91.655  12.647   6.536
  318    HZ1  LYS  39           HZ1      LYS  39  93.404  14.206   5.453
  319    HZ2  LYS  39           HZ2      LYS  39  92.551  13.873   4.022
  320    HZ3  LYS  39           HZ3      LYS  39  93.249  12.606   4.912
  321    H    SER  40           HN       SER  40  89.956   9.097   3.905
  322    HA   SER  40           HA       SER  40  88.302   7.886   1.807
  323    HG   SER  40           HG       SER  40  88.831   8.555  -0.752
  324    HB2  SER  40           HB2      SER  40  89.074  10.018   0.767
  325    HB3  SER  40           HB1      SER  40  90.741   9.518   1.041
  326    H    LYS  41           HN       LYS  41  90.129   7.213   4.190
  327    HA   LYS  41           HA       LYS  41  91.838   5.229   2.727
  328    HB2  LYS  41           HB2      LYS  41  93.251   5.369   4.907
  329    HB3  LYS  41           HB1      LYS  41  93.401   6.674   3.732
  330    HG2  LYS  41           HG2      LYS  41  91.790   8.027   4.997
  331    HG3  LYS  41           HG1      LYS  41  91.582   6.716   6.159
  332    HD2  LYS  41           HD2      LYS  41  94.340   7.767   5.612
  333    HD3  LYS  41           HD1      LYS  41  93.269   8.668   6.686
  334    HE2  LYS  41           HE2      LYS  41  92.917   6.577   8.013
  335    HE3  LYS  41           HE1      LYS  41  94.105   5.769   6.990
  336    HZ1  LYS  41           HZ1      LYS  41  95.631   6.542   8.380
  337    HZ2  LYS  41           HZ2      LYS  41  94.518   7.551   9.173
  338    HZ3  LYS  41           HZ3      LYS  41  95.316   8.096   7.776
  339    HA   PRO  42           HA       PRO  42  89.036   2.884   5.525
  340    HB2  PRO  42           HB2      PRO  42  87.868   1.308   3.677
  341    HB3  PRO  42           HB1      PRO  42  87.361   2.994   3.908
  342    HG2  PRO  42           HG2      PRO  42  89.019   1.801   1.762
  343    HG3  PRO  42           HG1      PRO  42  87.869   3.144   1.690
  344    HD2  PRO  42           HD2      PRO  42  90.683   3.367   1.874
  345    HD3  PRO  42           HD1      PRO  42  89.507   4.679   2.102
  346    HA   PRO  43           HA       PRO  43  91.698  -0.651   5.890
  347    HB2  PRO  43           HB2      PRO  43  89.951  -2.566   6.826
  348    HB3  PRO  43           HB1      PRO  43  90.603  -1.253   7.825
  349    HG2  PRO  43           HG2      PRO  43  87.948  -1.483   6.507
  350    HG3  PRO  43           HG1      PRO  43  88.371  -0.812   8.091
  351    HD2  PRO  43           HD2      PRO  43  87.853   0.758   5.912
  352    HD3  PRO  43           HD1      PRO  43  88.960   1.249   7.213
  353    H    LYS  44           HN       LYS  44  92.456  -2.163   4.434
  354    HA   LYS  44           HA       LYS  44  92.492  -3.595   2.576
  355    HB2  LYS  44           HB2      LYS  44  90.835  -4.808   4.128
  356    HB3  LYS  44           HB1      LYS  44  89.563  -4.109   3.125
  357    HG2  LYS  44           HG2      LYS  44  90.454  -5.184   1.143
  358    HG3  LYS  44           HG1      LYS  44  91.860  -5.762   2.039
  359    HD2  LYS  44           HD2      LYS  44  90.564  -7.285   3.311
  360    HD3  LYS  44           HD1      LYS  44  89.050  -6.496   2.866
  361    HE2  LYS  44           HE2      LYS  44  89.766  -8.729   1.663
  362    HE3  LYS  44           HE1      LYS  44  89.035  -7.423   0.730
  363    HZ1  LYS  44           HZ1      LYS  44  91.205  -8.486  -0.106
  364    HZ2  LYS  44           HZ2      LYS  44  91.956  -7.543   1.090
  365    HZ3  LYS  44           HZ3      LYS  44  91.060  -6.796  -0.145
  366    H    LYS  45           HN       LYS  45  92.601  -2.678   0.587
  367    HA   LYS  45           HA       LYS  45  90.337  -0.958  -0.321
  368    HB2  LYS  45           HB2      LYS  45  91.894   0.051  -1.850
  369    HB3  LYS  45           HB1      LYS  45  92.703  -0.051  -0.287
  370    HG2  LYS  45           HG2      LYS  45  93.587  -2.343  -1.146
  371    HG3  LYS  45           HG1      LYS  45  93.137  -1.741  -2.742
  372    HD2  LYS  45           HD2      LYS  45  94.468   0.393  -2.048
  373    HD3  LYS  45           HD1      LYS  45  95.194  -0.657  -0.831
  374    HE2  LYS  45           HE2      LYS  45  96.658  -0.894  -2.652
  375    HE3  LYS  45           HE1      LYS  45  95.595  -2.291  -2.824
  376    HZ1  LYS  45           HZ1      LYS  45  95.435   0.285  -4.284
  377    HZ2  LYS  45           HZ2      LYS  45  94.213  -0.895  -4.330
  378    HZ3  LYS  45           HZ3      LYS  45  95.762  -1.248  -4.932
  379    H    GLY  46           HN       GLY  46  89.376  -1.321  -2.368
  380    HA2  GLY  46           HA2      GLY  46  89.818  -4.067  -3.456
  381    HA3  GLY  46           HA1      GLY  46  88.308  -3.165  -3.599
  382    H    VAL  47           HN       VAL  47  91.413  -3.734  -5.008
  383    HA   VAL  47           HA       VAL  47  91.597  -1.432  -6.697
  384    HB   VAL  47           HB       VAL  47  92.603  -4.253  -7.175
  385   HG11  VAL  47          HG11      VAL  47  93.239  -1.588  -8.464
  386   HG12  VAL  47          HG12      VAL  47  92.654  -3.053  -9.253
  387   HG13  VAL  47          HG13      VAL  47  94.292  -2.996  -8.603
  388   HG21  VAL  47          HG21      VAL  47  93.361  -3.096  -5.054
  389   HG22  VAL  47          HG22      VAL  47  94.064  -1.838  -6.070
  390   HG23  VAL  47          HG23      VAL  47  94.665  -3.493  -6.173
  391    H    GLN  48           HN       GLN  48  90.387  -4.721  -7.452
  392    HA   GLN  48           HA       GLN  48  89.165  -3.700  -9.938
  393    HB2  GLN  48           HB2      GLN  48  90.328  -6.002  -9.607
  394    HB3  GLN  48           HB1      GLN  48  88.824  -6.484  -8.824
  395    HG2  GLN  48           HG2      GLN  48  87.649  -5.562 -10.932
  396    HG3  GLN  48           HG1      GLN  48  89.247  -5.600 -11.679
  397   HE21  GLN  48          HE21      GLN  48  87.476  -7.285 -12.870
  398   HE22  GLN  48          HE22      GLN  48  87.741  -8.898 -12.413
  399    H    GLY  49           HN       GLY  49  88.284  -3.877  -6.703
  400    HA2  GLY  49           HA2      GLY  49  85.546  -4.703  -6.906
  401    HA3  GLY  49           HA1      GLY  49  86.217  -3.721  -5.604
  402    H1U  RCY  50           H1U      RCY  50  83.632   3.458  -2.126
  403    H1S  RCY  50           H1S      RCY  50  83.950   3.283  -6.212
  404    HB1  RCY  50           HB1      RCY  50  87.060   0.861  -8.442
  405    HB2  RCY  50           HB2      RCY  50  87.036   0.874  -6.679
  406    HA   RCY  50           HA       RCY  50  84.561   0.098  -6.944
  407    HN1  RCY  50           HN1      RCY  50  86.853  -1.382  -6.552
  408    H    GLY  51           HN       GLY  51  83.012  -0.421  -8.387
  409    HA2  GLY  51           HA2      GLY  51  83.522  -1.572 -10.980
  410    HA3  GLY  51           HA1      GLY  51  81.972  -0.935 -10.432
  411    H    ASP  52           HN       ASP  52  85.027   0.862 -10.629
  412    HA   ASP  52           HA       ASP  52  85.571   2.792 -11.846
  413    HB2  ASP  52           HB2      ASP  52  83.559   1.989 -13.933
  414    HB3  ASP  52           HB1      ASP  52  85.150   2.719 -14.146
  415    H    ASP  53           HN       ASP  53  83.552   3.081  -9.870
  416    HA   ASP  53           HA       ASP  53  81.845   4.550  -9.211
  417    HB2  ASP  53           HB2      ASP  53  83.074   6.075 -11.522
  418    HB3  ASP  53           HB1      ASP  53  81.867   6.761 -10.435
  419    H    ILE  54           HN       ILE  54  81.598   2.747 -11.905
  420    HA   ILE  54           HA       ILE  54  78.834   3.749 -12.478
  421    HB   ILE  54           HB       ILE  54  80.814   2.619 -14.483
  422   HG12  ILE  54          HG12      ILE  54  79.584   5.380 -14.432
  423   HG13  ILE  54          HG11      ILE  54  81.118   5.031 -13.634
  424   HG21  ILE  54          HG21      ILE  54  78.991   3.310 -16.106
  425   HG22  ILE  54          HG22      ILE  54  77.933   3.527 -14.712
  426   HG23  ILE  54          HG23      ILE  54  78.587   1.932 -15.083
  427   HD11  ILE  54          HD11      ILE  54  81.357   5.897 -15.993
  428   HD12  ILE  54          HD12      ILE  54  80.570   4.420 -16.551
  429   HD13  ILE  54          HD13      ILE  54  82.122   4.332 -15.716
  430    HA   PRO  55           HA       PRO  55  78.748  -0.720 -11.347
  431    HB2  PRO  55           HB2      PRO  55  77.032  -0.565  -9.272
  432    HB3  PRO  55           HB1      PRO  55  78.748  -0.148  -9.097
  433    HG2  PRO  55           HG2      PRO  55  76.389   1.637  -9.323
  434    HG3  PRO  55           HG1      PRO  55  77.869   1.832  -8.371
  435    HD2  PRO  55           HD2      PRO  55  77.350   3.050 -10.850
  436    HD3  PRO  55           HD1      PRO  55  78.945   2.907 -10.080
  437    H    GLY  56           HN       GLY  56  75.624   0.236 -10.207
  438    HA2  GLY  56           HA2      GLY  56  74.286  -1.439 -12.145
  439    HA3  GLY  56           HA1      GLY  56  73.490  -0.408 -10.958
  440    H    MET  57           HN       MET  57  75.481   1.703 -12.378
  441    HA   MET  57           HA       MET  57  75.052   3.467 -13.878
  442    HB2  MET  57           HB2      MET  57  75.662   1.568 -15.422
  443    HB3  MET  57           HB1      MET  57  73.940   1.224 -15.592
  444    HG2  MET  57           HG2      MET  57  73.667   3.671 -16.290
  445    HG3  MET  57           HG1      MET  57  75.425   3.723 -16.426
  446    HE1  MET  57           HE1      MET  57  76.802   1.961 -17.793
  447    HE2  MET  57           HE2      MET  57  76.477   3.509 -18.570
  448    HE3  MET  57           HE3      MET  57  76.371   2.020 -19.507
  449    H    GLU  58           HN       GLU  58  73.258   3.970 -12.191
  450    HA   GLU  58           HA       GLU  58  70.739   4.334 -13.693
  451    HB2  GLU  58           HB2      GLU  58  70.531   2.155 -12.441
  452    HB3  GLU  58           HB1      GLU  58  70.753   3.054 -10.941
  453    HG2  GLU  58           HG2      GLU  58  68.360   2.743 -11.368
  454    HG3  GLU  58           HG1      GLU  58  68.773   4.452 -11.517
  455    H    GLY  59           HN       GLY  59  73.021   5.269 -11.333
  456    HA2  GLY  59           HA2      GLY  59  73.169   7.660 -10.753
  457    HA3  GLY  59           HA1      GLY  59  71.405   7.716 -10.753
  458    H1U  RCY  60           H1U      RCY  60  67.864   6.774  -1.409
  459    H1S  RCY  60           H1S      RCY  60  71.043   6.733  -3.911
  460    HB1  RCY  60           HB1      RCY  60  70.018   5.911  -5.602
  461    HB2  RCY  60           HB2      RCY  60  69.697   6.759  -7.113
  462    HA   RCY  60           HA       RCY  60  72.393   5.515  -6.767
  463    HN1  RCY  60           HN1      RCY  60  70.891   5.355  -9.277
  464    H    GLY  61           HN       GLY  61  70.200   3.994  -8.916
  465    HA2  GLY  61           HA2      GLY  61  68.899   2.059  -7.381
  466    HA3  GLY  61           HA1      GLY  61  69.533   1.731  -8.996
  467    H    THR  62           HN       THR  62  72.195   1.771  -8.758
  468    HA   THR  62           HA       THR  62  73.971   0.368  -8.126
  469    HB   THR  62           HB       THR  62  73.999   0.150  -5.471
  470    HG1  THR  62           HG1      THR  62  72.422   1.154  -4.552
  471   HG21  THR  62          HG21      THR  62  74.387   2.638  -7.137
  472   HG22  THR  62          HG22      THR  62  75.613   1.505  -6.566
  473   HG23  THR  62          HG23      THR  62  74.810   2.585  -5.426
  474    H    ASP  63           HN       ASP  63  72.854  -1.487  -9.170
  475    HA   ASP  63           HA       ASP  63  71.172  -3.273  -7.673
  476    HB2  ASP  63           HB2      ASP  63  72.957  -3.781 -10.073
  477    HB3  ASP  63           HB1      ASP  63  71.779  -4.934  -9.445
  478    H    ILE  64           HN       ILE  64  74.681  -3.237  -8.315
  479    HA   ILE  64           HA       ILE  64  75.000  -5.224  -6.091
  480    HB   ILE  64           HB       ILE  64  76.949  -4.778  -8.363
  481   HG12  ILE  64          HG12      ILE  64  74.834  -6.940  -8.093
  482   HG13  ILE  64          HG11      ILE  64  74.751  -5.586  -9.221
  483   HG21  ILE  64          HG21      ILE  64  76.596  -7.157  -6.526
  484   HG22  ILE  64          HG22      ILE  64  77.685  -5.820  -6.155
  485   HG23  ILE  64          HG23      ILE  64  77.959  -6.808  -7.590
  486   HD11  ILE  64          HD11      ILE  64  75.643  -7.394 -10.487
  487   HD12  ILE  64          HD12      ILE  64  76.742  -7.860  -9.188
  488   HD13  ILE  64          HD13      ILE  64  77.028  -6.375 -10.097
  489    H    THR  65           HN       THR  65  77.160  -3.016  -7.849
  490    HA   THR  65           HA       THR  65  78.425  -1.209  -7.066
  491    HB   THR  65           HB       THR  65  77.455  -1.506  -4.256
  492    HG1  THR  65           HG1      THR  65  75.851  -0.399  -6.307
  493   HG21  THR  65          HG21      THR  65  77.819   0.832  -6.152
  494   HG22  THR  65          HG22      THR  65  78.950   0.332  -4.894
  495   HG23  THR  65          HG23      THR  65  77.363   0.963  -4.453
  496    H    VAL  66           HN       VAL  66  79.856  -3.256  -7.418
  497    HA   VAL  66           HA       VAL  66  81.839  -4.293  -6.775
  498    HB   VAL  66           HB       VAL  66  81.632  -2.780  -4.165
  499   HG11  VAL  66          HG11      VAL  66  83.725  -4.278  -5.660
  500   HG12  VAL  66          HG12      VAL  66  83.496  -4.099  -3.921
  501   HG13  VAL  66          HG13      VAL  66  84.240  -2.798  -4.851
  502   HG21  VAL  66          HG21      VAL  66  82.409  -1.859  -6.928
  503   HG22  VAL  66          HG22      VAL  66  83.134  -1.117  -5.502
  504   HG23  VAL  66          HG23      VAL  66  81.388  -1.047  -5.741
  505    H    ILE  67           HN       ILE  67  80.291  -3.991  -3.563
  506    HA   ILE  67           HA       ILE  67  79.966  -6.957  -3.604
  507    HB   ILE  67           HB       ILE  67  81.381  -5.294  -1.512
  508   HG12  ILE  67          HG12      ILE  67  82.705  -6.161  -3.431
  509   HG13  ILE  67          HG11      ILE  67  83.186  -6.913  -1.910
  510   HG21  ILE  67          HG21      ILE  67  79.788  -7.739  -1.220
  511   HG22  ILE  67          HG22      ILE  67  80.427  -6.661   0.022
  512   HG23  ILE  67          HG23      ILE  67  81.448  -7.929  -0.657
  513   HD11  ILE  67          HD11      ILE  67  81.248  -8.638  -2.669
  514   HD12  ILE  67          HD12      ILE  67  82.940  -8.839  -3.126
  515   HD13  ILE  67          HD13      ILE  67  81.803  -8.102  -4.255
  516    H1U  RCY  68           H1U      RCY  68  70.140  -2.835  -6.576
  517    H1S  RCY  68           H1S      RCY  68  73.568  -4.038  -4.117
  518    HB1  RCY  68           HB1      RCY  68  75.069  -7.504  -3.456
  519    HB2  RCY  68           HB2      RCY  68  75.634  -5.953  -4.064
  520    HA   RCY  68           HA       RCY  68  76.276  -5.521  -1.546
  521    HN1  RCY  68           HN1      RCY  68  77.837  -7.183  -3.472
  522    HA   PRO  69           HA       PRO  69  76.046  -8.499   1.717
  523    HB2  PRO  69           HB2      PRO  69  73.119  -8.434   1.021
  524    HB3  PRO  69           HB1      PRO  69  73.886  -8.481   2.623
  525    HG2  PRO  69           HG2      PRO  69  73.028  -6.192   1.541
  526    HG3  PRO  69           HG1      PRO  69  74.494  -6.259   2.532
  527    HD2  PRO  69           HD2      PRO  69  74.246  -5.777  -0.365
  528    HD3  PRO  69           HD1      PRO  69  75.633  -5.481   0.707
  529    H    TRP  70           HN       TRP  70  74.039  -9.376  -1.175
  530    HA   TRP  70           HA       TRP  70  74.019 -12.161  -0.497
  531    HD1  TRP  70           HD1      TRP  70  75.872 -10.484  -3.506
  532    HE1  TRP  70           HE1      TRP  70  75.535  -8.491  -5.104
  533    HE3  TRP  70           HE3      TRP  70  70.775 -10.178  -3.469
  534    HZ2  TRP  70           HZ2      TRP  70  73.384  -6.965  -6.222
  535    HZ3  TRP  70           HZ3      TRP  70  69.610  -8.450  -4.805
  536    HH2  TRP  70           HH2      TRP  70  70.904  -6.845  -6.180
  537    HB2  TRP  70           HB2      TRP  70  73.584 -12.523  -2.987
  538    HB3  TRP  70           HB1      TRP  70  72.421 -11.532  -2.120
  539    H    GLU  71           HN       GLU  71  76.611 -10.341  -0.938
  540    HA   GLU  71           HA       GLU  71  78.337 -12.634  -1.501
  541    HB2  GLU  71           HB2      GLU  71  78.095 -10.307  -3.420
  542    HB3  GLU  71           HB1      GLU  71  79.599 -11.213  -3.276
  543    HG2  GLU  71           HG2      GLU  71  78.173 -13.322  -3.632
  544    HG3  GLU  71           HG1      GLU  71  76.889 -12.229  -4.148
  545    H    ALA  72           HN       ALA  72  78.338 -11.617   0.847
  546    HA   ALA  72           HA       ALA  72  79.563  -9.149   1.417
  547    HB1  ALA  72           HB1      ALA  72  80.270 -10.256   3.577
  548    HB2  ALA  72           HB2      ALA  72  79.660 -11.775   2.920
  549    HB3  ALA  72           HB3      ALA  72  78.557 -10.426   3.193
  550    H1U  RCY  73           H1U      RCY  73  79.600  -4.458   1.437
  551    H1S  RCY  73           H1S      RCY  73  82.059  -7.831   2.289
  552    HB1  RCY  73           HB1      RCY  73  83.470  -7.318   0.359
  553    HB2  RCY  73           HB2      RCY  73  85.093  -7.992   0.495
  554    HA   RCY  73           HA       RCY  73  83.674  -9.852   0.018
  555    HN1  RCY  73           HN1      RCY  73  81.664  -8.446   1.542
  556    H    ASN  74           HN       ASN  74  83.174  -9.271   3.494
  557    HA   ASN  74           HA       ASN  74  84.409 -11.768   4.230
  558    HB2  ASN  74           HB2      ASN  74  86.083  -9.285   4.227
  559    HB3  ASN  74           HB1      ASN  74  86.277 -10.404   5.576
  560   HD21  ASN  74          HD21      ASN  74  87.574  -9.731   2.603
  561   HD22  ASN  74          HD22      ASN  74  88.112 -11.281   2.166
  562    H    HIS  75           HN       HIS  75  82.168 -11.446   5.203
  563    HA   HIS  75           HA       HIS  75  80.860 -11.116   7.121
  564    HD1  HIS  75           HD1      HIS  75  82.371  -9.752  10.829
  565    HD2  HIS  75           HD2      HIS  75  80.391 -12.965   9.052
  566    HE1  HIS  75           HE1      HIS  75  80.627 -10.528  12.495
  567    HE2  HIS  75           HE2      HIS  75  79.415 -12.483  11.425
  568    HB2  HIS  75           HB2      HIS  75  83.123 -11.986   8.112
  569    HB3  HIS  75           HB1      HIS  75  83.354 -10.312   8.612
  570    H1U  RCY  76           H1U      RCY  76  79.489  -4.225   2.274
  571    H1S  RCY  76           H1S      RCY  76  79.201  -4.643   6.726
  572    HB1  RCY  76           HB1      RCY  76  79.841  -5.857   9.323
  573    HB2  RCY  76           HB2      RCY  76  79.575  -7.593   9.489
  574    HA   RCY  76           HA       RCY  76  81.777  -6.545   7.717
  575    HN1  RCY  76           HN1      RCY  76  81.958  -9.083   9.197
  576    H    GLU  77           HN       GLU  77  83.794  -7.754   9.355
  577    HA   GLU  77           HA       GLU  77  83.700  -6.665  12.036
  578    HB2  GLU  77           HB2      GLU  77  85.133  -8.616  11.266
  579    HB3  GLU  77           HB1      GLU  77  86.177  -7.434  10.474
  580    HG2  GLU  77           HG2      GLU  77  86.389  -6.263  12.703
  581    HG3  GLU  77           HG1      GLU  77  85.550  -7.633  13.430
  582    H    LEU  78           HN       LEU  78  84.007  -4.568  12.581
  583    HA   LEU  78           HA       LEU  78  85.984  -2.926  11.183
  584    HG   LEU  78           HG       LEU  78  85.461  -2.190   9.055
  585    HB2  LEU  78           HB2      LEU  78  83.358  -2.905  10.201
  586    HB3  LEU  78           HB1      LEU  78  83.451  -1.462  11.207
  587   HD11  LEU  78          HD11      LEU  78  84.421  -0.511   7.686
  588   HD12  LEU  78          HD12      LEU  78  83.373   0.003   9.007
  589   HD13  LEU  78          HD13      LEU  78  83.130  -1.572   8.251
  590   HD21  LEU  78          HD21      LEU  78  86.601  -0.821  10.580
  591   HD22  LEU  78          HD22      LEU  78  85.147   0.084  11.001
  592   HD23  LEU  78          HD23      LEU  78  85.938   0.360   9.449
  593    H    HIS  79           HN       HIS  79  83.033  -2.271  13.099
  594    HA   HIS  79           HA       HIS  79  84.784  -0.985  15.164
  595    HD1  HIS  79           HD1      HIS  79  83.962   1.588  16.724
  596    HD2  HIS  79           HD2      HIS  79  83.910   1.608  12.553
  597    HE1  HIS  79           HE1      HIS  79  85.261   3.639  16.002
  598    HE2  HIS  79           HE2      HIS  79  85.236   3.663  13.465
  599    HB2  HIS  79           HB2      HIS  79  82.218  -0.216  13.915
  600    HB3  HIS  79           HB1      HIS  79  82.229  -0.067  15.670
  601    H    GLU  80           HN       GLU  80  84.150  -3.836  14.989
  602    HA   GLU  80           HA       GLU  80  83.572  -5.555  16.471
  603    HB2  GLU  80           HB2      GLU  80  82.841  -3.442  18.502
  604    HB3  GLU  80           HB1      GLU  80  83.419  -5.082  18.786
  605    HG2  GLU  80           HG2      GLU  80  85.556  -4.328  17.527
  606    HG3  GLU  80           HG1      GLU  80  84.974  -2.687  17.813
  607    H    LEU  81           HN       LEU  81  81.341  -2.778  16.435
  608    HA   LEU  81           HA       LEU  81  79.056  -4.647  16.795
  609    HG   LEU  81           HG       LEU  81  78.262  -1.970  19.090
  610    HB2  LEU  81           HB2      LEU  81  79.390  -1.658  16.952
  611    HB3  LEU  81           HB1      LEU  81  77.790  -2.336  16.656
  612   HD11  LEU  81          HD11      LEU  81  77.078  -3.849  19.676
  613   HD12  LEU  81          HD12      LEU  81  78.155  -4.930  18.794
  614   HD13  LEU  81          HD13      LEU  81  76.931  -4.004  17.926
  615   HD21  LEU  81          HD21      LEU  81  80.233  -4.248  18.782
  616   HD22  LEU  81          HD22      LEU  81  79.934  -3.266  20.215
  617   HD23  LEU  81          HD23      LEU  81  80.734  -2.558  18.812
  618    H    ALA  82           HN       ALA  82  80.914  -3.342  14.347
  619    HA   ALA  82           HA       ALA  82  79.039  -2.593  12.365
  620    HB1  ALA  82           HB1      ALA  82  80.836  -3.407  10.745
  621    HB2  ALA  82           HB2      ALA  82  81.756  -3.906  12.166
  622    HB3  ALA  82           HB3      ALA  82  81.355  -2.204  11.927
  623    H    GLN  83           HN       GLN  83  79.606  -5.663  13.783
  624    HA   GLN  83           HA       GLN  83  79.088  -7.520  11.774
  625    HB2  GLN  83           HB2      GLN  83  77.698  -8.723  13.638
  626    HB3  GLN  83           HB1      GLN  83  79.419  -8.444  13.910
  627    HG2  GLN  83           HG2      GLN  83  78.958  -6.483  15.247
  628    HG3  GLN  83           HG1      GLN  83  77.242  -6.553  14.843
  629   HE21  GLN  83          HE21      GLN  83  77.146  -6.643  17.369
  630   HE22  GLN  83          HE22      GLN  83  77.211  -8.186  18.074
  631    H    TYR  84           HN       TYR  84  77.030  -5.021  12.938
  632    HA   TYR  84           HA       TYR  84  74.921  -5.896  11.035
  633    HD1  TYR  84           HD1      TYR  84  73.723  -7.853  11.485
  634    HD2  TYR  84           HD2      TYR  84  74.871  -6.659  15.448
  635    HE1  TYR  84           HE1      TYR  84  73.947 -10.235  12.138
  636    HE2  TYR  84           HE2      TYR  84  75.096  -9.041  16.101
  637    HH   TYR  84           HH       TYR  84  74.045 -11.629  13.996
  638    HB2  TYR  84           HB2      TYR  84  74.338  -5.022  13.884
  639    HB3  TYR  84           HB1      TYR  84  73.146  -5.470  12.665
  640    H    GLY  85           HN       GLY  85  76.288  -3.380  13.119
  641    HA2  GLY  85           HA2      GLY  85  76.176  -1.034  12.963
  642    HA3  GLY  85           HA1      GLY  85  76.360  -1.338  11.235
  643    H    ILE  86           HN       ILE  86  73.584  -2.571  12.951
  644    HA   ILE  86           HA       ILE  86  71.315  -2.269  12.296
  645    HB   ILE  86           HB       ILE  86  70.505  -0.040  13.096
  646   HG12  ILE  86          HG12      ILE  86  73.431   0.507  13.665
  647   HG13  ILE  86          HG11      ILE  86  72.582   1.171  12.268
  648   HG21  ILE  86          HG21      ILE  86  72.538  -1.476  14.830
  649   HG22  ILE  86          HG22      ILE  86  70.815  -1.834  14.713
  650   HG23  ILE  86          HG23      ILE  86  71.353  -0.319  15.436
  651   HD11  ILE  86          HD11      ILE  86  71.721   1.558  15.150
  652   HD12  ILE  86          HD12      ILE  86  70.975   2.289  13.729
  653   HD13  ILE  86          HD13      ILE  86  72.611   2.748  14.201
  654    H1U  RCY  87           H1U      RCY  87  75.748   1.506   1.651
  655    H1S  RCY  87           H1S      RCY  87  74.355   0.841   5.603
  656    HB1  RCY  87           HB1      RCY  87  73.366  -2.458   7.704
  657    HB2  RCY  87           HB2      RCY  87  74.347  -1.004   7.852
  658    HA   RCY  87           HA       RCY  87  72.425   0.312   8.485
  659    HN1  RCY  87           HN1      RCY  87  73.030  -2.058  10.021
  Start of MODEL   62
    1    HA   MET   1           HA       MET   1  75.897 -13.570  25.330
    2    HB2  MET   1           HB2      MET   1  74.609 -15.815  25.438
    3    HB3  MET   1           HB1      MET   1  76.332 -15.844  25.813
    4    HG2  MET   1           HG2      MET   1  74.280 -15.460  27.989
    5    HG3  MET   1           HG1      MET   1  74.725 -17.074  27.435
    6    HE1  MET   1           HE1      MET   1  76.483 -16.204  30.933
    7    HE2  MET   1           HE2      MET   1  75.217 -17.156  30.162
    8    HE3  MET   1           HE3      MET   1  75.032 -15.410  30.308
    9    H    ASN   2           HN       ASN   2  73.819 -13.508  24.226
   10    HA   ASN   2           HA       ASN   2  71.306 -13.422  25.585
   11    HB2  ASN   2           HB2      ASN   2  70.977 -10.878  25.259
   12    HB3  ASN   2           HB1      ASN   2  71.938 -11.398  26.644
   13   HD21  ASN   2          HD21      ASN   2  74.173 -10.828  26.683
   14   HD22  ASN   2          HD22      ASN   2  74.918  -9.908  25.467
   15    H    LEU   3           HN       LEU   3  73.267 -12.270  22.876
   16    HA   LEU   3           HA       LEU   3  70.927 -12.070  21.109
   17    HG   LEU   3           HG       LEU   3  71.691 -12.023  18.698
   18    HB2  LEU   3           HB2      LEU   3  73.056 -10.623  20.975
   19    HB3  LEU   3           HB1      LEU   3  73.827 -12.038  20.259
   20   HD11  LEU   3          HD11      LEU   3  71.920  -9.141  19.620
   21   HD12  LEU   3          HD12      LEU   3  70.536 -10.207  19.864
   22   HD13  LEU   3          HD13      LEU   3  70.969  -9.683  18.236
   23   HD21  LEU   3          HD21      LEU   3  74.097 -10.196  18.513
   24   HD22  LEU   3          HD22      LEU   3  72.958 -10.394  17.181
   25   HD23  LEU   3          HD23      LEU   3  73.879 -11.779  17.767
   26    H    GLU   4           HN       GLU   4  70.174 -14.292  21.255
   27    HA   GLU   4           HA       GLU   4  71.896 -16.498  20.504
   28    HB2  GLU   4           HB2      GLU   4  69.576 -17.655  20.209
   29    HB3  GLU   4           HB1      GLU   4  70.054 -17.136  21.826
   30    HG2  GLU   4           HG2      GLU   4  68.683 -15.194  21.723
   31    HG3  GLU   4           HG1      GLU   4  68.456 -15.354  19.981
   32    HA   PRO   5           HA       PRO   5  72.152 -16.491  16.103
   33    HB2  PRO   5           HB2      PRO   5  70.485 -18.984  16.281
   34    HB3  PRO   5           HB1      PRO   5  71.947 -18.676  15.321
   35    HG2  PRO   5           HG2      PRO   5  71.999 -20.029  17.646
   36    HG3  PRO   5           HG1      PRO   5  73.345 -19.022  17.093
   37    HD2  PRO   5           HD2      PRO   5  71.522 -18.574  19.351
   38    HD3  PRO   5           HD1      PRO   5  73.060 -17.766  18.977
   39    HA   PRO   6           HA       PRO   6  67.877 -14.928  15.504
   40    HB2  PRO   6           HB2      PRO   6  68.519 -12.549  14.406
   41    HB3  PRO   6           HB1      PRO   6  68.653 -12.834  16.152
   42    HG2  PRO   6           HG2      PRO   6  70.781 -12.720  14.093
   43    HG3  PRO   6           HG1      PRO   6  70.817 -12.211  15.788
   44    HD2  PRO   6           HD2      PRO   6  71.844 -14.633  14.770
   45    HD3  PRO   6           HD1      PRO   6  71.557 -14.258  16.483
   46    H    LYS   7           HN       LYS   7  66.607 -14.759  13.571
   47    HA   LYS   7           HA       LYS   7  67.880 -15.932  11.187
   48    HB2  LYS   7           HB2      LYS   7  65.414 -15.656  10.329
   49    HB3  LYS   7           HB1      LYS   7  65.768 -16.878  11.552
   50    HG2  LYS   7           HG2      LYS   7  64.884 -15.561  13.299
   51    HG3  LYS   7           HG1      LYS   7  64.967 -14.080  12.344
   52    HD2  LYS   7           HD2      LYS   7  62.638 -14.986  12.566
   53    HD3  LYS   7           HD1      LYS   7  63.179 -14.851  10.892
   54    HE2  LYS   7           HE2      LYS   7  62.027 -17.056  11.592
   55    HE3  LYS   7           HE1      LYS   7  63.543 -17.180  10.699
   56    HZ1  LYS   7           HZ1      LYS   7  64.625 -17.984  12.476
   57    HZ2  LYS   7           HZ2      LYS   7  63.073 -18.417  13.014
   58    HZ3  LYS   7           HZ3      LYS   7  63.804 -16.991  13.579
   59    H    ALA   8           HN       ALA   8  68.931 -14.532   9.851
   60    HA   ALA   8           HA       ALA   8  67.519 -12.334   8.618
   61    HB1  ALA   8           HB1      ALA   8  69.186 -10.575   9.460
   62    HB2  ALA   8           HB2      ALA   8  69.590 -11.724  10.736
   63    HB3  ALA   8           HB3      ALA   8  67.949 -11.091  10.607
   64    H    GLU   9           HN       GLU   9  69.535 -14.737   8.343
   65    HA   GLU   9           HA       GLU   9  71.795 -13.503   6.961
   66    HB2  GLU   9           HB2      GLU   9  71.777 -15.782   8.167
   67    HB3  GLU   9           HB1      GLU   9  70.945 -16.395   6.738
   68    HG2  GLU   9           HG2      GLU   9  73.266 -16.790   6.347
   69    HG3  GLU   9           HG1      GLU   9  72.852 -15.384   5.366
   70    H1U  RCY  10           H1U      RCY  10  65.747 -12.025   3.438
   71    H1S  RCY  10           H1S      RCY  10  67.942 -14.351   0.862
   72    HB1  RCY  10           HB1      RCY  10  70.507 -16.695   3.121
   73    HB2  RCY  10           HB2      RCY  10  70.860 -15.082   2.502
   74    HA   RCY  10           HA       RCY  10  68.847 -14.184   3.413
   75    HN1  RCY  10           HN1      RCY  10  69.530 -15.946   5.674
   76    H    ARG  11           HN       ARG  11  68.775 -17.639   4.372
   77    HA   ARG  11           HA       ARG  11  66.419 -18.423   3.132
   78    HE   ARG  11           HE       ARG  11  67.826 -19.175   1.812
   79    HB2  ARG  11           HB2      ARG  11  67.507 -19.142   5.861
   80    HB3  ARG  11           HB1      ARG  11  66.079 -19.924   5.183
   81    HG2  ARG  11           HG2      ARG  11  68.759 -19.793   3.772
   82    HG3  ARG  11           HG1      ARG  11  68.221 -21.169   4.735
   83    HD2  ARG  11           HD2      ARG  11  67.379 -21.910   2.749
   84    HD3  ARG  11           HD1      ARG  11  66.053 -20.809   3.125
   85   HH11  ARG  11          HH21      ARG  11  66.474 -22.288   1.203
   86   HH12  ARG  11          HH22      ARG  11  66.518 -22.117  -0.520
   87   HH21  ARG  11          HH11      ARG  11  67.891 -18.934  -0.434
   88   HH22  ARG  11          HH12      ARG  11  67.321 -20.218  -1.447
   89    H    SER  12           HN       SER  12  66.419 -17.439   6.576
   90    HA   SER  12           HA       SER  12  64.666 -16.506   7.843
   91    HG   SER  12           HG       SER  12  65.429 -14.182   4.806
   92    HB2  SER  12           HB2      SER  12  63.650 -14.462   6.664
   93    HB3  SER  12           HB1      SER  12  65.396 -14.453   6.890
   94    H    ALA  13           HN       ALA  13  62.627 -15.349   5.448
   95    HA   ALA  13           HA       ALA  13  61.171 -17.727   4.749
   96    HB1  ALA  13           HB1      ALA  13  60.585 -17.830   7.098
   97    HB2  ALA  13           HB2      ALA  13  59.166 -17.281   6.206
   98    HB3  ALA  13           HB3      ALA  13  60.144 -16.122   7.107
   99    H    THR  14           HN       THR  14  61.651 -16.122   2.892
  100    HA   THR  14           HA       THR  14  60.887 -14.539   1.343
  101    HB   THR  14           HB       THR  14  58.295 -14.351   1.341
  102    HG1  THR  14           HG1      THR  14  58.099 -15.033   3.530
  103   HG21  THR  14          HG21      THR  14  59.385 -15.778  -0.242
  104   HG22  THR  14          HG22      THR  14  58.124 -16.752   0.514
  105   HG23  THR  14          HG23      THR  14  59.806 -16.950   1.006
  106    H    ARG  15           HN       ARG  15  61.502 -12.474   1.756
  107    HA   ARG  15           HA       ARG  15  60.802 -11.063   4.168
  108    HE   ARG  15           HE       ARG  15  61.936  -8.388   6.549
  109    HB2  ARG  15           HB2      ARG  15  62.831 -10.617   2.710
  110    HB3  ARG  15           HB1      ARG  15  61.743  -9.844   1.559
  111    HG2  ARG  15           HG2      ARG  15  62.380  -8.004   2.823
  112    HG3  ARG  15           HG1      ARG  15  60.942  -8.514   3.709
  113    HD2  ARG  15           HD2      ARG  15  62.656 -10.025   5.026
  114    HD3  ARG  15           HD1      ARG  15  63.833  -8.851   4.438
  115   HH11  ARG  15          HH21      ARG  15  63.429  -6.977   3.781
  116   HH12  ARG  15          HH22      ARG  15  63.300  -5.355   4.372
  117   HH21  ARG  15          HH11      ARG  15  61.758  -6.277   7.338
  118   HH22  ARG  15          HH12      ARG  15  62.354  -4.958   6.387
  119    H    VAL  16           HN       VAL  16  58.375 -11.827   3.485
  120    HA   VAL  16           HA       VAL  16  56.213 -11.113   2.927
  121    HB   VAL  16           HB       VAL  16  57.532  -8.399   3.238
  122   HG11  VAL  16          HG11      VAL  16  54.648  -9.300   3.106
  123   HG12  VAL  16          HG12      VAL  16  55.447  -8.069   2.127
  124   HG13  VAL  16          HG13      VAL  16  55.121  -7.765   3.834
  125   HG21  VAL  16          HG21      VAL  16  56.838  -8.507   5.533
  126   HG22  VAL  16          HG22      VAL  16  57.650 -10.035   5.192
  127   HG23  VAL  16          HG23      VAL  16  55.889  -9.965   5.244
  128    H    MET  17           HN       MET  17  57.992  -8.433   1.394
  129    HA   MET  17           HA       MET  17  58.040  -7.731  -0.840
  130    HB2  MET  17           HB2      MET  17  57.459 -10.608  -1.572
  131    HB3  MET  17           HB1      MET  17  58.344  -9.405  -2.509
  132    HG2  MET  17           HG2      MET  17  59.226 -10.635   0.119
  133    HG3  MET  17           HG1      MET  17  59.930 -10.945  -1.468
  134    HE1  MET  17           HE1      MET  17  62.224 -10.464  -0.691
  135    HE2  MET  17           HE2      MET  17  62.879  -8.881  -1.104
  136    HE3  MET  17           HE3      MET  17  61.944  -9.781  -2.297
  137    H    GLY  18           HN       GLY  18  56.607  -7.513  -2.793
  138    HA2  GLY  18           HA2      GLY  18  54.373  -7.961  -3.786
  139    HA3  GLY  18           HA1      GLY  18  53.751  -8.127  -2.143
  140    H    GLY  19           HN       GLY  19  52.226  -6.414  -3.149
  141    HA2  GLY  19           HA2      GLY  19  51.480  -4.194  -2.774
  142    HA3  GLY  19           HA1      GLY  19  53.080  -3.796  -2.146
  143    HA   PRO  20           HA       PRO  20  52.147  -2.974  -7.017
  144    HB2  PRO  20           HB2      PRO  20  51.520  -0.279  -5.851
  145    HB3  PRO  20           HB1      PRO  20  50.877  -1.049  -7.315
  146    HG2  PRO  20           HG2      PRO  20  49.481  -0.960  -5.037
  147    HG3  PRO  20           HG1      PRO  20  49.385  -2.339  -6.143
  148    HD2  PRO  20           HD2      PRO  20  50.653  -2.177  -3.470
  149    HD3  PRO  20           HD1      PRO  20  50.085  -3.604  -4.364
  150    H1U  RCY  21           H1U      RCY  21  62.569   0.107  -3.653
  151    H1S  RCY  21           H1S      RCY  21  59.002  -0.949  -5.462
  152    HB1  RCY  21           HB1      RCY  21  56.598  -3.434  -6.979
  153    HB2  RCY  21           HB2      RCY  21  56.876  -2.313  -5.646
  154    HA   RCY  21           HA       RCY  21  55.879  -0.513  -6.787
  155    HN1  RCY  21           HN1      RCY  21  54.188  -2.740  -7.823
  156    H    THR  22           HN       THR  22  55.620   0.693  -8.681
  157    HA   THR  22           HA       THR  22  56.549  -0.607 -11.217
  158    HB   THR  22           HB       THR  22  54.206   0.145 -11.322
  159    HG1  THR  22           HG1      THR  22  56.240   1.203 -12.825
  160   HG21  THR  22          HG21      THR  22  54.964   3.006 -11.121
  161   HG22  THR  22          HG22      THR  22  54.941   2.105  -9.605
  162   HG23  THR  22          HG23      THR  22  53.488   2.191 -10.602
  163    HA   PRO  23           HA       PRO  23  59.705   2.587 -10.356
  164    HB2  PRO  23           HB2      PRO  23  61.857   1.178 -11.171
  165    HB3  PRO  23           HB1      PRO  23  61.081   0.871  -9.605
  166    HG2  PRO  23           HG2      PRO  23  60.912  -0.679 -12.127
  167    HG3  PRO  23           HG1      PRO  23  60.906  -1.243 -10.449
  168    HD2  PRO  23           HD2      PRO  23  58.634  -0.920 -12.077
  169    HD3  PRO  23           HD1      PRO  23  58.628  -1.114 -10.311
  170    H    ARG  24           HN       ARG  24  61.475   3.515 -11.884
  171    HA   ARG  24           HA       ARG  24  60.287   4.277 -14.364
  172    HE   ARG  24           HE       ARG  24  60.883   7.694 -16.657
  173    HB2  ARG  24           HB2      ARG  24  62.062   5.559 -13.133
  174    HB3  ARG  24           HB1      ARG  24  63.231   4.346 -13.640
  175    HG2  ARG  24           HG2      ARG  24  63.483   5.423 -15.603
  176    HG3  ARG  24           HG1      ARG  24  61.778   5.143 -15.960
  177    HD2  ARG  24           HD2      ARG  24  62.127   7.283 -14.015
  178    HD3  ARG  24           HD1      ARG  24  62.982   7.625 -15.519
  179   HH11  ARG  24          HH21      ARG  24  60.658   6.647 -13.380
  180   HH12  ARG  24          HH22      ARG  24  58.933   6.792 -13.312
  181   HH21  ARG  24          HH11      ARG  24  58.632   7.890 -16.588
  182   HH22  ARG  24          HH12      ARG  24  57.786   7.496 -15.129
  183    H    LYS  25           HN       LYS  25  63.386   3.500 -15.260
  184    HA   LYS  25           HA       LYS  25  62.483   0.965 -16.585
  185    HB2  LYS  25           HB2      LYS  25  63.839   3.387 -17.617
  186    HB3  LYS  25           HB1      LYS  25  64.557   1.866 -18.145
  187    HG2  LYS  25           HG2      LYS  25  62.789   2.618 -19.708
  188    HG3  LYS  25           HG1      LYS  25  62.360   1.089 -18.939
  189    HD2  LYS  25           HD2      LYS  25  60.743   2.070 -17.578
  190    HD3  LYS  25           HD1      LYS  25  61.491   3.665 -17.666
  191    HE2  LYS  25           HE2      LYS  25  60.398   2.402 -20.163
  192    HE3  LYS  25           HE1      LYS  25  59.299   3.194 -19.034
  193    HZ1  LYS  25           HZ1      LYS  25  59.888   5.104 -19.956
  194    HZ2  LYS  25           HZ2      LYS  25  61.091   4.358 -20.894
  195    HZ3  LYS  25           HZ3      LYS  25  61.448   4.896 -19.323
  196    H    GLY  26           HN       GLY  26  63.338  -0.315 -14.852
  197    HA2  GLY  26           HA2      GLY  26  65.015  -1.570 -13.798
  198    HA3  GLY  26           HA1      GLY  26  66.040  -1.159 -15.174
  199    HA   PRO  27           HA       PRO  27  67.048   1.044 -10.893
  200    HB2  PRO  27           HB2      PRO  27  69.511  -0.592 -11.369
  201    HB3  PRO  27           HB1      PRO  27  68.722  -0.163  -9.838
  202    HG2  PRO  27           HG2      PRO  27  68.476  -2.593 -10.931
  203    HG3  PRO  27           HG1      PRO  27  67.168  -1.832 -10.014
  204    HD2  PRO  27           HD2      PRO  27  67.370  -2.309 -12.935
  205    HD3  PRO  27           HD1      PRO  27  65.925  -2.088 -11.925
  206    HA   PRO  28           HA       PRO  28  69.200   4.301 -13.006
  207    HB2  PRO  28           HB2      PRO  28  71.249   4.102 -10.827
  208    HB3  PRO  28           HB1      PRO  28  70.397   5.531 -11.445
  209    HG2  PRO  28           HG2      PRO  28  69.720   4.364  -9.135
  210    HG3  PRO  28           HG1      PRO  28  68.523   5.123 -10.197
  211    HD2  PRO  28           HD2      PRO  28  68.976   2.244  -9.650
  212    HD3  PRO  28           HD1      PRO  28  67.513   3.065 -10.235
  213    H    LYS  29           HN       LYS  29  70.568   4.140 -14.751
  214    HA   LYS  29           HA       LYS  29  72.098   1.861 -15.350
  215    HB2  LYS  29           HB2      LYS  29  73.461   3.919 -16.655
  216    HB3  LYS  29           HB1      LYS  29  72.078   3.033 -17.292
  217    HG2  LYS  29           HG2      LYS  29  71.667   5.391 -15.462
  218    HG3  LYS  29           HG1      LYS  29  71.934   5.631 -17.189
  219    HD2  LYS  29           HD2      LYS  29  69.898   3.612 -16.323
  220    HD3  LYS  29           HD1      LYS  29  69.478   5.324 -16.240
  221    HE2  LYS  29           HE2      LYS  29  69.736   5.628 -18.559
  222    HE3  LYS  29           HE1      LYS  29  70.708   4.167 -18.735
  223    HZ1  LYS  29           HZ1      LYS  29  67.832   4.219 -17.998
  224    HZ2  LYS  29           HZ2      LYS  29  68.779   2.833 -18.260
  225    HZ3  LYS  29           HZ3      LYS  29  68.430   3.883 -19.549
  226    H1U  RCY  30           H1U      RCY  30  77.680   5.636  -9.951
  227    H1S  RCY  30           H1S      RCY  30  75.982   1.737 -11.846
  228    HB1  RCY  30           HB1      RCY  30  77.773   1.771 -14.917
  229    HB2  RCY  30           HB2      RCY  30  76.354   0.788 -15.274
  230    HA   RCY  30           HA       RCY  30  75.751   2.445 -13.015
  231    HN1  RCY  30           HN1      RCY  30  74.599   1.936 -15.655
  232    H    LYS  31           HN       LYS  31  77.020   3.315 -16.230
  233    HA   LYS  31           HA       LYS  31  78.218   5.217 -16.910
  234    HB2  LYS  31           HB2      LYS  31  76.003   6.256 -15.175
  235    HB3  LYS  31           HB1      LYS  31  77.251   7.382 -15.708
  236    HG2  LYS  31           HG2      LYS  31  76.728   7.091 -17.975
  237    HG3  LYS  31           HG1      LYS  31  75.932   5.543 -17.692
  238    HD2  LYS  31           HD2      LYS  31  74.117   6.714 -16.474
  239    HD3  LYS  31           HD1      LYS  31  74.900   8.258 -16.816
  240    HE2  LYS  31           HE2      LYS  31  73.592   6.346 -18.744
  241    HE3  LYS  31           HE1      LYS  31  73.303   8.073 -18.538
  242    HZ1  LYS  31           HZ1      LYS  31  75.782   6.838 -19.610
  243    HZ2  LYS  31           HZ2      LYS  31  75.530   8.503 -19.385
  244    HZ3  LYS  31           HZ3      LYS  31  74.600   7.645 -20.520
  245    H    GLN  32           HN       GLN  32  80.264   4.762 -16.055
  246    HA   GLN  32           HA       GLN  32  81.123   6.473 -13.858
  247    HB2  GLN  32           HB2      GLN  32  82.125   4.350 -12.662
  248    HB3  GLN  32           HB1      GLN  32  80.450   4.803 -12.369
  249    HG2  GLN  32           HG2      GLN  32  80.775   2.355 -12.880
  250    HG3  GLN  32           HG1      GLN  32  79.655   3.175 -13.969
  251   HE21  GLN  32          HE21      GLN  32  82.942   1.831 -13.733
  252   HE22  GLN  32          HE22      GLN  32  83.230   1.800 -15.405
  253    H    ARG  33           HN       ARG  33  83.228   3.944 -13.789
  254    HA   ARG  33           HA       ARG  33  85.346   3.632 -14.749
  255    HE   ARG  33           HE       ARG  33  83.620   3.658 -18.694
  256    HB2  ARG  33           HB2      ARG  33  83.699   3.043 -16.657
  257    HB3  ARG  33           HB1      ARG  33  84.123   4.616 -17.327
  258    HG2  ARG  33           HG2      ARG  33  86.461   4.008 -17.452
  259    HG3  ARG  33           HG1      ARG  33  86.164   2.504 -16.578
  260    HD2  ARG  33           HD2      ARG  33  86.290   2.583 -19.256
  261    HD3  ARG  33           HD1      ARG  33  85.225   1.464 -18.405
  262   HH11  ARG  33          HH21      ARG  33  85.701   1.910 -20.816
  263   HH12  ARG  33          HH22      ARG  33  84.759   2.245 -22.231
  264   HH21  ARG  33          HH11      ARG  33  82.378   4.105 -20.529
  265   HH22  ARG  33          HH12      ARG  33  82.878   3.487 -22.068
  266    H    GLN  34           HN       GLN  34  84.855   6.186 -13.541
  267    HA   GLN  34           HA       GLN  34  87.042   7.686 -14.694
  268    HB2  GLN  34           HB2      GLN  34  84.927   8.151 -16.178
  269    HB3  GLN  34           HB1      GLN  34  84.420   9.162 -14.826
  270    HG2  GLN  34           HG2      GLN  34  85.619  10.673 -16.163
  271    HG3  GLN  34           HG1      GLN  34  86.831  10.159 -14.989
  272   HE21  GLN  34          HE21      GLN  34  87.193  11.069 -17.863
  273   HE22  GLN  34          HE22      GLN  34  88.033   9.802 -18.618
  274    H    THR  35           HN       THR  35  85.780   6.639 -12.095
  275    HA   THR  35           HA       THR  35  86.401   9.074 -10.521
  276    HB   THR  35           HB       THR  35  84.385   9.071  -9.279
  277    HG1  THR  35           HG1      THR  35  83.391   6.799 -10.567
  278   HG21  THR  35          HG21      THR  35  84.138   9.946 -11.598
  279   HG22  THR  35          HG22      THR  35  82.630   9.291 -10.961
  280   HG23  THR  35          HG23      THR  35  83.582   8.354 -12.113
  281    H    ARG  36           HN       ARG  36  84.828   6.067  -9.469
  282    HA   ARG  36           HA       ARG  36  85.608   4.347  -8.084
  283    HE   ARG  36           HE       ARG  36  87.732   1.642 -10.996
  284    HB2  ARG  36           HB2      ARG  36  87.512   4.528  -9.932
  285    HB3  ARG  36           HB1      ARG  36  88.456   5.145  -8.577
  286    HG2  ARG  36           HG2      ARG  36  88.829   2.813  -8.504
  287    HG3  ARG  36           HG1      ARG  36  87.581   3.076  -7.286
  288    HD2  ARG  36           HD2      ARG  36  86.380   1.509  -8.388
  289    HD3  ARG  36           HD1      ARG  36  86.125   2.739  -9.625
  290   HH11  ARG  36          HH21      ARG  36  87.620   0.420  -7.774
  291   HH12  ARG  36          HH22      ARG  36  88.602  -0.964  -8.123
  292   HH21  ARG  36          HH11      ARG  36  89.016  -0.158 -11.470
  293   HH22  ARG  36          HH12      ARG  36  89.393  -1.290 -10.215
  294    H    GLN  37           HN       GLN  37  85.122   7.045  -7.031
  295    HA   GLN  37           HA       GLN  37  86.336   6.698  -4.420
  296    HB2  GLN  37           HB2      GLN  37  87.496   8.656  -6.358
  297    HB3  GLN  37           HB1      GLN  37  87.296   9.210  -4.701
  298    HG2  GLN  37           HG2      GLN  37  89.191   8.114  -4.155
  299    HG3  GLN  37           HG1      GLN  37  88.375   6.596  -4.528
  300   HE21  GLN  37          HE21      GLN  37  88.058   7.164  -7.405
  301   HE22  GLN  37          HE22      GLN  37  89.605   7.058  -8.094
  302    H1U  RCY  38           H1U      RCY  38  85.253   6.382  -0.152
  303    H1S  RCY  38           H1S      RCY  38  81.716   7.469  -2.125
  304    HB1  RCY  38           HB1      RCY  38  82.546   8.586  -5.452
  305    HB2  RCY  38           HB2      RCY  38  81.630  10.081  -5.613
  306    HA   RCY  38           HA       RCY  38  83.617  11.141  -5.790
  307    HN1  RCY  38           HN1      RCY  38  85.483   9.739  -6.049
  308    H    LYS  39           HN       LYS  39  82.147  11.879  -3.688
  309    HA   LYS  39           HA       LYS  39  83.481  13.450  -2.026
  310    HB2  LYS  39           HB2      LYS  39  80.977  12.487  -1.892
  311    HB3  LYS  39           HB1      LYS  39  81.658  11.641  -0.504
  312    HG2  LYS  39           HG2      LYS  39  80.916  13.655   0.445
  313    HG3  LYS  39           HG1      LYS  39  82.623  13.982   0.140
  314    HD2  LYS  39           HD2      LYS  39  81.744  14.819  -2.197
  315    HD3  LYS  39           HD1      LYS  39  80.210  14.981  -1.340
  316    HE2  LYS  39           HE2      LYS  39  82.804  16.161  -0.318
  317    HE3  LYS  39           HE1      LYS  39  81.667  17.059  -1.324
  318    HZ1  LYS  39           HZ1      LYS  39  81.567  16.654   1.430
  319    HZ2  LYS  39           HZ2      LYS  39  80.260  15.804   0.756
  320    HZ3  LYS  39           HZ3      LYS  39  80.441  17.466   0.455
  321    H    SER  40           HN       SER  40  84.937  13.416  -0.376
  322    HA   SER  40           HA       SER  40  86.331  10.877   0.132
  323    HG   SER  40           HG       SER  40  87.558  14.471  -0.121
  324    HB2  SER  40           HB2      SER  40  87.086  13.353   1.608
  325    HB3  SER  40           HB1      SER  40  88.111  12.176   0.790
  326    H    LYS  41           HN       LYS  41  86.392   9.808   2.107
  327    HA   LYS  41           HA       LYS  41  84.634  10.883   4.281
  328    HB2  LYS  41           HB2      LYS  41  84.995   7.933   4.099
  329    HB3  LYS  41           HB1      LYS  41  83.556   8.863   4.505
  330    HG2  LYS  41           HG2      LYS  41  84.685   8.722   1.701
  331    HG3  LYS  41           HG1      LYS  41  83.439   7.622   2.292
  332    HD2  LYS  41           HD2      LYS  41  83.074  10.592   2.582
  333    HD3  LYS  41           HD1      LYS  41  82.714   9.807   1.044
  334    HE2  LYS  41           HE2      LYS  41  81.273   8.169   2.351
  335    HE3  LYS  41           HE1      LYS  41  81.470   9.233   3.743
  336    HZ1  LYS  41           HZ1      LYS  41  79.500   9.504   2.014
  337    HZ2  LYS  41           HZ2      LYS  41  80.656  10.476   1.237
  338    HZ3  LYS  41           HZ3      LYS  41  80.180  10.827   2.830
  339    HA   PRO  42           HA       PRO  42  88.039  10.003   6.970
  340    HB2  PRO  42           HB2      PRO  42  86.803   8.635   9.103
  341    HB3  PRO  42           HB1      PRO  42  86.895  10.390   8.897
  342    HG2  PRO  42           HG2      PRO  42  84.602   8.723   8.737
  343    HG3  PRO  42           HG1      PRO  42  84.702  10.472   8.507
  344    HD2  PRO  42           HD2      PRO  42  84.468   8.349   6.482
  345    HD3  PRO  42           HD1      PRO  42  84.175  10.094   6.320
  346    HA   PRO  43           HA       PRO  43  89.807   5.985   6.521
  347    HB2  PRO  43           HB2      PRO  43  91.287   5.700   8.823
  348    HB3  PRO  43           HB1      PRO  43  91.756   6.755   7.476
  349    HG2  PRO  43           HG2      PRO  43  90.452   7.456  10.056
  350    HG3  PRO  43           HG1      PRO  43  91.705   8.321   9.150
  351    HD2  PRO  43           HD2      PRO  43  89.078   9.071   9.111
  352    HD3  PRO  43           HD1      PRO  43  90.174   9.338   7.738
  353    H    LYS  44           HN       LYS  44  88.993   3.948   6.778
  354    HA   LYS  44           HA       LYS  44  88.047   3.048   9.429
  355    HB2  LYS  44           HB2      LYS  44  86.258   3.207   6.986
  356    HB3  LYS  44           HB1      LYS  44  85.864   2.289   8.439
  357    HG2  LYS  44           HG2      LYS  44  86.211   4.458   9.741
  358    HG3  LYS  44           HG1      LYS  44  86.227   5.279   8.180
  359    HD2  LYS  44           HD2      LYS  44  83.970   5.419   8.689
  360    HD3  LYS  44           HD1      LYS  44  83.995   3.892   7.806
  361    HE2  LYS  44           HE2      LYS  44  82.732   3.683   9.924
  362    HE3  LYS  44           HE1      LYS  44  84.164   2.654   9.925
  363    HZ1  LYS  44           HZ1      LYS  44  84.305   5.391  11.004
  364    HZ2  LYS  44           HZ2      LYS  44  85.272   4.042  11.369
  365    HZ3  LYS  44           HZ3      LYS  44  83.681   4.134  11.959
  366    H    LYS  45           HN       LYS  45  86.830   0.680   8.631
  367    HA   LYS  45           HA       LYS  45  89.103  -0.943   7.962
  368    HB2  LYS  45           HB2      LYS  45  86.199  -1.768   7.725
  369    HB3  LYS  45           HB1      LYS  45  87.593  -2.805   8.027
  370    HG2  LYS  45           HG2      LYS  45  87.819  -1.019  10.085
  371    HG3  LYS  45           HG1      LYS  45  86.066  -1.112   9.908
  372    HD2  LYS  45           HD2      LYS  45  87.900  -3.512  10.176
  373    HD3  LYS  45           HD1      LYS  45  86.951  -2.821  11.493
  374    HE2  LYS  45           HE2      LYS  45  84.899  -3.160  10.014
  375    HE3  LYS  45           HE1      LYS  45  85.932  -4.131   8.965
  376    HZ1  LYS  45           HZ1      LYS  45  84.647  -4.927  11.297
  377    HZ2  LYS  45           HZ2      LYS  45  86.311  -4.917  11.639
  378    HZ3  LYS  45           HZ3      LYS  45  85.714  -5.833  10.339
  379    H    GLY  46           HN       GLY  46  86.501   0.464   6.052
  380    HA2  GLY  46           HA2      GLY  46  86.955  -1.085   3.670
  381    HA3  GLY  46           HA1      GLY  46  86.140   0.479   3.730
  382    H    VAL  47           HN       VAL  47  87.983  -0.256   1.671
  383    HA   VAL  47           HA       VAL  47  90.643   0.538   1.976
  384    HB   VAL  47           HB       VAL  47  88.791   1.127  -0.353
  385   HG11  VAL  47          HG11      VAL  47  91.805   1.202  -0.072
  386   HG12  VAL  47          HG12      VAL  47  90.740   2.515  -0.575
  387   HG13  VAL  47          HG13      VAL  47  90.986   1.125  -1.632
  388   HG21  VAL  47          HG21      VAL  47  89.118  -1.292   0.422
  389   HG22  VAL  47          HG22      VAL  47  90.809  -1.107  -0.041
  390   HG23  VAL  47          HG23      VAL  47  89.540  -0.956  -1.257
  391    H    GLN  48           HN       GLN  48  91.714   2.601   1.650
  392    HA   GLN  48           HA       GLN  48  90.195   4.834   2.824
  393    HB2  GLN  48           HB2      GLN  48  93.098   4.542   1.999
  394    HB3  GLN  48           HB1      GLN  48  92.425   5.992   2.743
  395    HG2  GLN  48           HG2      GLN  48  91.631   4.509   4.649
  396    HG3  GLN  48           HG1      GLN  48  92.611   3.221   3.946
  397   HE21  GLN  48          HE21      GLN  48  94.665   5.267   3.008
  398   HE22  GLN  48          HE22      GLN  48  95.532   5.677   4.409
  399    H    GLY  49           HN       GLY  49  89.664   3.858   0.014
  400    HA2  GLY  49           HA2      GLY  49  90.699   5.768  -1.857
  401    HA3  GLY  49           HA1      GLY  49  89.238   4.809  -2.093
  402    H1U  RCY  50           H1U      RCY  50  80.520   7.813   1.088
  403    H1S  RCY  50           H1S      RCY  50  84.681   5.319   1.281
  404    HB1  RCY  50           HB1      RCY  50  85.348   8.457  -0.608
  405    HB2  RCY  50           HB2      RCY  50  86.874   8.588   0.266
  406    HA   RCY  50           HA       RCY  50  86.380   8.234  -2.644
  407    HN1  RCY  50           HN1      RCY  50  87.841   6.408  -2.811
  408    H    GLY  51           HN       GLY  51  86.896  10.280  -3.286
  409    HA2  GLY  51           HA2      GLY  51  88.376  12.144  -1.745
  410    HA3  GLY  51           HA1      GLY  51  89.496  11.396  -2.882
  411    H    ASP  52           HN       ASP  52  87.275  11.054  -4.890
  412    HA   ASP  52           HA       ASP  52  87.667  13.560  -6.266
  413    HB2  ASP  52           HB2      ASP  52  85.658  11.362  -6.838
  414    HB3  ASP  52           HB1      ASP  52  86.158  12.628  -7.959
  415    H    ASP  53           HN       ASP  53  84.849  13.661  -7.290
  416    HA   ASP  53           HA       ASP  53  83.525  14.913  -4.912
  417    HB2  ASP  53           HB2      ASP  53  82.723  16.713  -6.395
  418    HB3  ASP  53           HB1      ASP  53  84.486  16.660  -6.373
  419    H    ILE  54           HN       ILE  54  81.604  15.584  -7.447
  420    HA   ILE  54           HA       ILE  54  80.280  12.908  -7.512
  421    HB   ILE  54           HB       ILE  54  78.738  15.479  -7.083
  422   HG12  ILE  54          HG12      ILE  54  78.472  14.187  -4.732
  423   HG13  ILE  54          HG11      ILE  54  80.106  13.671  -5.149
  424   HG21  ILE  54          HG21      ILE  54  77.500  13.609  -8.091
  425   HG22  ILE  54          HG22      ILE  54  76.948  13.886  -6.440
  426   HG23  ILE  54          HG23      ILE  54  78.033  12.541  -6.793
  427   HD11  ILE  54          HD11      ILE  54  80.514  15.669  -4.007
  428   HD12  ILE  54          HD12      ILE  54  79.071  16.449  -4.655
  429   HD13  ILE  54          HD13      ILE  54  80.483  16.211  -5.685
  430    HA   PRO  55           HA       PRO  55  80.239  14.865 -11.677
  431    HB2  PRO  55           HB2      PRO  55  81.727  13.051 -12.999
  432    HB3  PRO  55           HB1      PRO  55  82.476  14.307 -11.993
  433    HG2  PRO  55           HG2      PRO  55  82.101  11.423 -11.437
  434    HG3  PRO  55           HG1      PRO  55  83.400  12.514 -10.934
  435    HD2  PRO  55           HD2      PRO  55  81.185  11.707  -9.361
  436    HD3  PRO  55           HD1      PRO  55  82.337  13.003  -8.974
  437    H    GLY  56           HN       GLY  56  79.946  11.397 -10.903
  438    HA2  GLY  56           HA2      GLY  56  77.522  11.291 -12.646
  439    HA3  GLY  56           HA1      GLY  56  78.737  10.014 -12.736
  440    H    MET  57           HN       MET  57  78.612  11.151  -9.609
  441    HA   MET  57           HA       MET  57  77.688  10.342  -7.618
  442    HB2  MET  57           HB2      MET  57  75.490   9.123  -9.303
  443    HB3  MET  57           HB1      MET  57  75.417   9.595  -7.610
  444    HG2  MET  57           HG2      MET  57  76.204  11.772  -9.439
  445    HG3  MET  57           HG1      MET  57  74.565  11.171  -9.688
  446    HE1  MET  57           HE1      MET  57  72.600  12.166  -8.405
  447    HE2  MET  57           HE2      MET  57  72.597  11.916  -6.661
  448    HE3  MET  57           HE3      MET  57  73.023  10.586  -7.736
  449    H    GLU  58           HN       GLU  58  79.502   8.686  -9.373
  450    HA   GLU  58           HA       GLU  58  78.666   5.956  -8.468
  451    HB2  GLU  58           HB2      GLU  58  80.404   5.158 -10.089
  452    HB3  GLU  58           HB1      GLU  58  79.099   6.060 -10.856
  453    HG2  GLU  58           HG2      GLU  58  81.509   7.577  -9.933
  454    HG3  GLU  58           HG1      GLU  58  81.643   6.614 -11.404
  455    H    GLY  59           HN       GLY  59  81.786   5.590  -9.113
  456    HA2  GLY  59           HA2      GLY  59  83.797   5.724  -7.875
  457    HA3  GLY  59           HA1      GLY  59  82.988   6.805  -6.741
  458    H1U  RCY  60           H1U      RCY  60  77.647   3.855  -9.498
  459    H1S  RCY  60           H1S      RCY  60  81.983   3.181  -7.950
  460    HB1  RCY  60           HB1      RCY  60  81.520   2.317  -5.762
  461    HB2  RCY  60           HB2      RCY  60  82.368   0.939  -5.062
  462    HA   RCY  60           HA       RCY  60  83.368   3.059  -4.297
  463    HN1  RCY  60           HN1      RCY  60  84.487   3.955  -6.784
  464    H    GLY  61           HN       GLY  61  84.087   0.379  -4.337
  465    HA2  GLY  61           HA2      GLY  61  86.592  -0.099  -5.687
  466    HA3  GLY  61           HA1      GLY  61  86.873   0.416  -4.023
  467    H    THR  62           HN       THR  62  85.858  -0.885  -2.303
  468    HA   THR  62           HA       THR  62  84.759  -3.505  -3.019
  469    HB   THR  62           HB       THR  62  86.985  -4.220  -3.263
  470    HG1  THR  62           HG1      THR  62  87.082  -5.626  -1.681
  471   HG21  THR  62          HG21      THR  62  87.574  -2.283  -1.022
  472   HG22  THR  62          HG22      THR  62  88.200  -2.267  -2.671
  473   HG23  THR  62          HG23      THR  62  88.741  -3.502  -1.534
  474    H    ASP  63           HN       ASP  63  84.931  -0.886  -1.038
  475    HA   ASP  63           HA       ASP  63  84.608  -2.096   1.567
  476    HB2  ASP  63           HB2      ASP  63  85.257   0.296   1.188
  477    HB3  ASP  63           HB1      ASP  63  83.617   0.608   0.618
  478    H    ILE  64           HN       ILE  64  82.914  -3.219  -0.585
  479    HA   ILE  64           HA       ILE  64  80.312  -2.998   0.833
  480    HB   ILE  64           HB       ILE  64  80.800  -2.463  -2.104
  481   HG12  ILE  64          HG12      ILE  64  79.028  -1.068  -0.078
  482   HG13  ILE  64          HG11      ILE  64  80.699  -0.597  -0.391
  483   HG21  ILE  64          HG21      ILE  64  78.313  -3.486  -0.729
  484   HG22  ILE  64          HG22      ILE  64  79.075  -4.088  -2.201
  485   HG23  ILE  64          HG23      ILE  64  78.222  -2.544  -2.217
  486   HD11  ILE  64          HD11      ILE  64  78.535   0.396  -1.750
  487   HD12  ILE  64          HD12      ILE  64  79.051  -0.911  -2.817
  488   HD13  ILE  64          HD13      ILE  64  80.181   0.371  -2.382
  489    H    THR  65           HN       THR  65  82.140  -4.594  -1.777
  490    HA   THR  65           HA       THR  65  80.563  -6.976  -1.863
  491    HB   THR  65           HB       THR  65  83.495  -6.542  -2.511
  492    HG1  THR  65           HG1      THR  65  82.761  -5.763  -4.306
  493   HG21  THR  65          HG21      THR  65  83.200  -8.888  -2.265
  494   HG22  THR  65          HG22      THR  65  83.049  -8.586  -3.996
  495   HG23  THR  65          HG23      THR  65  81.605  -8.843  -3.016
  496    H    VAL  66           HN       VAL  66  83.290  -5.997   0.159
  497    HA   VAL  66           HA       VAL  66  83.363  -8.668   1.435
  498    HB   VAL  66           HB       VAL  66  85.008  -6.258   2.214
  499   HG11  VAL  66          HG11      VAL  66  85.734  -9.193   2.230
  500   HG12  VAL  66          HG12      VAL  66  84.911  -8.426   3.589
  501   HG13  VAL  66          HG13      VAL  66  86.514  -7.874   3.103
  502   HG21  VAL  66          HG21      VAL  66  85.465  -8.239  -0.037
  503   HG22  VAL  66          HG22      VAL  66  86.722  -7.184   0.610
  504   HG23  VAL  66          HG23      VAL  66  85.306  -6.488  -0.179
  505    H    ILE  67           HN       ILE  67  83.004  -5.260   2.512
  506    HA   ILE  67           HA       ILE  67  81.192  -6.278   4.663
  507    HB   ILE  67           HB       ILE  67  83.378  -4.214   5.055
  508   HG12  ILE  67          HG12      ILE  67  83.124  -7.027   6.166
  509   HG13  ILE  67          HG11      ILE  67  84.188  -6.575   4.833
  510   HG21  ILE  67          HG21      ILE  67  81.343  -5.442   6.938
  511   HG22  ILE  67          HG22      ILE  67  81.431  -3.752   6.441
  512   HG23  ILE  67          HG23      ILE  67  82.699  -4.440   7.455
  513   HD11  ILE  67          HD11      ILE  67  84.297  -5.490   7.663
  514   HD12  ILE  67          HD12      ILE  67  85.307  -4.926   6.331
  515   HD13  ILE  67          HD13      ILE  67  85.463  -6.582   6.916
  516    H1U  RCY  68           H1U      RCY  68  76.777  -1.268  -2.289
  517    H1S  RCY  68           H1S      RCY  68  75.313  -3.310   0.872
  518    HB1  RCY  68           HB1      RCY  68  77.705  -4.951   2.428
  519    HB2  RCY  68           HB2      RCY  68  77.879  -3.439   1.541
  520    HA   RCY  68           HA       RCY  68  79.243  -2.560   3.126
  521    HN1  RCY  68           HN1      RCY  68  79.279  -5.409   4.005
  522    HA   PRO  69           HA       PRO  69  77.975  -1.271   7.214
  523    HB2  PRO  69           HB2      PRO  69  76.175   0.511   5.607
  524    HB3  PRO  69           HB1      PRO  69  77.229   0.914   6.977
  525    HG2  PRO  69           HG2      PRO  69  77.920   1.455   4.449
  526    HG3  PRO  69           HG1      PRO  69  79.113   1.002   5.676
  527    HD2  PRO  69           HD2      PRO  69  78.146  -0.557   3.353
  528    HD3  PRO  69           HD1      PRO  69  79.649  -0.736   4.283
  529    H    TRP  70           HN       TRP  70  75.715  -2.348   4.765
  530    HA   TRP  70           HA       TRP  70  73.300  -2.276   6.261
  531    HD1  TRP  70           HD1      TRP  70  71.137  -2.039   5.126
  532    HE1  TRP  70           HE1      TRP  70  68.967  -3.422   5.256
  533    HE3  TRP  70           HE3      TRP  70  73.008  -6.702   4.215
  534    HZ2  TRP  70           HZ2      TRP  70  68.132  -6.151   5.006
  535    HZ3  TRP  70           HZ3      TRP  70  71.509  -8.670   4.166
  536    HH2  TRP  70           HH2      TRP  70  69.077  -8.405   4.560
  537    HB2  TRP  70           HB2      TRP  70  73.567  -2.845   3.792
  538    HB3  TRP  70           HB1      TRP  70  74.053  -4.461   4.308
  539    H    GLU  71           HN       GLU  71  76.034  -4.474   6.408
  540    HA   GLU  71           HA       GLU  71  74.563  -6.403   8.082
  541    HB2  GLU  71           HB2      GLU  71  77.436  -6.218   7.147
  542    HB3  GLU  71           HB1      GLU  71  76.878  -7.463   8.265
  543    HG2  GLU  71           HG2      GLU  71  75.535  -6.966   5.601
  544    HG3  GLU  71           HG1      GLU  71  76.873  -8.101   5.787
  545    H    ALA  72           HN       ALA  72  77.125  -3.966   8.471
  546    HA   ALA  72           HA       ALA  72  77.395  -4.471  11.328
  547    HB1  ALA  72           HB1      ALA  72  79.198  -3.508   9.813
  548    HB2  ALA  72           HB2      ALA  72  78.937  -2.635  11.323
  549    HB3  ALA  72           HB3      ALA  72  78.278  -2.003   9.813
  550    H1U  RCY  73           H1U      RCY  73  72.128   2.898   4.918
  551    H1S  RCY  73           H1S      RCY  73  72.417   2.520   9.212
  552    HB1  RCY  73           HB1      RCY  73  73.807  -0.011   9.162
  553    HB2  RCY  73           HB2      RCY  73  75.503   0.465   9.219
  554    HA   RCY  73           HA       RCY  73  75.215  -0.192  11.794
  555    HN1  RCY  73           HN1      RCY  73  76.397  -1.489   9.623
  556    H    ASN  74           HN       ASN  74  73.146  -1.685   9.307
  557    HA   ASN  74           HA       ASN  74  71.773  -3.618  10.708
  558    HB2  ASN  74           HB2      ASN  74  71.117  -0.913  11.732
  559    HB3  ASN  74           HB1      ASN  74  69.714  -1.901  11.334
  560   HD21  ASN  74          HD21      ASN  74  69.323  -1.986  13.743
  561   HD22  ASN  74          HD22      ASN  74  70.201  -3.095  14.681
  562    H    HIS  75           HN       HIS  75  69.134  -3.316  10.072
  563    HA   HIS  75           HA       HIS  75  68.998  -3.701   7.302
  564    HD1  HIS  75           HD1      HIS  75  67.522  -5.251   6.425
  565    HD2  HIS  75           HD2      HIS  75  64.747  -2.190   7.002
  566    HE1  HIS  75           HE1      HIS  75  65.889  -5.392   4.494
  567    HE2  HIS  75           HE2      HIS  75  64.194  -3.535   4.833
  568    HB2  HIS  75           HB2      HIS  75  67.172  -4.109   9.065
  569    HB3  HIS  75           HB1      HIS  75  66.758  -2.406   8.870
  570    H1U  RCY  76           H1U      RCY  76  71.828  -1.852   4.377
  571    H1S  RCY  76           H1S      RCY  76  70.057   1.992   4.249
  572    HB1  RCY  76           HB1      RCY  76  66.321   1.264   6.622
  573    HB2  RCY  76           HB2      RCY  76  67.173  -0.048   5.811
  574    HA   RCY  76           HA       RCY  76  69.250   1.019   7.145
  575    HN1  RCY  76           HN1      RCY  76  67.755  -0.742   8.889
  576    H    GLU  77           HN       GLU  77  68.922   0.853   9.922
  577    HA   GLU  77           HA       GLU  77  66.892   2.666  10.897
  578    HB2  GLU  77           HB2      GLU  77  68.510   0.857  12.099
  579    HB3  GLU  77           HB1      GLU  77  69.415   2.329  12.450
  580    HG2  GLU  77           HG2      GLU  77  66.468   1.913  13.041
  581    HG3  GLU  77           HG1      GLU  77  67.765   1.823  14.233
  582    H    LEU  78           HN       LEU  78  67.266   4.837  11.733
  583    HA   LEU  78           HA       LEU  78  68.108   7.018  11.556
  584    HG   LEU  78           HG       LEU  78  70.125   8.409  11.335
  585    HB2  LEU  78           HB2      LEU  78  70.201   5.577  12.371
  586    HB3  LEU  78           HB1      LEU  78  70.801   5.963  10.761
  587   HD11  LEU  78          HD11      LEU  78  68.871   8.135  13.328
  588   HD12  LEU  78          HD12      LEU  78  70.427   8.761  13.875
  589   HD13  LEU  78          HD13      LEU  78  70.066   7.042  14.027
  590   HD21  LEU  78          HD21      LEU  78  72.459   7.568  11.120
  591   HD22  LEU  78          HD22      LEU  78  72.422   7.088  12.817
  592   HD23  LEU  78          HD23      LEU  78  72.313   8.793  12.381
  593    H    HIS  79           HN       HIS  79  68.409   8.565   9.879
  594    HA   HIS  79           HA       HIS  79  68.214   9.290   7.645
  595    HD1  HIS  79           HD1      HIS  79  72.476   7.291   7.926
  596    HD2  HIS  79           HD2      HIS  79  70.092  10.644   8.620
  597    HE1  HIS  79           HE1      HIS  79  73.844   8.854   9.375
  598    HE2  HIS  79           HE2      HIS  79  72.405  10.899   9.805
  599    HB2  HIS  79           HB2      HIS  79  70.095   6.971   7.109
  600    HB3  HIS  79           HB1      HIS  79  69.904   8.428   6.137
  601    H    GLU  80           HN       GLU  80  66.029   8.712   7.247
  602    HA   GLU  80           HA       GLU  80  65.583   5.984   6.108
  603    HB2  GLU  80           HB2      GLU  80  63.499   7.932   7.124
  604    HB3  GLU  80           HB1      GLU  80  63.269   6.228   6.728
  605    HG2  GLU  80           HG2      GLU  80  64.829   5.596   8.535
  606    HG3  GLU  80           HG1      GLU  80  65.046   7.300   8.939
  607    H    LEU  81           HN       LEU  81  63.451   8.741   5.634
  608    HA   LEU  81           HA       LEU  81  63.805   8.380   2.708
  609    HG   LEU  81           HG       LEU  81  62.189  10.077   5.377
  610    HB2  LEU  81           HB2      LEU  81  61.663   9.890   2.733
  611    HB3  LEU  81           HB1      LEU  81  61.532   8.188   3.171
  612   HD11  LEU  81          HD11      LEU  81  59.501   9.963   3.987
  613   HD12  LEU  81          HD12      LEU  81  60.485  11.391   4.310
  614   HD13  LEU  81          HD13      LEU  81  59.703  10.539   5.642
  615   HD21  LEU  81          HD21      LEU  81  60.949   8.512   6.669
  616   HD22  LEU  81          HD22      LEU  81  61.818   7.527   5.492
  617   HD23  LEU  81          HD23      LEU  81  60.109   7.887   5.249
  618    H    ALA  82           HN       ALA  82  63.611  11.030   5.111
  619    HA   ALA  82           HA       ALA  82  63.969  13.220   3.433
  620    HB1  ALA  82           HB1      ALA  82  65.297  12.769   6.124
  621    HB2  ALA  82           HB2      ALA  82  63.680  13.427   5.870
  622    HB3  ALA  82           HB3      ALA  82  65.095  14.334   5.336
  623    H    GLN  83           HN       GLN  83  65.464  13.600   1.885
  624    HA   GLN  83           HA       GLN  83  67.461  13.389   0.657
  625    HB2  GLN  83           HB2      GLN  83  68.410  13.910   3.483
  626    HB3  GLN  83           HB1      GLN  83  69.513  13.852   2.110
  627    HG2  GLN  83           HG2      GLN  83  67.062  15.593   2.006
  628    HG3  GLN  83           HG1      GLN  83  68.521  16.161   2.818
  629   HE21  GLN  83          HE21      GLN  83  69.905  17.290   1.456
  630   HE22  GLN  83          HE22      GLN  83  70.039  17.053  -0.219
  631    H    TYR  84           HN       TYR  84  66.292  10.923   2.121
  632    HA   TYR  84           HA       TYR  84  68.643   9.185   1.569
  633    HD1  TYR  84           HD2      TYR  84  70.457   9.228   2.884
  634    HD2  TYR  84           HD1      TYR  84  67.468  10.453   5.715
  635    HE1  TYR  84           HE2      TYR  84  72.121  10.679   4.013
  636    HE2  TYR  84           HE1      TYR  84  69.132  11.905   6.844
  637    HH   TYR  84           HH       TYR  84  72.518  11.766   6.066
  638    HB2  TYR  84           HB2      TYR  84  66.887   8.953   4.035
  639    HB3  TYR  84           HB1      TYR  84  68.172   7.835   3.581
  640    H    GLY  85           HN       GLY  85  65.476   9.961   1.036
  641    HA2  GLY  85           HA2      GLY  85  64.553   7.179   0.580
  642    HA3  GLY  85           HA1      GLY  85  63.552   8.629   0.458
  643    H    ILE  86           HN       ILE  86  65.709   9.995  -1.127
  644    HA   ILE  86           HA       ILE  86  64.761   9.488  -3.743
  645    HB   ILE  86           HB       ILE  86  67.587  10.409  -3.199
  646   HG12  ILE  86          HG12      ILE  86  66.236  11.593  -1.572
  647   HG13  ILE  86          HG11      ILE  86  66.577  12.702  -2.901
  648   HG21  ILE  86          HG21      ILE  86  66.675  10.127  -5.547
  649   HG22  ILE  86          HG22      ILE  86  67.231  11.756  -5.164
  650   HG23  ILE  86          HG23      ILE  86  65.506  11.392  -5.169
  651   HD11  ILE  86          HD11      ILE  86  64.352  11.978  -3.911
  652   HD12  ILE  86          HD12      ILE  86  64.241  12.931  -2.431
  653   HD13  ILE  86          HD13      ILE  86  64.014  11.182  -2.373
  654    H1U  RCY  87           H1U      RCY  87  69.191  -1.532  -4.698
  655    H1S  RCY  87           H1S      RCY  87  67.792   2.113  -2.020
  656    HB1  RCY  87           HB1      RCY  87  66.585   4.352  -1.982
  657    HB2  RCY  87           HB2      RCY  87  67.407   5.591  -1.039
  658    HA   RCY  87           HA       RCY  87  68.392   6.204  -3.467
  659    HN1  RCY  87           HN1      RCY  87  66.399   7.353  -1.839
  Start of MODEL   63
    1    HA   MET   1           HA       MET   1  59.335 -10.836  -0.483
    2    HB2  MET   1           HB2      MET   1  59.391 -13.226  -2.334
    3    HB3  MET   1           HB1      MET   1  58.728 -11.622  -2.649
    4    HG2  MET   1           HG2      MET   1  61.032 -10.677  -2.466
    5    HG3  MET   1           HG1      MET   1  61.657 -12.315  -2.279
    6    HE1  MET   1           HE1      MET   1  62.962 -12.061  -5.690
    7    HE2  MET   1           HE2      MET   1  62.801 -13.353  -4.503
    8    HE3  MET   1           HE3      MET   1  63.207 -11.724  -3.972
    9    H    ASN   2           HN       ASN   2  58.919 -14.383  -0.798
   10    HA   ASN   2           HA       ASN   2  56.190 -14.195   0.222
   11    HB2  ASN   2           HB2      ASN   2  57.901 -16.650  -0.279
   12    HB3  ASN   2           HB1      ASN   2  56.151 -16.626  -0.057
   13   HD21  ASN   2          HD21      ASN   2  58.244 -17.059  -2.478
   14   HD22  ASN   2          HD22      ASN   2  57.452 -16.257  -3.747
   15    H    LEU   3           HN       LEU   3  58.484 -13.371   1.978
   16    HA   LEU   3           HA       LEU   3  58.416 -15.423   4.111
   17    HG   LEU   3           HG       LEU   3  60.117 -12.872   2.298
   18    HB2  LEU   3           HB2      LEU   3  59.870 -13.522   5.253
   19    HB3  LEU   3           HB1      LEU   3  60.572 -14.557   4.011
   20   HD11  LEU   3          HD11      LEU   3  59.319 -10.580   3.187
   21   HD12  LEU   3          HD12      LEU   3  58.758 -11.472   4.602
   22   HD13  LEU   3          HD13      LEU   3  58.104 -11.846   3.007
   23   HD21  LEU   3          HD21      LEU   3  61.349 -11.456   4.673
   24   HD22  LEU   3          HD22      LEU   3  61.748 -11.255   2.967
   25   HD23  LEU   3          HD23      LEU   3  62.184 -12.744   3.806
   26    H    GLU   4           HN       GLU   4  58.187 -14.310   6.430
   27    HA   GLU   4           HA       GLU   4  55.481 -13.238   6.504
   28    HB2  GLU   4           HB2      GLU   4  57.355 -13.320   8.866
   29    HB3  GLU   4           HB1      GLU   4  55.605 -13.542   8.839
   30    HG2  GLU   4           HG2      GLU   4  55.987 -15.647   7.487
   31    HG3  GLU   4           HG1      GLU   4  57.711 -15.459   7.812
   32    HA   PRO   5           HA       PRO   5  55.986  -8.852   6.346
   33    HB2  PRO   5           HB2      PRO   5  54.971  -8.921   9.173
   34    HB3  PRO   5           HB1      PRO   5  54.492  -7.859   7.834
   35    HG2  PRO   5           HG2      PRO   5  53.033  -9.989   8.565
   36    HG3  PRO   5           HG1      PRO   5  53.142  -9.445   6.884
   37    HD2  PRO   5           HD2      PRO   5  54.249 -11.883   8.111
   38    HD3  PRO   5           HD1      PRO   5  54.003 -11.503   6.393
   39    HA   PRO   6           HA       PRO   6  59.870  -8.902   8.782
   40    HB2  PRO   6           HB2      PRO   6  61.450  -7.726   6.925
   41    HB3  PRO   6           HB1      PRO   6  60.992  -9.438   6.826
   42    HG2  PRO   6           HG2      PRO   6  59.945  -7.114   5.309
   43    HG3  PRO   6           HG1      PRO   6  60.191  -8.787   4.788
   44    HD2  PRO   6           HD2      PRO   6  57.734  -7.672   5.555
   45    HD3  PRO   6           HD1      PRO   6  58.088  -9.410   5.442
   46    H    LYS   7           HN       LYS   7  60.524  -7.305  10.184
   47    HA   LYS   7           HA       LYS   7  60.322  -4.465   9.391
   48    HB2  LYS   7           HB2      LYS   7  58.966  -3.856  11.333
   49    HB3  LYS   7           HB1      LYS   7  58.095  -5.041  10.360
   50    HG2  LYS   7           HG2      LYS   7  59.044  -6.836  11.878
   51    HG3  LYS   7           HG1      LYS   7  59.628  -5.541  12.923
   52    HD2  LYS   7           HD2      LYS   7  57.562  -5.952  13.894
   53    HD3  LYS   7           HD1      LYS   7  57.120  -4.702  12.730
   54    HE2  LYS   7           HE2      LYS   7  56.411  -6.402  11.122
   55    HE3  LYS   7           HE1      LYS   7  56.932  -7.685  12.215
   56    HZ1  LYS   7           HZ1      LYS   7  55.110  -5.740  13.352
   57    HZ2  LYS   7           HZ2      LYS   7  55.137  -7.431  13.512
   58    HZ3  LYS   7           HZ3      LYS   7  54.449  -6.716  12.133
   59    H    ALA   8           HN       ALA   8  61.815  -6.991  11.034
   60    HA   ALA   8           HA       ALA   8  63.587  -7.076  12.579
   61    HB1  ALA   8           HB1      ALA   8  65.342  -5.462  12.176
   62    HB2  ALA   8           HB2      ALA   8  64.201  -4.332  11.446
   63    HB3  ALA   8           HB3      ALA   8  64.597  -5.841  10.623
   64    H    GLU   9           HN       GLU   9  64.799  -5.367  14.240
   65    HA   GLU   9           HA       GLU   9  62.808  -3.584  15.494
   66    HB2  GLU   9           HB2      GLU   9  63.887  -6.087  16.813
   67    HB3  GLU   9           HB1      GLU   9  63.194  -4.749  17.730
   68    HG2  GLU   9           HG2      GLU   9  61.117  -4.961  16.311
   69    HG3  GLU   9           HG1      GLU   9  61.809  -6.432  15.625
   70    H1U  RCY  10           H1U      RCY  10  69.201  -5.331   9.290
   71    H1S  RCY  10           H1S      RCY  10  68.323  -6.375  13.236
   72    HB1  RCY  10           HB1      RCY  10  69.034  -2.406  14.799
   73    HB2  RCY  10           HB2      RCY  10  67.829  -2.822  13.581
   74    HA   RCY  10           HA       RCY  10  67.328  -2.880  16.572
   75    HN1  RCY  10           HN1      RCY  10  65.665  -3.677  14.291
   76    H    ARG  11           HN       ARG  11  65.161  -1.355  14.385
   77    HA   ARG  11           HA       ARG  11  65.451   1.189  15.692
   78    HE   ARG  11           HE       ARG  11  68.507  -0.765  10.781
   79    HB2  ARG  11           HB2      ARG  11  66.347   2.508  13.862
   80    HB3  ARG  11           HB1      ARG  11  67.499   1.246  14.289
   81    HG2  ARG  11           HG2      ARG  11  65.448   0.857  12.103
   82    HG3  ARG  11           HG1      ARG  11  67.030   1.566  11.781
   83    HD2  ARG  11           HD2      ARG  11  67.940  -0.532  13.058
   84    HD3  ARG  11           HD1      ARG  11  66.360  -1.221  12.687
   85   HH11  ARG  11          HH21      ARG  11  65.100  -0.904  11.293
   86   HH12  ARG  11          HH22      ARG  11  64.736  -1.323   9.652
   87   HH21  ARG  11          HH11      ARG  11  68.051  -1.312   8.635
   88   HH22  ARG  11          HH12      ARG  11  66.407  -1.554   8.148
   89    H    SER  12           HN       SER  12  64.353   2.911  13.909
   90    HA   SER  12           HA       SER  12  62.207   3.485  13.124
   91    HG   SER  12           HG       SER  12  62.340   0.057  12.165
   92    HB2  SER  12           HB2      SER  12  61.445   1.959  11.249
   93    HB3  SER  12           HB1      SER  12  63.086   2.575  11.075
   94    H    ALA  13           HN       ALA  13  60.047   1.832  12.363
   95    HA   ALA  13           HA       ALA  13  59.480   0.024  14.621
   96    HB1  ALA  13           HB1      ALA  13  58.911   2.351  15.422
   97    HB2  ALA  13           HB2      ALA  13  57.541   1.241  15.402
   98    HB3  ALA  13           HB3      ALA  13  57.720   2.443  14.125
   99    H    THR  14           HN       THR  14  58.230   1.718  11.752
  100    HA   THR  14           HA       THR  14  57.334  -0.782  10.581
  101    HB   THR  14           HB       THR  14  55.162   1.195  11.325
  102    HG1  THR  14           HG1      THR  14  55.292  -1.310  12.501
  103   HG21  THR  14          HG21      THR  14  53.666  -0.555  10.596
  104   HG22  THR  14          HG22      THR  14  55.006  -1.687  10.407
  105   HG23  THR  14          HG23      THR  14  54.859  -0.304   9.322
  106    H    ARG  15           HN       ARG  15  58.569  -0.032   8.802
  107    HA   ARG  15           HA       ARG  15  58.964   1.160   6.820
  108    HE   ARG  15           HE       ARG  15  55.939   3.715   2.922
  109    HB2  ARG  15           HB2      ARG  15  56.569   0.375   6.483
  110    HB3  ARG  15           HB1      ARG  15  56.053   1.964   7.048
  111    HG2  ARG  15           HG2      ARG  15  57.628   2.922   5.251
  112    HG3  ARG  15           HG1      ARG  15  57.660   1.290   4.582
  113    HD2  ARG  15           HD2      ARG  15  55.181   1.321   4.437
  114    HD3  ARG  15           HD1      ARG  15  55.181   2.976   5.047
  115   HH11  ARG  15          HH21      ARG  15  56.116   0.293   3.299
  116   HH12  ARG  15          HH22      ARG  15  56.465  -0.007   1.629
  117   HH21  ARG  15          HH11      ARG  15  56.394   3.344   0.740
  118   HH22  ARG  15          HH12      ARG  15  56.623   1.721   0.180
  119    H    VAL  16           HN       VAL  16  60.336   2.818   7.504
  120    HA   VAL  16           HA       VAL  16  59.080   5.477   7.747
  121    HB   VAL  16           HB       VAL  16  59.330   4.467  10.092
  122   HG11  VAL  16          HG11      VAL  16  61.617   3.478   9.468
  123   HG12  VAL  16          HG12      VAL  16  61.509   4.286  11.032
  124   HG13  VAL  16          HG13      VAL  16  62.252   5.112   9.663
  125   HG21  VAL  16          HG21      VAL  16  60.089   6.583  11.025
  126   HG22  VAL  16          HG22      VAL  16  59.140   6.919   9.576
  127   HG23  VAL  16          HG23      VAL  16  60.901   6.998   9.515
  128    H    MET  17           HN       MET  17  60.727   7.209   7.551
  129    HA   MET  17           HA       MET  17  63.473   6.760   6.999
  130    HB2  MET  17           HB2      MET  17  62.838   5.482   5.060
  131    HB3  MET  17           HB1      MET  17  61.638   6.684   4.587
  132    HG2  MET  17           HG2      MET  17  63.316   8.275   4.004
  133    HG3  MET  17           HG1      MET  17  64.582   7.340   4.800
  134    HE1  MET  17           HE1      MET  17  65.745   7.978   2.388
  135    HE2  MET  17           HE2      MET  17  66.100   6.459   1.570
  136    HE3  MET  17           HE3      MET  17  66.282   6.574   3.318
  137    H    GLY  18           HN       GLY  18  60.558   8.621   6.612
  138    HA2  GLY  18           HA2      GLY  18  61.616  11.029   5.548
  139    HA3  GLY  18           HA1      GLY  18  60.204  10.939   6.601
  140    H    GLY  19           HN       GLY  19  61.800  13.107   6.926
  141    HA2  GLY  19           HA2      GLY  19  62.298  13.657   9.449
  142    HA3  GLY  19           HA1      GLY  19  63.618  12.510   9.208
  143    HA   PRO  20           HA       PRO  20  64.865  17.045   8.284
  144    HB2  PRO  20           HB2      PRO  20  67.258  15.819   9.616
  145    HB3  PRO  20           HB1      PRO  20  66.602  17.461   9.769
  146    HG2  PRO  20           HG2      PRO  20  66.213  15.615  11.654
  147    HG3  PRO  20           HG1      PRO  20  64.975  16.816  11.252
  148    HD2  PRO  20           HD2      PRO  20  65.025  13.904  10.655
  149    HD3  PRO  20           HD1      PRO  20  63.635  14.997  10.831
  150    H1U  RCY  21           H1U      RCY  21  66.027   7.550   4.091
  151    H1S  RCY  21           H1S      RCY  21  67.832  11.392   3.631
  152    HB1  RCY  21           HB1      RCY  21  64.956  14.684   3.544
  153    HB2  RCY  21           HB2      RCY  21  65.361  13.689   4.942
  154    HA   RCY  21           HA       RCY  21  67.461  15.286   5.085
  155    HN1  RCY  21           HN1      RCY  21  64.785  16.250   6.024
  156    H    THR  22           HN       THR  22  68.364  16.504   3.471
  157    HA   THR  22           HA       THR  22  66.642  18.380   1.939
  158    HB   THR  22           HB       THR  22  68.447  20.160   2.344
  159    HG1  THR  22           HG1      THR  22  69.690  18.294   3.454
  160   HG21  THR  22          HG21      THR  22  66.220  20.315   3.339
  161   HG22  THR  22          HG22      THR  22  67.431  20.821   4.517
  162   HG23  THR  22          HG23      THR  22  66.699  19.221   4.636
  163    HA   PRO  23           HA       PRO  23  69.391  16.072  -0.939
  164    HB2  PRO  23           HB2      PRO  23  67.777  17.769  -2.804
  165    HB3  PRO  23           HB1      PRO  23  68.173  16.042  -2.907
  166    HG2  PRO  23           HG2      PRO  23  65.759  16.873  -2.153
  167    HG3  PRO  23           HG1      PRO  23  66.512  15.440  -1.434
  168    HD2  PRO  23           HD2      PRO  23  66.116  18.150  -0.248
  169    HD3  PRO  23           HD1      PRO  23  66.185  16.566   0.554
  170    H    ARG  24           HN       ARG  24  71.400  17.079  -0.615
  171    HA   ARG  24           HA       ARG  24  71.856  19.888  -1.122
  172    HE   ARG  24           HE       ARG  24  73.859  20.781   2.971
  173    HB2  ARG  24           HB2      ARG  24  73.843  17.598  -0.982
  174    HB3  ARG  24           HB1      ARG  24  74.243  19.313  -0.894
  175    HG2  ARG  24           HG2      ARG  24  72.433  17.854   1.053
  176    HG3  ARG  24           HG1      ARG  24  74.119  18.271   1.360
  177    HD2  ARG  24           HD2      ARG  24  73.303  20.700   0.689
  178    HD3  ARG  24           HD1      ARG  24  71.728  20.066   1.167
  179   HH11  ARG  24          HH21      ARG  24  71.356  18.493   2.350
  180   HH12  ARG  24          HH22      ARG  24  71.121  18.097   4.020
  181   HH21  ARG  24          HH11      ARG  24  73.566  20.277   5.155
  182   HH22  ARG  24          HH12      ARG  24  72.372  19.107   5.608
  183    H    LYS  25           HN       LYS  25  74.037  20.104  -2.733
  184    HA   LYS  25           HA       LYS  25  73.874  18.622  -5.194
  185    HB2  LYS  25           HB2      LYS  25  72.918  20.436  -6.611
  186    HB3  LYS  25           HB1      LYS  25  71.747  19.795  -5.460
  187    HG2  LYS  25           HG2      LYS  25  72.960  21.810  -4.011
  188    HG3  LYS  25           HG1      LYS  25  72.904  22.490  -5.638
  189    HD2  LYS  25           HD2      LYS  25  70.499  22.029  -5.774
  190    HD3  LYS  25           HD1      LYS  25  70.536  21.286  -4.174
  191    HE2  LYS  25           HE2      LYS  25  71.541  23.561  -3.397
  192    HE3  LYS  25           HE1      LYS  25  70.890  24.184  -4.913
  193    HZ1  LYS  25           HZ1      LYS  25  69.317  24.418  -3.082
  194    HZ2  LYS  25           HZ2      LYS  25  69.329  22.736  -2.842
  195    HZ3  LYS  25           HZ3      LYS  25  68.712  23.387  -4.285
  196    H    GLY  26           HN       GLY  26  75.658  20.134  -3.155
  197    HA2  GLY  26           HA2      GLY  26  77.101  22.003  -4.919
  198    HA3  GLY  26           HA1      GLY  26  77.503  21.647  -3.239
  199    HA   PRO  27           HA       PRO  27  80.618  18.667  -4.071
  200    HB2  PRO  27           HB2      PRO  27  78.784  16.394  -3.416
  201    HB3  PRO  27           HB1      PRO  27  80.400  16.758  -2.779
  202    HG2  PRO  27           HG2      PRO  27  78.195  17.225  -1.355
  203    HG3  PRO  27           HG1      PRO  27  79.607  18.290  -1.267
  204    HD2  PRO  27           HD2      PRO  27  76.975  18.767  -2.577
  205    HD3  PRO  27           HD1      PRO  27  78.123  19.936  -1.889
  206    HA   PRO  28           HA       PRO  28  80.301  17.379  -8.314
  207    HB2  PRO  28           HB2      PRO  28  81.646  14.871  -7.362
  208    HB3  PRO  28           HB1      PRO  28  82.049  15.909  -8.744
  209    HG2  PRO  28           HG2      PRO  28  83.427  15.993  -6.448
  210    HG3  PRO  28           HG1      PRO  28  83.166  17.429  -7.450
  211    HD2  PRO  28           HD2      PRO  28  81.997  16.760  -4.816
  212    HD3  PRO  28           HD1      PRO  28  82.159  18.342  -5.607
  213    H    LYS  29           HN       LYS  29  79.120  15.838  -9.639
  214    HA   LYS  29           HA       LYS  29  76.782  14.735  -8.409
  215    HB2  LYS  29           HB2      LYS  29  78.030  14.103 -11.104
  216    HB3  LYS  29           HB1      LYS  29  76.391  13.671 -10.618
  217    HG2  LYS  29           HG2      LYS  29  77.246  16.534 -10.383
  218    HG3  LYS  29           HG1      LYS  29  76.841  15.902 -11.979
  219    HD2  LYS  29           HD2      LYS  29  74.974  15.332  -9.710
  220    HD3  LYS  29           HD1      LYS  29  74.962  16.946 -10.421
  221    HE2  LYS  29           HE2      LYS  29  74.462  16.071 -12.603
  222    HE3  LYS  29           HE1      LYS  29  74.744  14.414 -12.067
  223    HZ1  LYS  29           HZ1      LYS  29  72.740  15.979 -10.630
  224    HZ2  LYS  29           HZ2      LYS  29  72.767  14.320 -10.994
  225    HZ3  LYS  29           HZ3      LYS  29  72.338  15.447 -12.190
  226    H1U  RCY  30           H1U      RCY  30  76.871   3.798 -10.887
  227    H1S  RCY  30           H1S      RCY  30  76.547   7.814 -11.372
  228    HB1  RCY  30           HB1      RCY  30  76.984  10.585  -7.839
  229    HB2  RCY  30           HB2      RCY  30  77.871   9.081  -8.079
  230    HA   RCY  30           HA       RCY  30  79.463  10.816  -8.444
  231    HN1  RCY  30           HN1      RCY  30  78.016  12.352 -10.456
  232    H    LYS  31           HN       LYS  31  79.720  11.760 -11.251
  233    HA   LYS  31           HA       LYS  31  80.325   9.107 -12.482
  234    HB2  LYS  31           HB2      LYS  31  78.880  11.446 -13.747
  235    HB3  LYS  31           HB1      LYS  31  79.666  10.192 -14.706
  236    HG2  LYS  31           HG2      LYS  31  78.254   8.484 -13.795
  237    HG3  LYS  31           HG1      LYS  31  77.630   9.572 -12.555
  238    HD2  LYS  31           HD2      LYS  31  76.528  10.937 -14.246
  239    HD3  LYS  31           HD1      LYS  31  77.232   9.961 -15.535
  240    HE2  LYS  31           HE2      LYS  31  76.053   7.959 -14.552
  241    HE3  LYS  31           HE1      LYS  31  75.222   9.062 -13.455
  242    HZ1  LYS  31           HZ1      LYS  31  74.161  10.131 -15.229
  243    HZ2  LYS  31           HZ2      LYS  31  74.038   8.476 -15.591
  244    HZ3  LYS  31           HZ3      LYS  31  75.187   9.439 -16.389
  245    H    GLN  32           HN       GLN  32  81.676   9.761 -14.665
  246    HA   GLN  32           HA       GLN  32  83.805  10.486 -15.347
  247    HB2  GLN  32           HB2      GLN  32  83.089  13.065 -13.938
  248    HB3  GLN  32           HB1      GLN  32  84.107  12.853 -15.363
  249    HG2  GLN  32           HG2      GLN  32  82.138  12.057 -16.639
  250    HG3  GLN  32           HG1      GLN  32  81.124  12.318 -15.219
  251   HE21  GLN  32          HE21      GLN  32  83.743  14.346 -16.654
  252   HE22  GLN  32          HE22      GLN  32  82.777  15.731 -16.821
  253    H    ARG  33           HN       ARG  33  83.153   9.753 -12.287
  254    HA   ARG  33           HA       ARG  33  85.434  10.966 -10.921
  255    HE   ARG  33           HE       ARG  33  81.151   6.277  -9.595
  256    HB2  ARG  33           HB2      ARG  33  84.800   9.475  -9.057
  257    HB3  ARG  33           HB1      ARG  33  83.393  10.335  -9.680
  258    HG2  ARG  33           HG2      ARG  33  83.002   8.287 -11.177
  259    HG3  ARG  33           HG1      ARG  33  84.176   7.455 -10.156
  260    HD2  ARG  33           HD2      ARG  33  82.739   8.262  -8.168
  261    HD3  ARG  33           HD1      ARG  33  81.497   8.603  -9.373
  262   HH11  ARG  33          HH21      ARG  33  84.125   7.016  -8.016
  263   HH12  ARG  33          HH22      ARG  33  84.466   5.370  -7.597
  264   HH21  ARG  33          HH11      ARG  33  81.578   4.123  -9.057
  265   HH22  ARG  33          HH12      ARG  33  83.024   3.732  -8.187
  266    H    GLN  34           HN       GLN  34  86.015   8.295  -9.581
  267    HA   GLN  34           HA       GLN  34  87.482   6.923 -11.783
  268    HB2  GLN  34           HB2      GLN  34  88.695   7.930  -9.192
  269    HB3  GLN  34           HB1      GLN  34  89.499   6.807 -10.290
  270    HG2  GLN  34           HG2      GLN  34  89.123   8.548 -12.123
  271    HG3  GLN  34           HG1      GLN  34  88.685   9.669 -10.833
  272   HE21  GLN  34          HE21      GLN  34  90.550  11.028 -10.910
  273   HE22  GLN  34          HE22      GLN  34  92.120  10.466 -10.590
  274    H    THR  35           HN       THR  35  88.052   4.713 -11.235
  275    HA   THR  35           HA       THR  35  86.096   3.484  -9.433
  276    HB   THR  35           HB       THR  35  86.661   2.428 -11.594
  277    HG1  THR  35           HG1      THR  35  87.614   0.911  -9.398
  278   HG21  THR  35          HG21      THR  35  89.358   1.720 -10.470
  279   HG22  THR  35          HG22      THR  35  89.132   3.236 -11.341
  280   HG23  THR  35          HG23      THR  35  88.816   1.700 -12.148
  281    H    ARG  36           HN       ARG  36  89.662   3.631  -9.622
  282    HA   ARG  36           HA       ARG  36  91.248   3.538  -7.897
  283    HE   ARG  36           HE       ARG  36  92.938   4.656  -7.915
  284    HB2  ARG  36           HB2      ARG  36  89.278   4.901  -6.732
  285    HB3  ARG  36           HB1      ARG  36  89.110   3.416  -5.799
  286    HG2  ARG  36           HG2      ARG  36  90.645   4.813  -4.591
  287    HG3  ARG  36           HG1      ARG  36  91.608   3.545  -5.350
  288    HD2  ARG  36           HD2      ARG  36  91.193   5.964  -7.003
  289    HD3  ARG  36           HD1      ARG  36  92.178   6.201  -5.559
  290   HH11  ARG  36          HH21      ARG  36  93.285   5.128  -4.517
  291   HH12  ARG  36          HH22      ARG  36  94.865   4.423  -4.445
  292   HH21  ARG  36          HH11      ARG  36  95.000   3.733  -7.841
  293   HH22  ARG  36          HH12      ARG  36  95.836   3.633  -6.327
  294    H    GLN  37           HN       GLN  37  88.391   1.483  -7.549
  295    HA   GLN  37           HA       GLN  37  89.942  -0.929  -7.548
  296    HB2  GLN  37           HB2      GLN  37  90.612  -0.354  -5.311
  297    HB3  GLN  37           HB1      GLN  37  88.961   0.077  -4.864
  298    HG2  GLN  37           HG2      GLN  37  88.238  -2.181  -4.909
  299    HG3  GLN  37           HG1      GLN  37  89.666  -2.705  -5.803
  300   HE21  GLN  37          HE21      GLN  37  88.548  -1.618  -2.595
  301   HE22  GLN  37          HE22      GLN  37  89.894  -2.207  -1.745
  302    H1U  RCY  38           H1U      RCY  38  81.741   0.900  -3.951
  303    H1S  RCY  38           H1S      RCY  38  82.435  -1.947  -6.710
  304    HB1  RCY  38           HB1      RCY  38  85.368  -0.631  -9.839
  305    HB2  RCY  38           HB2      RCY  38  85.454  -0.285  -8.112
  306    HA   RCY  38           HA       RCY  38  85.988  -2.821  -7.863
  307    HN1  RCY  38           HN1      RCY  38  88.361  -1.652  -9.004
  308    H    LYS  39           HN       LYS  39  84.814  -2.088 -10.754
  309    HA   LYS  39           HA       LYS  39  85.274  -4.556 -11.985
  310    HB2  LYS  39           HB2      LYS  39  84.794  -3.299 -14.164
  311    HB3  LYS  39           HB1      LYS  39  83.574  -3.151 -12.898
  312    HG2  LYS  39           HG2      LYS  39  84.301  -0.970 -12.300
  313    HG3  LYS  39           HG1      LYS  39  85.815  -1.147 -13.186
  314    HD2  LYS  39           HD2      LYS  39  84.502  -1.287 -15.310
  315    HD3  LYS  39           HD1      LYS  39  83.036  -0.962 -14.384
  316    HE2  LYS  39           HE2      LYS  39  85.438   0.876 -14.321
  317    HE3  LYS  39           HE1      LYS  39  84.125   1.070 -15.483
  318    HZ1  LYS  39           HZ1      LYS  39  82.667   0.923 -13.351
  319    HZ2  LYS  39           HZ2      LYS  39  83.414   2.389 -13.775
  320    HZ3  LYS  39           HZ3      LYS  39  84.092   1.406 -12.567
  321    H    SER  40           HN       SER  40  87.366  -1.757 -11.850
  322    HA   SER  40           HA       SER  40  89.104  -2.513 -14.022
  323    HG   SER  40           HG       SER  40  89.988   0.546 -13.787
  324    HB2  SER  40           HB2      SER  40  89.327  -0.661 -11.667
  325    HB3  SER  40           HB1      SER  40  90.767  -1.040 -12.609
  326    H    LYS  41           HN       LYS  41  89.372  -2.951 -10.474
  327    HA   LYS  41           HA       LYS  41  91.720  -4.672 -10.812
  328    HB2  LYS  41           HB2      LYS  41  90.062  -3.782  -8.453
  329    HB3  LYS  41           HB1      LYS  41  91.281  -5.045  -8.279
  330    HG2  LYS  41           HG2      LYS  41  92.985  -3.503  -9.222
  331    HG3  LYS  41           HG1      LYS  41  91.762  -2.236  -9.316
  332    HD2  LYS  41           HD2      LYS  41  92.083  -1.717  -7.153
  333    HD3  LYS  41           HD1      LYS  41  91.732  -3.379  -6.677
  334    HE2  LYS  41           HE2      LYS  41  94.426  -2.446  -7.705
  335    HE3  LYS  41           HE1      LYS  41  94.023  -2.605  -5.995
  336    HZ1  LYS  41           HZ1      LYS  41  94.143  -4.741  -8.044
  337    HZ2  LYS  41           HZ2      LYS  41  93.395  -4.963  -6.535
  338    HZ3  LYS  41           HZ3      LYS  41  95.054  -4.608  -6.619
  339    HA   PRO  42           HA       PRO  42  89.493  -8.468 -11.271
  340    HB2  PRO  42           HB2      PRO  42  91.248 -10.234 -10.109
  341    HB3  PRO  42           HB1      PRO  42  91.502  -9.512 -11.710
  342    HG2  PRO  42           HG2      PRO  42  92.690  -8.756  -9.089
  343    HG3  PRO  42           HG1      PRO  42  93.436  -8.812 -10.696
  344    HD2  PRO  42           HD2      PRO  42  92.617  -6.478  -9.527
  345    HD3  PRO  42           HD1      PRO  42  92.640  -6.719 -11.289
  346    HA   PRO  43           HA       PRO  43  87.353  -9.331  -7.486
  347    HB2  PRO  43           HB2      PRO  43  86.516 -11.900  -7.879
  348    HB3  PRO  43           HB1      PRO  43  85.835 -10.520  -8.762
  349    HG2  PRO  43           HG2      PRO  43  87.862 -12.511  -9.649
  350    HG3  PRO  43           HG1      PRO  43  86.517 -11.789 -10.549
  351    HD2  PRO  43           HD2      PRO  43  89.120 -10.949 -10.807
  352    HD3  PRO  43           HD1      PRO  43  87.721  -9.890 -11.087
  353    H    LYS  44           HN       LYS  44  88.253  -9.693  -5.507
  354    HA   LYS  44           HA       LYS  44  90.173 -11.974  -5.205
  355    HB2  LYS  44           HB2      LYS  44  89.993  -9.263  -3.892
  356    HB3  LYS  44           HB1      LYS  44  90.857 -10.586  -3.110
  357    HG2  LYS  44           HG2      LYS  44  92.204 -10.873  -5.204
  358    HG3  LYS  44           HG1      LYS  44  91.413  -9.440  -5.861
  359    HD2  LYS  44           HD2      LYS  44  92.291  -8.072  -4.040
  360    HD3  LYS  44           HD1      LYS  44  93.001  -9.495  -3.278
  361    HE2  LYS  44           HE2      LYS  44  94.748  -8.349  -4.506
  362    HE3  LYS  44           HE1      LYS  44  94.368  -9.845  -5.359
  363    HZ1  LYS  44           HZ1      LYS  44  92.633  -7.967  -6.364
  364    HZ2  LYS  44           HZ2      LYS  44  94.006  -8.600  -7.138
  365    HZ3  LYS  44           HZ3      LYS  44  94.119  -7.157  -6.249
  366    H    LYS  45           HN       LYS  45  87.058 -11.470  -4.785
  367    HA   LYS  45           HA       LYS  45  86.809 -13.398  -2.636
  368    HB2  LYS  45           HB2      LYS  45  85.383 -11.739  -1.228
  369    HB3  LYS  45           HB1      LYS  45  87.138 -11.642  -1.097
  370    HG2  LYS  45           HG2      LYS  45  87.171  -9.819  -2.754
  371    HG3  LYS  45           HG1      LYS  45  85.416  -9.917  -2.903
  372    HD2  LYS  45           HD2      LYS  45  86.627  -9.537  -0.185
  373    HD3  LYS  45           HD1      LYS  45  86.500  -8.151  -1.269
  374    HE2  LYS  45           HE2      LYS  45  84.211  -9.953  -0.422
  375    HE3  LYS  45           HE1      LYS  45  84.500  -8.312   0.156
  376    HZ1  LYS  45           HZ1      LYS  45  83.119  -7.806  -1.530
  377    HZ2  LYS  45           HZ2      LYS  45  83.461  -9.226  -2.399
  378    HZ3  LYS  45           HZ3      LYS  45  84.532  -7.909  -2.464
  379    H    GLY  46           HN       GLY  46  85.165 -10.830  -4.487
  380    HA2  GLY  46           HA2      GLY  46  82.677 -12.443  -4.513
  381    HA3  GLY  46           HA1      GLY  46  82.840 -10.792  -5.116
  382    H    VAL  47           HN       VAL  47  83.087 -14.154  -5.931
  383    HA   VAL  47           HA       VAL  47  84.506 -13.854  -8.419
  384    HB   VAL  47           HB       VAL  47  83.556 -16.102  -8.948
  385   HG11  VAL  47          HG11      VAL  47  84.489 -15.917  -6.071
  386   HG12  VAL  47          HG12      VAL  47  85.571 -15.757  -7.455
  387   HG13  VAL  47          HG13      VAL  47  84.708 -17.270  -7.181
  388   HG21  VAL  47          HG21      VAL  47  82.292 -17.059  -6.813
  389   HG22  VAL  47          HG22      VAL  47  81.406 -16.209  -8.078
  390   HG23  VAL  47          HG23      VAL  47  81.853 -15.365  -6.596
  391    H    GLN  48           HN       GLN  48  83.688 -12.351  -9.826
  392    HA   GLN  48           HA       GLN  48  81.908 -11.061 -10.846
  393    HB2  GLN  48           HB2      GLN  48  81.011 -12.891 -12.654
  394    HB3  GLN  48           HB1      GLN  48  82.570 -12.081 -12.780
  395    HG2  GLN  48           HG2      GLN  48  82.231 -14.664 -11.246
  396    HG3  GLN  48           HG1      GLN  48  82.597 -14.642 -12.972
  397   HE21  GLN  48          HE21      GLN  48  84.252 -15.312 -10.379
  398   HE22  GLN  48          HE22      GLN  48  85.702 -14.466 -10.632
  399    H    GLY  49           HN       GLY  49  80.238 -10.668  -9.354
  400    HA2  GLY  49           HA2      GLY  49  77.872 -10.760  -8.975
  401    HA3  GLY  49           HA1      GLY  49  77.835 -12.349  -9.742
  402    H1U  RCY  50           H1U      RCY  50  78.269  -9.363   0.163
  403    H1S  RCY  50           H1S      RCY  50  79.276  -9.666  -4.045
  404    HB1  RCY  50           HB1      RCY  50  80.270 -11.397  -4.556
  405    HB2  RCY  50           HB2      RCY  50  79.268 -12.595  -3.739
  406    HA   RCY  50           HA       RCY  50  80.783 -13.435  -5.649
  407    HN1  RCY  50           HN1      RCY  50  80.398 -12.089  -7.564
  408    H    GLY  51           HN       GLY  51  77.394 -13.192  -4.817
  409    HA2  GLY  51           HA2      GLY  51  75.668 -14.838  -5.044
  410    HA3  GLY  51           HA1      GLY  51  76.842 -15.932  -5.778
  411    H    ASP  52           HN       ASP  52  76.560 -14.218  -2.641
  412    HA   ASP  52           HA       ASP  52  76.782 -16.841  -1.262
  413    HB2  ASP  52           HB2      ASP  52  79.089 -16.062  -1.396
  414    HB3  ASP  52           HB1      ASP  52  78.621 -14.476  -0.781
  415    H    ASP  53           HN       ASP  53  76.888 -13.369  -0.368
  416    HA   ASP  53           HA       ASP  53  74.937 -13.889   1.780
  417    HB2  ASP  53           HB2      ASP  53  76.478 -11.435   0.906
  418    HB3  ASP  53           HB1      ASP  53  75.263 -11.388   2.184
  419    H    ILE  54           HN       ILE  54  73.587 -14.485  -0.421
  420    HA   ILE  54           HA       ILE  54  71.861 -12.088  -0.923
  421    HB   ILE  54           HB       ILE  54  72.600 -14.266  -2.904
  422   HG12  ILE  54          HG12      ILE  54  73.515 -12.165  -4.121
  423   HG13  ILE  54          HG11      ILE  54  73.444 -11.391  -2.537
  424   HG21  ILE  54          HG21      ILE  54  70.352 -13.578  -3.345
  425   HG22  ILE  54          HG22      ILE  54  71.360 -12.682  -4.481
  426   HG23  ILE  54          HG23      ILE  54  70.737 -11.885  -3.037
  427   HD11  ILE  54          HD11      ILE  54  74.648 -13.999  -2.284
  428   HD12  ILE  54          HD12      ILE  54  75.339 -12.423  -1.899
  429   HD13  ILE  54          HD13      ILE  54  75.489 -13.077  -3.530
  430    HA   PRO  55           HA       PRO  55  69.315 -15.594   0.668
  431    HB2  PRO  55           HB2      PRO  55  68.208 -14.331   2.784
  432    HB3  PRO  55           HB1      PRO  55  69.847 -15.009   2.852
  433    HG2  PRO  55           HG2      PRO  55  68.983 -12.188   2.550
  434    HG3  PRO  55           HG1      PRO  55  70.379 -12.859   3.407
  435    HD2  PRO  55           HD2      PRO  55  70.440 -11.702   0.848
  436    HD3  PRO  55           HD1      PRO  55  71.710 -12.725   1.552
  437    H    GLY  56           HN       GLY  56  68.500 -12.228   0.007
  438    HA2  GLY  56           HA2      GLY  56  65.624 -12.760  -0.148
  439    HA3  GLY  56           HA1      GLY  56  66.420 -11.243  -0.565
  440    H    MET  57           HN       MET  57  68.349 -12.838  -2.311
  441    HA   MET  57           HA       MET  57  68.477 -13.181  -4.637
  442    HB2  MET  57           HB2      MET  57  67.355 -15.307  -3.616
  443    HB3  MET  57           HB1      MET  57  65.880 -14.690  -4.359
  444    HG2  MET  57           HG2      MET  57  68.478 -15.123  -5.861
  445    HG3  MET  57           HG1      MET  57  67.151 -16.284  -5.830
  446    HE1  MET  57           HE1      MET  57  64.685 -15.496  -6.206
  447    HE2  MET  57           HE2      MET  57  65.371 -16.333  -7.596
  448    HE3  MET  57           HE3      MET  57  64.378 -14.898  -7.842
  449    H    GLU  58           HN       GLU  58  67.974 -10.885  -5.043
  450    HA   GLU  58           HA       GLU  58  65.348 -10.594  -6.435
  451    HB2  GLU  58           HB2      GLU  58  65.481  -9.477  -4.094
  452    HB3  GLU  58           HB1      GLU  58  66.567  -8.322  -4.868
  453    HG2  GLU  58           HG2      GLU  58  64.365  -7.389  -5.031
  454    HG3  GLU  58           HG1      GLU  58  64.768  -7.995  -6.638
  455    H    GLY  59           HN       GLY  59  68.342  -8.686  -5.860
  456    HA2  GLY  59           HA2      GLY  59  69.005  -8.813  -8.711
  457    HA3  GLY  59           HA1      GLY  59  68.456  -7.223  -8.183
  458    H1U  RCY  60           H1U      RCY  60  75.375  -2.181  -4.914
  459    H1S  RCY  60           H1S      RCY  60  74.806  -3.694  -8.716
  460    HB1  RCY  60           HB1      RCY  60  73.586  -6.132  -6.622
  461    HB2  RCY  60           HB2      RCY  60  71.959  -5.857  -7.242
  462    HA   RCY  60           HA       RCY  60  73.431  -8.183  -8.374
  463    HN1  RCY  60           HN1      RCY  60  71.187  -8.479  -8.991
  464    H    GLY  61           HN       GLY  61  72.048  -7.116  -5.294
  465    HA2  GLY  61           HA2      GLY  61  72.768  -9.676  -4.009
  466    HA3  GLY  61           HA1      GLY  61  73.644  -8.245  -3.456
  467    H    THR  62           HN       THR  62  70.250  -8.594  -4.447
  468    HA   THR  62           HA       THR  62  68.297  -7.893  -3.354
  469    HB   THR  62           HB       THR  62  68.201  -8.647  -0.923
  470    HG1  THR  62           HG1      THR  62  70.067 -10.146  -0.549
  471   HG21  THR  62          HG21      THR  62  68.906 -10.453  -3.226
  472   HG22  THR  62          HG22      THR  62  67.334 -10.181  -2.476
  473   HG23  THR  62          HG23      THR  62  68.561 -11.125  -1.633
  474    H    ASP  63           HN       ASP  63  70.627  -5.996  -3.465
  475    HA   ASP  63           HA       ASP  63  70.738  -4.527  -1.003
  476    HB2  ASP  63           HB2      ASP  63  71.472  -2.619  -2.516
  477    HB3  ASP  63           HB1      ASP  63  72.430  -4.093  -2.657
  478    H    ILE  64           HN       ILE  64  68.257  -4.907  -0.764
  479    HA   ILE  64           HA       ILE  64  66.908  -2.380  -1.506
  480    HB   ILE  64           HB       ILE  64  65.940  -5.154  -2.223
  481   HG12  ILE  64          HG12      ILE  64  66.035  -2.578  -3.822
  482   HG13  ILE  64          HG11      ILE  64  67.304  -3.803  -3.859
  483   HG21  ILE  64          HG21      ILE  64  64.378  -2.601  -1.814
  484   HG22  ILE  64          HG22      ILE  64  64.042  -4.202  -1.157
  485   HG23  ILE  64          HG23      ILE  64  63.797  -3.885  -2.874
  486   HD11  ILE  64          HD11      ILE  64  65.675  -5.481  -4.632
  487   HD12  ILE  64          HD12      ILE  64  65.720  -4.104  -5.733
  488   HD13  ILE  64          HD13      ILE  64  64.395  -4.269  -4.581
  489    H    THR  65           HN       THR  65  67.153  -5.288   0.399
  490    HA   THR  65           HA       THR  65  65.526  -3.965   2.536
  491    HB   THR  65           HB       THR  65  65.515  -6.923   1.869
  492    HG1  THR  65           HG1      THR  65  64.206  -6.220   0.377
  493   HG21  THR  65          HG21      THR  65  64.065  -5.207   3.890
  494   HG22  THR  65          HG22      THR  65  65.081  -6.616   4.194
  495   HG23  THR  65          HG23      THR  65  63.500  -6.814   3.436
  496    H    VAL  66           HN       VAL  66  68.137  -6.146   1.628
  497    HA   VAL  66           HA       VAL  66  68.939  -6.653   4.382
  498    HB   VAL  66           HB       VAL  66  71.121  -7.399   3.068
  499   HG11  VAL  66          HG11      VAL  66  69.612  -8.957   4.171
  500   HG12  VAL  66          HG12      VAL  66  69.969  -9.564   2.554
  501   HG13  VAL  66          HG13      VAL  66  68.426  -8.775   2.879
  502   HG21  VAL  66          HG21      VAL  66  69.058  -7.550   0.864
  503   HG22  VAL  66          HG22      VAL  66  70.793  -7.844   0.756
  504   HG23  VAL  66          HG23      VAL  66  70.190  -6.202   0.983
  505    H    ILE  67           HN       ILE  67  70.210  -4.575   1.724
  506    HA   ILE  67           HA       ILE  67  71.508  -2.958   3.888
  507    HB   ILE  67           HB       ILE  67  72.848  -3.611   1.256
  508   HG12  ILE  67          HG12      ILE  67  73.542  -4.664   4.011
  509   HG13  ILE  67          HG11      ILE  67  72.563  -5.571   2.857
  510   HG21  ILE  67          HG21      ILE  67  73.761  -2.216   3.790
  511   HG22  ILE  67          HG22      ILE  67  73.548  -1.481   2.201
  512   HG23  ILE  67          HG23      ILE  67  74.831  -2.663   2.461
  513   HD11  ILE  67          HD11      ILE  67  74.336  -5.883   1.387
  514   HD12  ILE  67          HD12      ILE  67  75.184  -5.913   2.933
  515   HD13  ILE  67          HD13      ILE  67  75.191  -4.448   1.953
  516    H1U  RCY  68           H1U      RCY  68  73.125   1.419  -1.132
  517    H1S  RCY  68           H1S      RCY  68  70.053  -1.391  -0.275
  518    HB1  RCY  68           HB1      RCY  68  67.698   0.911   1.577
  519    HB2  RCY  68           HB2      RCY  68  67.625  -0.470   2.659
  520    HA   RCY  68           HA       RCY  68  70.158   0.296   1.191
  521    HN1  RCY  68           HN1      RCY  68  69.816  -1.426   3.608
  522    HA   PRO  69           HA       PRO  69  70.954   3.926   3.597
  523    HB2  PRO  69           HB2      PRO  69  68.026   4.619   3.509
  524    HB3  PRO  69           HB1      PRO  69  69.436   5.691   3.358
  525    HG2  PRO  69           HG2      PRO  69  68.128   4.844   1.208
  526    HG3  PRO  69           HG1      PRO  69  69.896   4.967   1.200
  527    HD2  PRO  69           HD2      PRO  69  68.193   2.530   1.235
  528    HD3  PRO  69           HD1      PRO  69  69.868   2.727   0.673
  529    H    TRP  70           HN       TRP  70  68.035   2.151   4.694
  530    HA   TRP  70           HA       TRP  70  68.349   3.142   7.419
  531    HD1  TRP  70           HD1      TRP  70  68.217  -0.716   6.253
  532    HE1  TRP  70           HE1      TRP  70  67.153  -1.978   4.274
  533    HE3  TRP  70           HE3      TRP  70  64.268   2.366   5.263
  534    HZ2  TRP  70           HZ2      TRP  70  64.918  -1.715   2.502
  535    HZ3  TRP  70           HZ3      TRP  70  62.691   1.839   3.430
  536    HH2  TRP  70           HH2      TRP  70  63.008  -0.193   2.049
  537    HB2  TRP  70           HB2      TRP  70  66.731   1.227   7.961
  538    HB3  TRP  70           HB1      TRP  70  66.133   2.493   6.896
  539    H    GLU  71           HN       GLU  71  70.440   1.455   5.783
  540    HA   GLU  71           HA       GLU  71  71.321  -0.115   8.152
  541    HB2  GLU  71           HB2      GLU  71  70.732  -1.148   5.398
  542    HB3  GLU  71           HB1      GLU  71  72.123  -1.819   6.248
  543    HG2  GLU  71           HG2      GLU  71  69.626  -1.585   7.839
  544    HG3  GLU  71           HG1      GLU  71  69.605  -2.784   6.545
  545    H    ALA  72           HN       ALA  72  71.928   2.273   6.054
  546    HA   ALA  72           HA       ALA  72  74.527   1.816   5.030
  547    HB1  ALA  72           HB1      ALA  72  73.295   3.738   4.284
  548    HB2  ALA  72           HB2      ALA  72  74.727   4.341   5.120
  549    HB3  ALA  72           HB3      ALA  72  73.160   4.363   5.928
  550    H1U  RCY  73           H1U      RCY  73  75.800   1.765   3.107
  551    H1S  RCY  73           H1S      RCY  73  74.527  -1.284   6.680
  552    HB1  RCY  73           HB1      RCY  73  77.651   0.019   9.653
  553    HB2  RCY  73           HB2      RCY  73  78.041  -0.028   7.935
  554    HA   RCY  73           HA       RCY  73  76.083   1.759   9.370
  555    HN1  RCY  73           HN1      RCY  73  75.580   0.639   6.787
  556    H    ASN  74           HN       ASN  74  76.689   3.374   6.747
  557    HA   ASN  74           HA       ASN  74  78.204   5.066   6.175
  558    HB2  ASN  74           HB2      ASN  74  78.006   5.424   8.742
  559    HB3  ASN  74           HB1      ASN  74  79.577   4.628   8.828
  560   HD21  ASN  74          HD21      ASN  74  79.999   5.899   5.951
  561   HD22  ASN  74          HD22      ASN  74  80.523   7.469   6.325
  562    H    HIS  75           HN       HIS  75  80.995   4.595   7.744
  563    HA   HIS  75           HA       HIS  75  82.089   2.941   5.529
  564    HD1  HIS  75           HD1      HIS  75  83.802   1.780   5.373
  565    HD2  HIS  75           HD2      HIS  75  86.145   5.192   5.885
  566    HE1  HIS  75           HE1      HIS  75  86.018   1.302   4.243
  567    HE2  HIS  75           HE2      HIS  75  87.453   3.372   4.547
  568    HB2  HIS  75           HB2      HIS  75  83.092   5.196   6.179
  569    HB3  HIS  75           HB1      HIS  75  83.647   4.418   7.662
  570    H1U  RCY  76           H1U      RCY  76  78.256  -5.150   4.733
  571    H1S  RCY  76           H1S      RCY  76  81.318  -2.889   6.449
  572    HB1  RCY  76           HB1      RCY  76  82.091  -1.605   8.820
  573    HB2  RCY  76           HB2      RCY  76  83.414  -0.566   8.290
  574    HA   RCY  76           HA       RCY  76  80.794   0.189   9.554
  575    HN1  RCY  76           HN1      RCY  76  80.668   2.121   8.222
  576    H    GLU  77           HN       GLU  77  83.949   1.768   9.002
  577    HA   GLU  77           HA       GLU  77  84.947   1.116  11.643
  578    HB2  GLU  77           HB2      GLU  77  86.318   1.740   9.557
  579    HB3  GLU  77           HB1      GLU  77  85.895   3.413   9.921
  580    HG2  GLU  77           HG2      GLU  77  87.982   3.059  11.007
  581    HG3  GLU  77           HG1      GLU  77  86.776   2.954  12.290
  582    H    LEU  78           HN       LEU  78  83.264   3.883  10.218
  583    HA   LEU  78           HA       LEU  78  83.364   5.332  12.805
  584    HG   LEU  78           HG       LEU  78  84.378   7.284  12.039
  585    HB2  LEU  78           HB2      LEU  78  82.510   6.033  10.000
  586    HB3  LEU  78           HB1      LEU  78  81.999   7.032  11.358
  587   HD11  LEU  78          HD11      LEU  78  85.400   5.312  11.181
  588   HD12  LEU  78          HD12      LEU  78  86.066   6.630  10.217
  589   HD13  LEU  78          HD13      LEU  78  84.787   5.611   9.554
  590   HD21  LEU  78          HD21      LEU  78  85.061   8.585   9.890
  591   HD22  LEU  78          HD22      LEU  78  83.598   9.089  10.736
  592   HD23  LEU  78          HD23      LEU  78  83.479   8.103   9.279
  593    H    HIS  79           HN       HIS  79  80.686   4.942  10.477
  594    HA   HIS  79           HA       HIS  79  78.548   3.991  10.806
  595    HD1  HIS  79           HD1      HIS  79  76.445   3.799  11.770
  596    HD2  HIS  79           HD2      HIS  79  78.255   0.305  13.154
  597    HE1  HIS  79           HE1      HIS  79  74.695   1.975  11.610
  598    HE2  HIS  79           HE2      HIS  79  75.784  -0.157  12.450
  599    HB2  HIS  79           HB2      HIS  79  79.891   2.584  12.626
  600    HB3  HIS  79           HB1      HIS  79  78.991   3.610  13.743
  601    H    GLU  80           HN       GLU  80  79.209   6.818  11.078
  602    HA   GLU  80           HA       GLU  80  76.717   7.711  12.195
  603    HB2  GLU  80           HB2      GLU  80  77.326   8.732  14.204
  604    HB3  GLU  80           HB1      GLU  80  78.264   7.244  14.255
  605    HG2  GLU  80           HG2      GLU  80  79.267   9.967  13.366
  606    HG3  GLU  80           HG1      GLU  80  79.710   9.125  14.851
  607    H    LEU  81           HN       LEU  81  79.512   8.131  10.408
  608    HA   LEU  81           HA       LEU  81  79.089  11.059  10.071
  609    HG   LEU  81           HG       LEU  81  82.554  11.580   9.602
  610    HB2  LEU  81           HB2      LEU  81  81.397   9.472  10.149
  611    HB3  LEU  81           HB1      LEU  81  81.205   9.855   8.443
  612   HD11  LEU  81          HD11      LEU  81  80.794  12.053   7.726
  613   HD12  LEU  81          HD12      LEU  81  81.491  13.416   8.602
  614   HD13  LEU  81          HD13      LEU  81  79.880  12.832   9.018
  615   HD21  LEU  81          HD21      LEU  81  81.930  12.521  11.577
  616   HD22  LEU  81          HD22      LEU  81  80.835  11.144  11.706
  617   HD23  LEU  81          HD23      LEU  81  80.248  12.681  11.071
  618    H    ALA  82           HN       ALA  82  77.477   8.613   8.975
  619    HA   ALA  82           HA       ALA  82  77.790   8.674   6.113
  620    HB1  ALA  82           HB1      ALA  82  76.638   6.838   7.332
  621    HB2  ALA  82           HB2      ALA  82  75.628   7.522   6.059
  622    HB3  ALA  82           HB3      ALA  82  75.335   7.953   7.743
  623    H    GLN  83           HN       GLN  83  77.288  11.273   7.781
  624    HA   GLN  83           HA       GLN  83  74.820  12.425   7.053
  625    HB2  GLN  83           HB2      GLN  83  76.646  13.416   8.548
  626    HB3  GLN  83           HB1      GLN  83  77.441  13.936   7.062
  627    HG2  GLN  83           HG2      GLN  83  76.087  15.778   7.814
  628    HG3  GLN  83           HG1      GLN  83  75.273  15.076   6.416
  629   HE21  GLN  83          HE21      GLN  83  73.347  16.237   7.592
  630   HE22  GLN  83          HE22      GLN  83  72.503  15.315   8.740
  631    H    TYR  84           HN       TYR  84  77.806  12.075   5.183
  632    HA   TYR  84           HA       TYR  84  76.303  12.393   2.695
  633    HD1  TYR  84           HD1      TYR  84  79.749  13.377   4.305
  634    HD2  TYR  84           HD2      TYR  84  76.606  16.305   4.292
  635    HE1  TYR  84           HE1      TYR  84  80.703  14.410   6.347
  636    HE2  TYR  84           HE2      TYR  84  77.561  17.339   6.334
  637    HH   TYR  84           HH       TYR  84  80.394  15.922   7.957
  638    HB2  TYR  84           HB2      TYR  84  78.247  14.222   2.113
  639    HB3  TYR  84           HB1      TYR  84  76.626  14.662   2.650
  640    H    GLY  85           HN       GLY  85  78.925  11.315   4.525
  641    HA2  GLY  85           HA2      GLY  85  80.633   9.795   3.994
  642    HA3  GLY  85           HA1      GLY  85  79.879   9.604   2.411
  643    H    ILE  86           HN       ILE  86  82.204  11.495   4.262
  644    HA   ILE  86           HA       ILE  86  82.968  13.081   1.899
  645    HB   ILE  86           HB       ILE  86  84.877  13.756   3.594
  646   HG12  ILE  86          HG12      ILE  86  84.208  13.455   5.936
  647   HG13  ILE  86          HG11      ILE  86  82.771  12.565   5.429
  648   HG21  ILE  86          HG21      ILE  86  83.188  15.332   2.964
  649   HG22  ILE  86          HG22      ILE  86  83.204  15.312   4.727
  650   HG23  ILE  86          HG23      ILE  86  81.942  14.450   3.847
  651   HD11  ILE  86          HD11      ILE  86  85.535  11.672   4.611
  652   HD12  ILE  86          HD12      ILE  86  84.042  10.734   4.637
  653   HD13  ILE  86          HD13      ILE  86  84.830  11.179   6.151
  654    H1U  RCY  87           H1U      RCY  87  86.026   1.136   0.963
  655    H1S  RCY  87           H1S      RCY  87  86.003   4.939   2.275
  656    HB1  RCY  87           HB1      RCY  87  83.822   7.858   1.482
  657    HB2  RCY  87           HB2      RCY  87  84.786   7.699   2.949
  658    HA   RCY  87           HA       RCY  87  86.189   9.542   2.331
  659    HN1  RCY  87           HN1      RCY  87  83.346   9.987   2.414
  Start of MODEL   64
    1    HA   MET   1           HA       MET   1  58.925   7.539  -1.575
    2    HB2  MET   1           HB2      MET   1  60.783   9.677  -2.664
    3    HB3  MET   1           HB1      MET   1  60.976   8.809  -1.140
    4    HG2  MET   1           HG2      MET   1  62.394   7.672  -2.671
    5    HG3  MET   1           HG1      MET   1  60.954   6.661  -2.549
    6    HE1  MET   1           HE1      MET   1  61.205   5.393  -4.497
    7    HE2  MET   1           HE2      MET   1  60.504   5.894  -6.034
    8    HE3  MET   1           HE3      MET   1  59.528   5.948  -4.569
    9    H    ASN   2           HN       ASN   2  58.303  10.643  -3.152
   10    HA   ASN   2           HA       ASN   2  57.056  11.590  -0.596
   11    HB2  ASN   2           HB2      ASN   2  58.658  13.166  -2.631
   12    HB3  ASN   2           HB1      ASN   2  57.692  13.910  -1.357
   13   HD21  ASN   2          HD21      ASN   2  58.722  11.084   0.004
   14   HD22  ASN   2          HD22      ASN   2  60.162  11.615   0.729
   15    H    LEU   3           HN       LEU   3  57.109  13.169  -3.763
   16    HA   LEU   3           HA       LEU   3  54.394  12.283  -4.419
   17    HG   LEU   3           HG       LEU   3  52.903  13.853  -5.328
   18    HB2  LEU   3           HB2      LEU   3  54.067  14.098  -2.699
   19    HB3  LEU   3           HB1      LEU   3  54.868  15.214  -3.803
   20   HD11  LEU   3          HD11      LEU   3  51.746  15.007  -2.775
   21   HD12  LEU   3          HD12      LEU   3  51.903  13.279  -3.090
   22   HD13  LEU   3          HD13      LEU   3  50.853  14.268  -4.105
   23   HD21  LEU   3          HD21      LEU   3  51.892  16.159  -5.399
   24   HD22  LEU   3          HD22      LEU   3  53.621  16.135  -5.743
   25   HD23  LEU   3          HD23      LEU   3  53.045  16.648  -4.157
   26    H    GLU   4           HN       GLU   4  57.409  13.585  -5.200
   27    HA   GLU   4           HA       GLU   4  56.713  14.876  -7.700
   28    HB2  GLU   4           HB2      GLU   4  59.261  13.918  -6.416
   29    HB3  GLU   4           HB1      GLU   4  59.272  14.388  -8.115
   30    HG2  GLU   4           HG2      GLU   4  58.111  16.169  -5.966
   31    HG3  GLU   4           HG1      GLU   4  59.813  16.238  -6.425
   32    HA   PRO   5           HA       PRO   5  56.102  11.423 -10.370
   33    HB2  PRO   5           HB2      PRO   5  57.650  12.188 -12.570
   34    HB3  PRO   5           HB1      PRO   5  55.983  12.704 -12.255
   35    HG2  PRO   5           HG2      PRO   5  58.531  14.136 -11.745
   36    HG3  PRO   5           HG1      PRO   5  56.958  14.768 -12.260
   37    HD2  PRO   5           HD2      PRO   5  57.838  15.043  -9.710
   38    HD3  PRO   5           HD1      PRO   5  56.114  14.822 -10.088
   39    HA   PRO   6           HA       PRO   6  60.006   9.245  -9.478
   40    HB2  PRO   6           HB2      PRO   6  58.948   6.797  -9.046
   41    HB3  PRO   6           HB1      PRO   6  58.811   8.100  -7.848
   42    HG2  PRO   6           HG2      PRO   6  56.782   7.087  -9.769
   43    HG3  PRO   6           HG1      PRO   6  56.580   7.648  -8.102
   44    HD2  PRO   6           HD2      PRO   6  56.037   9.175 -10.376
   45    HD3  PRO   6           HD1      PRO   6  56.318   9.834  -8.749
   46    H    LYS   7           HN       LYS   7  61.335   7.895 -10.761
   47    HA   LYS   7           HA       LYS   7  60.512   7.548 -13.530
   48    HB2  LYS   7           HB2      LYS   7  62.797   6.284 -13.592
   49    HB3  LYS   7           HB1      LYS   7  62.803   8.023 -13.297
   50    HG2  LYS   7           HG2      LYS   7  63.172   7.748 -10.978
   51    HG3  LYS   7           HG1      LYS   7  62.688   6.052 -11.016
   52    HD2  LYS   7           HD2      LYS   7  65.123   6.204 -10.843
   53    HD3  LYS   7           HD1      LYS   7  64.682   5.544 -12.418
   54    HE2  LYS   7           HE2      LYS   7  66.464   7.364 -12.457
   55    HE3  LYS   7           HE1      LYS   7  65.075   7.640 -13.508
   56    HZ1  LYS   7           HZ1      LYS   7  64.124   9.104 -11.910
   57    HZ2  LYS   7           HZ2      LYS   7  65.732   9.593 -12.157
   58    HZ3  LYS   7           HZ3      LYS   7  65.310   8.727 -10.758
   59    H    ALA   8           HN       ALA   8  58.737   6.077 -13.423
   60    HA   ALA   8           HA       ALA   8  58.867   3.547 -12.061
   61    HB1  ALA   8           HB1      ALA   8  56.717   4.511 -12.682
   62    HB2  ALA   8           HB2      ALA   8  56.906   2.960 -13.499
   63    HB3  ALA   8           HB3      ALA   8  57.153   4.462 -14.391
   64    H    GLU   9           HN       GLU   9  60.210   1.911 -12.602
   65    HA   GLU   9           HA       GLU   9  60.573   1.243 -15.478
   66    HB2  GLU   9           HB2      GLU   9  62.765   1.856 -13.491
   67    HB3  GLU   9           HB1      GLU   9  63.057   0.811 -14.882
   68    HG2  GLU   9           HG2      GLU   9  61.839   3.566 -15.154
   69    HG3  GLU   9           HG1      GLU   9  63.580   3.290 -15.223
   70    H1U  RCY  10           H1U      RCY  10  61.098  -2.653  -8.949
   71    H1S  RCY  10           H1S      RCY  10  58.587  -4.657 -12.536
   72    HB1  RCY  10           HB1      RCY  10  61.524  -3.123 -13.999
   73    HB2  RCY  10           HB2      RCY  10  60.578  -2.901 -15.472
   74    HA   RCY  10           HA       RCY  10  58.558  -2.599 -13.856
   75    HN1  RCY  10           HN1      RCY  10  59.001  -0.420 -14.603
   76    H    ARG  11           HN       ARG  11  59.532  -4.300 -12.117
   77    HA   ARG  11           HA       ARG  11  59.759  -4.614  -9.800
   78    HE   ARG  11           HE       ARG  11  61.384  -5.185  -5.809
   79    HB2  ARG  11           HB2      ARG  11  62.114  -3.774 -10.757
   80    HB3  ARG  11           HB1      ARG  11  61.775  -2.400  -9.708
   81    HG2  ARG  11           HG2      ARG  11  61.768  -5.308  -8.846
   82    HG3  ARG  11           HG1      ARG  11  63.048  -4.144  -8.504
   83    HD2  ARG  11           HD2      ARG  11  61.296  -2.707  -7.365
   84    HD3  ARG  11           HD1      ARG  11  60.185  -4.068  -7.521
   85   HH11  ARG  11          HH21      ARG  11  63.066  -2.441  -7.043
   86   HH12  ARG  11          HH22      ARG  11  64.288  -2.471  -5.817
   87   HH21  ARG  11          HH11      ARG  11  62.971  -5.242  -4.200
   88   HH22  ARG  11          HH12      ARG  11  64.235  -4.057  -4.207
   89    H    SER  12           HN       SER  12  57.536  -3.434  -9.835
   90    HA   SER  12           HA       SER  12  57.659  -1.325  -7.780
   91    HG   SER  12           HG       SER  12  55.405   0.803  -9.791
   92    HB2  SER  12           HB2      SER  12  57.665   0.169  -9.594
   93    HB3  SER  12           HB1      SER  12  56.652  -0.878 -10.583
   94    H    ALA  13           HN       ALA  13  55.815  -3.556  -9.779
   95    HA   ALA  13           HA       ALA  13  53.311  -3.220  -8.374
   96    HB1  ALA  13           HB1      ALA  13  54.273  -5.666  -9.885
   97    HB2  ALA  13           HB2      ALA  13  53.564  -4.251 -10.662
   98    HB3  ALA  13           HB3      ALA  13  52.602  -5.218  -9.544
   99    H    THR  14           HN       THR  14  56.144  -4.146  -7.130
  100    HA   THR  14           HA       THR  14  55.362  -6.574  -5.714
  101    HB   THR  14           HB       THR  14  57.596  -4.744  -4.848
  102    HG1  THR  14           HG1      THR  14  58.825  -6.029  -6.443
  103   HG21  THR  14          HG21      THR  14  57.144  -6.746  -3.511
  104   HG22  THR  14          HG22      THR  14  58.676  -6.927  -4.366
  105   HG23  THR  14          HG23      THR  14  57.234  -7.752  -4.956
  106    H    ARG  15           HN       ARG  15  53.654  -4.123  -5.461
  107    HA   ARG  15           HA       ARG  15  52.506  -2.964  -3.772
  108    HE   ARG  15           HE       ARG  15  50.357  -6.220  -1.945
  109    HB2  ARG  15           HB2      ARG  15  52.255  -5.442  -3.098
  110    HB3  ARG  15           HB1      ARG  15  53.513  -5.117  -1.906
  111    HG2  ARG  15           HG2      ARG  15  51.639  -4.624  -0.638
  112    HG3  ARG  15           HG1      ARG  15  51.950  -3.036  -1.341
  113    HD2  ARG  15           HD2      ARG  15  49.599  -3.527  -1.635
  114    HD3  ARG  15           HD1      ARG  15  50.377  -3.641  -3.214
  115   HH11  ARG  15          HH21      ARG  15  48.375  -3.857  -3.486
  116   HH12  ARG  15          HH22      ARG  15  47.228  -5.012  -4.078
  117   HH21  ARG  15          HH11      ARG  15  48.870  -7.742  -2.709
  118   HH22  ARG  15          HH12      ARG  15  47.508  -7.211  -3.638
  119    H    VAL  16           HN       VAL  16  55.086  -1.982  -4.268
  120    HA   VAL  16           HA       VAL  16  56.823  -0.739  -3.288
  121    HB   VAL  16           HB       VAL  16  55.184  -0.242  -0.847
  122   HG11  VAL  16          HG11      VAL  16  55.963   1.952  -1.121
  123   HG12  VAL  16          HG12      VAL  16  56.154   1.769  -2.865
  124   HG13  VAL  16          HG13      VAL  16  57.297   0.996  -1.766
  125   HG21  VAL  16          HG21      VAL  16  54.214   0.214  -3.664
  126   HG22  VAL  16          HG22      VAL  16  53.740   1.315  -2.370
  127   HG23  VAL  16          HG23      VAL  16  53.318  -0.394  -2.273
  128    H    MET  17           HN       MET  17  57.894  -0.430  -0.862
  129    HA   MET  17           HA       MET  17  59.230  -2.782  -0.242
  130    HB2  MET  17           HB2      MET  17  59.026  -1.609   2.262
  131    HB3  MET  17           HB1      MET  17  60.226  -1.193   1.042
  132    HG2  MET  17           HG2      MET  17  57.511   0.087   0.922
  133    HG3  MET  17           HG1      MET  17  58.704   0.696   2.070
  134    HE1  MET  17           HE1      MET  17  58.524   2.854   1.143
  135    HE2  MET  17           HE2      MET  17  59.605   3.453  -0.113
  136    HE3  MET  17           HE3      MET  17  60.275   2.691   1.328
  137    H    GLY  18           HN       GLY  18  55.935  -2.053   0.401
  138    HA2  GLY  18           HA2      GLY  18  54.469  -3.991   0.912
  139    HA3  GLY  18           HA1      GLY  18  55.723  -4.567   2.010
  140    H    GLY  19           HN       GLY  19  53.307  -4.381   3.129
  141    HA2  GLY  19           HA2      GLY  19  52.760  -1.756   4.260
  142    HA3  GLY  19           HA1      GLY  19  51.982  -3.267   4.730
  143    HA   PRO  20           HA       PRO  20  54.443  -4.238   8.276
  144    HB2  PRO  20           HB2      PRO  20  56.558  -5.581   6.622
  145    HB3  PRO  20           HB1      PRO  20  55.786  -6.133   8.123
  146    HG2  PRO  20           HG2      PRO  20  55.068  -7.107   5.751
  147    HG3  PRO  20           HG1      PRO  20  53.882  -6.834   7.037
  148    HD2  PRO  20           HD2      PRO  20  54.278  -5.328   4.509
  149    HD3  PRO  20           HD1      PRO  20  52.821  -5.480   5.516
  150    H1U  RCY  21           H1U      RCY  21  63.283   0.201   3.125
  151    H1S  RCY  21           H1S      RCY  21  61.333  -2.439   5.474
  152    HB1  RCY  21           HB1      RCY  21  59.547  -1.232   5.217
  153    HB2  RCY  21           HB2      RCY  21  58.070  -1.731   4.396
  154    HA   RCY  21           HA       RCY  21  58.710  -2.268   7.312
  155    HN1  RCY  21           HN1      RCY  21  56.752  -3.491   5.632
  156    H    THR  22           HN       THR  22  58.561  -0.397   8.433
  157    HA   THR  22           HA       THR  22  56.525   1.620   7.565
  158    HB   THR  22           HB       THR  22  57.722   1.161  10.312
  159    HG1  THR  22           HG1      THR  22  55.320   0.645  10.558
  160   HG21  THR  22          HG21      THR  22  57.109   3.457  10.122
  161   HG22  THR  22          HG22      THR  22  55.763   2.673  10.949
  162   HG23  THR  22          HG23      THR  22  55.637   3.064   9.234
  163    HA   PRO  23           HA       PRO  23  60.509   3.797   6.978
  164    HB2  PRO  23           HB2      PRO  23  59.750   5.296   4.846
  165    HB3  PRO  23           HB1      PRO  23  60.228   3.595   4.689
  166    HG2  PRO  23           HG2      PRO  23  57.521   4.804   4.665
  167    HG3  PRO  23           HG1      PRO  23  58.146   3.412   3.769
  168    HD2  PRO  23           HD2      PRO  23  56.577   3.266   6.082
  169    HD3  PRO  23           HD1      PRO  23  57.573   1.947   5.433
  170    H    ARG  24           HN       ARG  24  60.613   5.233   8.701
  171    HA   ARG  24           HA       ARG  24  59.371   7.865   8.345
  172    HE   ARG  24           HE       ARG  24  56.106  10.329   8.614
  173    HB2  ARG  24           HB2      ARG  24  57.796   6.121   9.659
  174    HB3  ARG  24           HB1      ARG  24  58.803   6.634  11.010
  175    HG2  ARG  24           HG2      ARG  24  57.127   8.245  11.091
  176    HG3  ARG  24           HG1      ARG  24  58.305   9.053  10.056
  177    HD2  ARG  24           HD2      ARG  24  57.112   8.240   8.056
  178    HD3  ARG  24           HD1      ARG  24  55.935   7.426   9.087
  179   HH11  ARG  24          HH21      ARG  24  54.911   7.680  10.469
  180   HH12  ARG  24          HH22      ARG  24  53.574   8.567  11.122
  181   HH21  ARG  24          HH11      ARG  24  54.368  11.503   9.456
  182   HH22  ARG  24          HH12      ARG  24  53.267  10.732  10.549
  183    H    LYS  25           HN       LYS  25  62.079   6.987   8.401
  184    HA   LYS  25           HA       LYS  25  64.122   7.366   9.513
  185    HB2  LYS  25           HB2      LYS  25  62.547   9.698  10.643
  186    HB3  LYS  25           HB1      LYS  25  64.302   9.580  10.527
  187    HG2  LYS  25           HG2      LYS  25  64.132  10.551   8.494
  188    HG3  LYS  25           HG1      LYS  25  63.394   9.052   7.930
  189    HD2  LYS  25           HD2      LYS  25  61.822  10.739   7.370
  190    HD3  LYS  25           HD1      LYS  25  61.180  10.000   8.837
  191    HE2  LYS  25           HE2      LYS  25  62.539  11.844  10.080
  192    HE3  LYS  25           HE1      LYS  25  62.558  12.658   8.515
  193    HZ1  LYS  25           HZ1      LYS  25  60.301  12.937   8.525
  194    HZ2  LYS  25           HZ2      LYS  25  60.629  13.072  10.186
  195    HZ3  LYS  25           HZ3      LYS  25  60.016  11.619   9.554
  196    H    GLY  26           HN       GLY  26  62.082   5.693  10.919
  197    HA2  GLY  26           HA2      GLY  26  62.154   6.349  13.730
  198    HA3  GLY  26           HA1      GLY  26  61.720   4.778  13.056
  199    HA   PRO  27           HA       PRO  27  65.697   2.991  13.728
  200    HB2  PRO  27           HB2      PRO  27  66.758   3.257  10.975
  201    HB3  PRO  27           HB1      PRO  27  66.389   1.791  11.900
  202    HG2  PRO  27           HG2      PRO  27  64.894   2.611   9.827
  203    HG3  PRO  27           HG1      PRO  27  64.217   1.742  11.214
  204    HD2  PRO  27           HD2      PRO  27  64.050   4.659  10.554
  205    HD3  PRO  27           HD1      PRO  27  62.850   3.609  11.341
  206    HA   PRO  28           HA       PRO  28  69.091   5.727  14.448
  207    HB2  PRO  28           HB2      PRO  28  70.883   4.234  12.577
  208    HB3  PRO  28           HB1      PRO  28  71.134   4.658  14.282
  209    HG2  PRO  28           HG2      PRO  28  70.512   2.178  13.542
  210    HG3  PRO  28           HG1      PRO  28  69.884   2.883  15.042
  211    HD2  PRO  28           HD2      PRO  28  68.464   2.381  12.459
  212    HD3  PRO  28           HD1      PRO  28  67.832   2.350  14.120
  213    H    LYS  29           HN       LYS  29  69.406   7.760  13.626
  214    HA   LYS  29           HA       LYS  29  68.810   8.344  10.849
  215    HB2  LYS  29           HB2      LYS  29  69.810   9.965  13.189
  216    HB3  LYS  29           HB1      LYS  29  69.753  10.664  11.570
  217    HG2  LYS  29           HG2      LYS  29  67.386  10.336  11.413
  218    HG3  LYS  29           HG1      LYS  29  67.365   9.317  12.852
  219    HD2  LYS  29           HD2      LYS  29  67.741  11.139  14.299
  220    HD3  LYS  29           HD1      LYS  29  68.334  12.168  12.994
  221    HE2  LYS  29           HE2      LYS  29  65.913  12.558  13.885
  222    HE3  LYS  29           HE1      LYS  29  66.180  12.549  12.142
  223    HZ1  LYS  29           HZ1      LYS  29  64.273  11.170  12.932
  224    HZ2  LYS  29           HZ2      LYS  29  65.397  10.139  13.681
  225    HZ3  LYS  29           HZ3      LYS  29  65.411  10.332  11.993
  226    H1U  RCY  30           H1U      RCY  30  71.846   4.561   2.713
  227    H1S  RCY  30           H1S      RCY  30  73.442   5.986   7.052
  228    HB1  RCY  30           HB1      RCY  30  73.144   6.871  10.215
  229    HB2  RCY  30           HB2      RCY  30  73.860   7.022   8.611
  230    HA   RCY  30           HA       RCY  30  73.068   9.208   9.563
  231    HN1  RCY  30           HN1      RCY  30  70.254   8.742   9.169
  232    H    LYS  31           HN       LYS  31  70.290   8.882   7.666
  233    HA   LYS  31           HA       LYS  31  69.846   9.327   5.402
  234    HB2  LYS  31           HB2      LYS  31  72.139  11.088   6.162
  235    HB3  LYS  31           HB1      LYS  31  71.763  10.955   4.446
  236    HG2  LYS  31           HG2      LYS  31  70.509  12.821   5.402
  237    HG3  LYS  31           HG1      LYS  31  69.388  11.532   4.959
  238    HD2  LYS  31           HD2      LYS  31  68.809  12.361   7.178
  239    HD3  LYS  31           HD1      LYS  31  69.452  10.724   7.324
  240    HE2  LYS  31           HE2      LYS  31  71.407  11.431   8.324
  241    HE3  LYS  31           HE1      LYS  31  71.390  12.989   7.498
  242    HZ1  LYS  31           HZ1      LYS  31  70.826  12.860  10.006
  243    HZ2  LYS  31           HZ2      LYS  31  69.296  12.359   9.464
  244    HZ3  LYS  31           HZ3      LYS  31  69.912  13.872   8.996
  245    H    GLN  32           HN       GLN  32  71.012   9.288   3.120
  246    HA   GLN  32           HA       GLN  32  72.872   6.937   3.134
  247    HB2  GLN  32           HB2      GLN  32  70.563   6.653   2.091
  248    HB3  GLN  32           HB1      GLN  32  71.075   7.805   0.857
  249    HG2  GLN  32           HG2      GLN  32  72.912   6.367   0.193
  250    HG3  GLN  32           HG1      GLN  32  72.578   5.259   1.525
  251   HE21  GLN  32          HE21      GLN  32  69.742   6.590   0.068
  252   HE22  GLN  32          HE22      GLN  32  69.324   5.238  -0.869
  253    H    ARG  33           HN       ARG  33  74.335   9.051   3.494
  254    HA   ARG  33           HA       ARG  33  75.830   9.390   1.053
  255    HE   ARG  33           HE       ARG  33  71.689  11.015   2.288
  256    HB2  ARG  33           HB2      ARG  33  75.469  11.812   0.749
  257    HB3  ARG  33           HB1      ARG  33  73.965  10.918   0.526
  258    HG2  ARG  33           HG2      ARG  33  73.751  11.376   3.154
  259    HG3  ARG  33           HG1      ARG  33  74.767  12.756   2.738
  260    HD2  ARG  33           HD2      ARG  33  72.605  13.613   2.432
  261    HD3  ARG  33           HD1      ARG  33  73.054  13.119   0.800
  262   HH11  ARG  33          HH21      ARG  33  71.398  13.849   0.346
  263   HH12  ARG  33          HH22      ARG  33  69.821  13.444  -0.244
  264   HH21  ARG  33          HH11      ARG  33  69.632  10.469   1.527
  265   HH22  ARG  33          HH12      ARG  33  68.821  11.530   0.424
  266    H    GLN  34           HN       GLN  34  76.540   8.550   3.611
  267    HA   GLN  34           HA       GLN  34  77.509  10.502   5.400
  268    HB2  GLN  34           HB2      GLN  34  78.573   7.762   4.678
  269    HB3  GLN  34           HB1      GLN  34  79.259   8.737   5.978
  270    HG2  GLN  34           HG2      GLN  34  77.186   8.742   7.186
  271    HG3  GLN  34           HG1      GLN  34  76.315   8.053   5.816
  272   HE21  GLN  34          HE21      GLN  34  76.845   5.762   5.233
  273   HE22  GLN  34          HE22      GLN  34  77.470   4.720   6.419
  274    H    THR  35           HN       THR  35  78.485   9.889   2.195
  275    HA   THR  35           HA       THR  35  80.837  11.681   2.578
  276    HB   THR  35           HB       THR  35  80.969   9.324   0.700
  277    HG1  THR  35           HG1      THR  35  82.393   8.696   2.721
  278   HG21  THR  35          HG21      THR  35  83.037  11.044   2.097
  279   HG22  THR  35          HG22      THR  35  82.601  11.119   0.390
  280   HG23  THR  35          HG23      THR  35  83.405   9.687   1.033
  281    H    ARG  36           HN       ARG  36  78.390  12.568   1.686
  282    HA   ARG  36           HA       ARG  36  77.340  13.649  -0.109
  283    HE   ARG  36           HE       ARG  36  79.835  16.226  -2.212
  284    HB2  ARG  36           HB2      ARG  36  80.197  13.657  -1.128
  285    HB3  ARG  36           HB1      ARG  36  78.886  14.636  -1.785
  286    HG2  ARG  36           HG2      ARG  36  78.627  15.819   0.302
  287    HG3  ARG  36           HG1      ARG  36  79.751  14.730   1.116
  288    HD2  ARG  36           HD2      ARG  36  80.814  16.897   0.489
  289    HD3  ARG  36           HD1      ARG  36  81.588  15.516  -0.288
  290   HH11  ARG  36          HH21      ARG  36  81.864  18.096  -0.145
  291   HH12  ARG  36          HH22      ARG  36  82.068  19.382  -1.286
  292   HH21  ARG  36          HH11      ARG  36  80.089  17.895  -3.715
  293   HH22  ARG  36          HH12      ARG  36  81.063  19.269  -3.308
  294    H    GLN  37           HN       GLN  37  76.050  11.975  -0.925
  295    HA   GLN  37           HA       GLN  37  75.346  10.331  -2.444
  296    HB2  GLN  37           HB2      GLN  37  77.439  11.669  -4.185
  297    HB3  GLN  37           HB1      GLN  37  76.115  10.652  -4.753
  298    HG2  GLN  37           HG2      GLN  37  75.628  13.139  -3.107
  299    HG3  GLN  37           HG1      GLN  37  75.734  13.188  -4.867
  300   HE21  GLN  37          HE21      GLN  37  73.402  13.312  -2.681
  301   HE22  GLN  37          HE22      GLN  37  72.211  12.333  -3.388
  302    H1U  RCY  38           H1U      RCY  38  82.932   3.407   1.269
  303    H1S  RCY  38           H1S      RCY  38  79.140   4.725  -0.396
  304    HB1  RCY  38           HB1      RCY  38  77.878   5.350  -2.654
  305    HB2  RCY  38           HB2      RCY  38  76.494   6.376  -2.275
  306    HA   RCY  38           HA       RCY  38  79.022   7.653  -3.269
  307    HN1  RCY  38           HN1      RCY  38  76.357   8.583  -4.066
  308    H    LYS  39           HN       LYS  39  78.165   8.399  -5.769
  309    HA   LYS  39           HA       LYS  39  78.563   5.932  -7.267
  310    HB2  LYS  39           HB2      LYS  39  76.478   6.280  -8.669
  311    HB3  LYS  39           HB1      LYS  39  76.179   5.701  -7.030
  312    HG2  LYS  39           HG2      LYS  39  75.750   8.038  -6.304
  313    HG3  LYS  39           HG1      LYS  39  75.982   8.579  -7.967
  314    HD2  LYS  39           HD2      LYS  39  74.051   7.433  -8.728
  315    HD3  LYS  39           HD1      LYS  39  73.959   6.450  -7.266
  316    HE2  LYS  39           HE2      LYS  39  72.326   8.466  -7.505
  317    HE3  LYS  39           HE1      LYS  39  73.155   8.236  -5.965
  318    HZ1  LYS  39           HZ1      LYS  39  74.494  10.016  -6.307
  319    HZ2  LYS  39           HZ2      LYS  39  73.156  10.539  -7.215
  320    HZ3  LYS  39           HZ3      LYS  39  74.499   9.849  -7.995
  321    H    SER  40           HN       SER  40  78.860   9.195  -6.820
  322    HA   SER  40           HA       SER  40  78.924  10.116  -9.565
  323    HG   SER  40           HG       SER  40  80.536  13.063  -8.231
  324    HB2  SER  40           HB2      SER  40  78.668  11.825  -7.945
  325    HB3  SER  40           HB1      SER  40  79.977  11.196  -6.950
  326    H    LYS  41           HN       LYS  41  81.789  10.423  -7.527
  327    HA   LYS  41           HA       LYS  41  83.288   8.538  -9.244
  328    HB2  LYS  41           HB2      LYS  41  85.018  10.244  -9.771
  329    HB3  LYS  41           HB1      LYS  41  83.457  10.626 -10.495
  330    HG2  LYS  41           HG2      LYS  41  83.170  11.896  -8.123
  331    HG3  LYS  41           HG1      LYS  41  84.920  12.018  -8.312
  332    HD2  LYS  41           HD2      LYS  41  82.932  12.810 -10.458
  333    HD3  LYS  41           HD1      LYS  41  83.660  13.947  -9.323
  334    HE2  LYS  41           HE2      LYS  41  85.358  12.119 -11.021
  335    HE3  LYS  41           HE1      LYS  41  84.805  13.682 -11.621
  336    HZ1  LYS  41           HZ1      LYS  41  86.430  14.644 -10.497
  337    HZ2  LYS  41           HZ2      LYS  41  86.946  13.140  -9.898
  338    HZ3  LYS  41           HZ3      LYS  41  85.798  14.051  -9.039
  339    HA   PRO  42           HA       PRO  42  84.954   8.643  -4.973
  340    HB2  PRO  42           HB2      PRO  42  84.200   6.176  -4.192
  341    HB3  PRO  42           HB1      PRO  42  83.052   7.528  -4.215
  342    HG2  PRO  42           HG2      PRO  42  83.272   5.220  -6.032
  343    HG3  PRO  42           HG1      PRO  42  81.863   6.206  -5.618
  344    HD2  PRO  42           HD2      PRO  42  83.528   6.426  -7.954
  345    HD3  PRO  42           HD1      PRO  42  82.140   7.443  -7.510
  346    HA   PRO  43           HA       PRO  43  88.710   6.480  -5.950
  347    HB2  PRO  43           HB2      PRO  43  89.482   5.560  -3.453
  348    HB3  PRO  43           HB1      PRO  43  89.702   7.227  -4.017
  349    HG2  PRO  43           HG2      PRO  43  87.623   6.096  -2.223
  350    HG3  PRO  43           HG1      PRO  43  88.429   7.673  -2.171
  351    HD2  PRO  43           HD2      PRO  43  85.886   7.343  -3.121
  352    HD3  PRO  43           HD1      PRO  43  86.976   8.619  -3.707
  353    H    LYS  44           HN       LYS  44  89.462   4.358  -6.408
  354    HA   LYS  44           HA       LYS  44  87.604   2.151  -5.589
  355    HB2  LYS  44           HB2      LYS  44  87.888   2.966  -8.103
  356    HB3  LYS  44           HB1      LYS  44  89.330   1.955  -8.035
  357    HG2  LYS  44           HG2      LYS  44  87.587   0.247  -6.909
  358    HG3  LYS  44           HG1      LYS  44  86.456   1.168  -7.901
  359    HD2  LYS  44           HD2      LYS  44  89.010  -0.079  -8.956
  360    HD3  LYS  44           HD1      LYS  44  87.419  -0.831  -9.079
  361    HE2  LYS  44           HE2      LYS  44  86.583   0.985 -10.427
  362    HE3  LYS  44           HE1      LYS  44  88.043   1.934 -10.147
  363    HZ1  LYS  44           HZ1      LYS  44  88.951  -0.443 -11.136
  364    HZ2  LYS  44           HZ2      LYS  44  88.815   1.015 -11.998
  365    HZ3  LYS  44           HZ3      LYS  44  87.562  -0.132 -12.059
  366    H    LYS  45           HN       LYS  45  89.299   0.092  -6.662
  367    HA   LYS  45           HA       LYS  45  91.011  -1.323  -5.924
  368    HB2  LYS  45           HB2      LYS  45  92.320   0.683  -6.865
  369    HB3  LYS  45           HB1      LYS  45  92.518   1.192  -5.188
  370    HG2  LYS  45           HG2      LYS  45  93.731  -0.774  -4.622
  371    HG3  LYS  45           HG1      LYS  45  93.242  -1.595  -6.105
  372    HD2  LYS  45           HD2      LYS  45  95.550  -0.838  -6.333
  373    HD3  LYS  45           HD1      LYS  45  94.522   0.097  -7.419
  374    HE2  LYS  45           HE2      LYS  45  95.107   1.091  -4.637
  375    HE3  LYS  45           HE1      LYS  45  96.251   1.376  -5.949
  376    HZ1  LYS  45           HZ1      LYS  45  93.666   2.559  -5.471
  377    HZ2  LYS  45           HZ2      LYS  45  93.905   2.052  -7.074
  378    HZ3  LYS  45           HZ3      LYS  45  94.984   3.152  -6.359
  379    H    GLY  46           HN       GLY  46  89.293  -1.582  -4.094
  380    HA2  GLY  46           HA2      GLY  46  90.210  -0.491  -1.499
  381    HA3  GLY  46           HA1      GLY  46  88.726  -1.409  -1.765
  382    H    VAL  47           HN       VAL  47  92.199  -1.666  -1.277
  383    HA   VAL  47           HA       VAL  47  91.800  -4.458  -0.362
  384    HB   VAL  47           HB       VAL  47  93.770  -5.230  -1.661
  385   HG11  VAL  47          HG11      VAL  47  91.721  -3.957  -3.492
  386   HG12  VAL  47          HG12      VAL  47  91.383  -5.391  -2.523
  387   HG13  VAL  47          HG13      VAL  47  92.633  -5.442  -3.766
  388   HG21  VAL  47          HG21      VAL  47  94.544  -3.750  -3.541
  389   HG22  VAL  47          HG22      VAL  47  94.933  -3.113  -1.943
  390   HG23  VAL  47          HG23      VAL  47  93.577  -2.446  -2.852
  391    H    GLN  48           HN       GLN  48  92.371  -1.882   0.947
  392    HA   GLN  48           HA       GLN  48  94.829  -2.732   2.375
  393    HB2  GLN  48           HB2      GLN  48  95.514  -1.073   0.622
  394    HB3  GLN  48           HB1      GLN  48  94.427   0.101   1.363
  395    HG2  GLN  48           HG2      GLN  48  96.110  -1.095   3.387
  396    HG3  GLN  48           HG1      GLN  48  97.106  -0.433   2.091
  397   HE21  GLN  48          HE21      GLN  48  97.753   1.621   2.775
  398   HE22  GLN  48          HE22      GLN  48  96.717   2.791   3.439
  399    H    GLY  49           HN       GLY  49  91.749  -2.300   2.704
  400    HA2  GLY  49           HA2      GLY  49  90.870  -2.191   5.033
  401    HA3  GLY  49           HA1      GLY  49  91.972  -0.842   5.309
  402    H1U  RCY  50           H1U      RCY  50  81.451   0.655   2.202
  403    H1S  RCY  50           H1S      RCY  50  86.010   0.336   2.462
  404    HB1  RCY  50           HB1      RCY  50  87.546  -1.162   1.294
  405    HB2  RCY  50           HB2      RCY  50  88.878  -0.331   0.491
  406    HA   RCY  50           HA       RCY  50  88.956   1.278   2.413
  407    HN1  RCY  50           HN1      RCY  50  89.824  -1.454   2.529
  408    H    GLY  51           HN       GLY  51  87.484  -1.648   3.808
  409    HA2  GLY  51           HA2      GLY  51  85.160  -0.113   4.757
  410    HA3  GLY  51           HA1      GLY  51  85.447  -1.833   5.030
  411    H    ASP  52           HN       ASP  52  88.085   0.281   5.698
  412    HA   ASP  52           HA       ASP  52  88.459  -0.538   8.349
  413    HB2  ASP  52           HB2      ASP  52  89.691   1.680   8.624
  414    HB3  ASP  52           HB1      ASP  52  90.216   0.683   7.266
  415    H    ASP  53           HN       ASP  53  87.994   0.554  10.386
  416    HA   ASP  53           HA       ASP  53  85.300   1.286  10.755
  417    HB2  ASP  53           HB2      ASP  53  87.640   2.218  12.445
  418    HB3  ASP  53           HB1      ASP  53  85.960   2.066  12.961
  419    H    ILE  54           HN       ILE  54  88.138   3.367  10.208
  420    HA   ILE  54           HA       ILE  54  86.859   5.869  10.564
  421    HB   ILE  54           HB       ILE  54  89.075   5.145   8.625
  422   HG12  ILE  54          HG12      ILE  54  89.250   4.694  11.218
  423   HG13  ILE  54          HG11      ILE  54  90.589   5.471  10.373
  424   HG21  ILE  54          HG21      ILE  54  88.002   7.764   9.679
  425   HG22  ILE  54          HG22      ILE  54  88.295   7.296   8.004
  426   HG23  ILE  54          HG23      ILE  54  89.654   7.619   9.080
  427   HD11  ILE  54          HD11      ILE  54  90.041   7.601  11.197
  428   HD12  ILE  54          HD12      ILE  54  89.712   6.555  12.579
  429   HD13  ILE  54          HD13      ILE  54  88.383   7.131  11.573
  430    HA   PRO  55           HA       PRO  55  84.239   5.461   6.883
  431    HB2  PRO  55           HB2      PRO  55  82.452   7.389   7.495
  432    HB3  PRO  55           HB1      PRO  55  82.465   5.828   8.342
  433    HG2  PRO  55           HG2      PRO  55  83.522   8.461   9.236
  434    HG3  PRO  55           HG1      PRO  55  82.678   7.209  10.161
  435    HD2  PRO  55           HD2      PRO  55  85.438   7.574  10.155
  436    HD3  PRO  55           HD1      PRO  55  84.619   6.064  10.610
  437    H    GLY  56           HN       GLY  56  84.074   6.646   4.931
  438    HA2  GLY  56           HA2      GLY  56  84.172   8.746   3.669
  439    HA3  GLY  56           HA1      GLY  56  85.258   9.387   4.903
  440    H    MET  57           HN       MET  57  87.190   7.525   5.167
  441    HA   MET  57           HA       MET  57  88.869   7.912   2.921
  442    HB2  MET  57           HB2      MET  57  88.951   5.753   5.051
  443    HB3  MET  57           HB1      MET  57  90.262   6.083   3.916
  444    HG2  MET  57           HG2      MET  57  89.097   8.172   5.776
  445    HG3  MET  57           HG1      MET  57  90.524   7.210   6.163
  446    HE1  MET  57           HE1      MET  57  90.972   9.896   6.516
  447    HE2  MET  57           HE2      MET  57  89.812  10.619   5.405
  448    HE3  MET  57           HE3      MET  57  91.532  10.954   5.215
  449    H    GLU  58           HN       GLU  58  86.129   6.020   3.085
  450    HA   GLU  58           HA       GLU  58  87.111   3.855   1.341
  451    HB2  GLU  58           HB2      GLU  58  84.194   4.329   1.845
  452    HB3  GLU  58           HB1      GLU  58  85.080   2.807   1.740
  453    HG2  GLU  58           HG2      GLU  58  86.270   3.604   3.909
  454    HG3  GLU  58           HG1      GLU  58  84.924   4.735   4.051
  455    H    GLY  59           HN       GLY  59  84.867   3.599  -0.366
  456    HA2  GLY  59           HA2      GLY  59  84.348   6.080  -1.771
  457    HA3  GLY  59           HA1      GLY  59  85.565   5.108  -2.600
  458    H1U  RCY  60           H1U      RCY  60  78.279   2.929   0.756
  459    H1S  RCY  60           H1S      RCY  60  80.086   2.731  -3.607
  460    HB1  RCY  60           HB1      RCY  60  82.094   2.064  -2.277
  461    HB2  RCY  60           HB2      RCY  60  83.178   0.837  -2.930
  462    HA   RCY  60           HA       RCY  60  83.401   2.030  -5.010
  463    HN1  RCY  60           HN1      RCY  60  84.878   3.437  -3.860
  464    H    GLY  61           HN       GLY  61  81.801   2.458  -6.464
  465    HA2  GLY  61           HA2      GLY  61  79.587   4.278  -5.733
  466    HA3  GLY  61           HA1      GLY  61  80.636   4.803  -7.051
  467    H    THR  62           HN       THR  62  81.143   2.252  -8.191
  468    HA   THR  62           HA       THR  62  78.893   1.974  -9.906
  469    HB   THR  62           HB       THR  62  80.374  -0.482  -9.851
  470    HG1  THR  62           HG1      THR  62  81.910   0.698  -8.653
  471   HG21  THR  62          HG21      THR  62  81.119   0.306 -12.064
  472   HG22  THR  62          HG22      THR  62  80.547   1.930 -11.680
  473   HG23  THR  62          HG23      THR  62  79.395   0.604 -11.839
  474    H    ASP  63           HN       ASP  63  77.031   0.918  -9.601
  475    HA   ASP  63           HA       ASP  63  76.207  -0.190  -7.146
  476    HB2  ASP  63           HB2      ASP  63  74.389  -1.309  -8.543
  477    HB3  ASP  63           HB1      ASP  63  74.528   0.439  -8.728
  478    H    ILE  64           HN       ILE  64  78.664  -1.425  -8.829
  479    HA   ILE  64           HA       ILE  64  78.292  -4.103  -7.683
  480    HB   ILE  64           HB       ILE  64  77.298  -4.199 -10.010
  481   HG12  ILE  64          HG12      ILE  64  79.823  -5.841  -9.871
  482   HG13  ILE  64          HG11      ILE  64  78.514  -6.109  -8.720
  483   HG21  ILE  64          HG21      ILE  64  78.659  -3.888 -11.912
  484   HG22  ILE  64          HG22      ILE  64  80.148  -3.977 -10.971
  485   HG23  ILE  64          HG23      ILE  64  79.116  -2.551 -10.857
  486   HD11  ILE  64          HD11      ILE  64  78.145  -6.121 -11.728
  487   HD12  ILE  64          HD12      ILE  64  76.950  -6.572 -10.511
  488   HD13  ILE  64          HD13      ILE  64  78.379  -7.576 -10.758
  489    H    THR  65           HN       THR  65  80.154  -1.467  -8.201
  490    HA   THR  65           HA       THR  65  82.506  -1.140  -8.512
  491    HB   THR  65           HB       THR  65  82.265  -1.403  -6.089
  492    HG1  THR  65           HG1      THR  65  84.404  -3.006  -7.032
  493   HG21  THR  65          HG21      THR  65  82.565  -3.698  -5.096
  494   HG22  THR  65          HG22      THR  65  82.410  -4.361  -6.723
  495   HG23  THR  65          HG23      THR  65  81.059  -3.495  -5.991
  496    H    VAL  66           HN       VAL  66  81.511  -2.902 -10.397
  497    HA   VAL  66           HA       VAL  66  82.358  -4.396 -11.996
  498    HB   VAL  66           HB       VAL  66  84.739  -5.005 -10.251
  499   HG11  VAL  66          HG11      VAL  66  85.851  -5.177 -12.429
  500   HG12  VAL  66          HG12      VAL  66  84.393  -4.605 -13.239
  501   HG13  VAL  66          HG13      VAL  66  84.393  -6.168 -12.422
  502   HG21  VAL  66          HG21      VAL  66  85.638  -2.921 -11.754
  503   HG22  VAL  66          HG22      VAL  66  85.087  -2.749 -10.088
  504   HG23  VAL  66          HG23      VAL  66  83.992  -2.384 -11.421
  505    H    ILE  67           HN       ILE  67  83.063  -5.374  -8.645
  506    HA   ILE  67           HA       ILE  67  81.345  -7.760  -9.024
  507    HB   ILE  67           HB       ILE  67  84.181  -7.815  -7.948
  508   HG12  ILE  67          HG12      ILE  67  82.890  -9.332 -10.236
  509   HG13  ILE  67          HG11      ILE  67  83.871  -7.880 -10.443
  510   HG21  ILE  67          HG21      ILE  67  81.964  -9.876  -7.906
  511   HG22  ILE  67          HG22      ILE  67  82.870  -9.239  -6.533
  512   HG23  ILE  67          HG23      ILE  67  83.664 -10.297  -7.699
  513   HD11  ILE  67          HD11      ILE  67  85.202  -9.955 -10.767
  514   HD12  ILE  67          HD12      ILE  67  84.817 -10.438  -9.115
  515   HD13  ILE  67          HD13      ILE  67  85.791  -8.997  -9.408
  516    H1U  RCY  68           H1U      RCY  68  77.347  -2.640   0.710
  517    H1S  RCY  68           H1S      RCY  68  77.837  -4.952  -3.169
  518    HB1  RCY  68           HB1      RCY  68  77.940  -6.414  -4.757
  519    HB2  RCY  68           HB2      RCY  68  78.099  -6.085  -6.482
  520    HA   RCY  68           HA       RCY  68  80.601  -5.615  -5.058
  521    HN1  RCY  68           HN1      RCY  68  79.791  -6.724  -7.593
  522    HA   PRO  69           HA       PRO  69  81.694  -9.444  -2.996
  523    HB2  PRO  69           HB2      PRO  69  80.740  -7.854  -0.641
  524    HB3  PRO  69           HB1      PRO  69  82.224  -8.810  -0.831
  525    HG2  PRO  69           HG2      PRO  69  82.242  -6.149  -1.009
  526    HG3  PRO  69           HG1      PRO  69  83.294  -7.156  -2.015
  527    HD2  PRO  69           HD2      PRO  69  80.882  -5.602  -2.797
  528    HD3  PRO  69           HD1      PRO  69  82.271  -6.105  -3.786
  529    H    TRP  70           HN       TRP  70  78.570  -8.168  -3.306
  530    HA   TRP  70           HA       TRP  70  77.105  -9.706  -1.417
  531    HD1  TRP  70           HD1      TRP  70  75.162 -10.831  -1.249
  532    HE1  TRP  70           HE1      TRP  70  72.897 -11.894  -1.864
  533    HE3  TRP  70           HE3      TRP  70  74.241  -8.446  -5.669
  534    HZ2  TRP  70           HZ2      TRP  70  70.948 -11.753  -3.959
  535    HZ3  TRP  70           HZ3      TRP  70  72.179  -8.927  -6.951
  536    HH2  TRP  70           HH2      TRP  70  70.532 -10.574  -6.105
  537    HB2  TRP  70           HB2      TRP  70  75.937  -7.993  -2.633
  538    HB3  TRP  70           HB1      TRP  70  76.369  -8.713  -4.183
  539    H    GLU  71           HN       GLU  71  77.846 -10.469  -4.838
  540    HA   GLU  71           HA       GLU  71  77.016 -13.260  -4.421
  541    HB2  GLU  71           HB2      GLU  71  78.167 -11.755  -6.785
  542    HB3  GLU  71           HB1      GLU  71  77.843 -13.490  -6.823
  543    HG2  GLU  71           HG2      GLU  71  75.486 -13.108  -6.350
  544    HG3  GLU  71           HG1      GLU  71  75.772 -11.379  -6.152
  545    H    ALA  72           HN       ALA  72  80.002 -12.016  -5.927
  546    HA   ALA  72           HA       ALA  72  81.526 -14.267  -4.855
  547    HB1  ALA  72           HB1      ALA  72  83.477 -13.003  -5.908
  548    HB2  ALA  72           HB2      ALA  72  82.294 -11.814  -6.455
  549    HB3  ALA  72           HB3      ALA  72  82.192 -13.482  -7.019
  550    H1U  RCY  73           H1U      RCY  73  76.099  -9.489   1.061
  551    H1S  RCY  73           H1S      RCY  73  79.547 -12.321   0.513
  552    HB1  RCY  73           HB1      RCY  73  82.431 -13.989   0.047
  553    HB2  RCY  73           HB2      RCY  73  80.747 -13.610  -0.318
  554    HA   RCY  73           HA       RCY  73  81.770 -11.351  -1.224
  555    HN1  RCY  73           HN1      RCY  73  81.018 -13.702  -2.537
  556    H    ASN  74           HN       ASN  74  83.674 -10.355  -1.830
  557    HA   ASN  74           HA       ASN  74  86.138 -11.856  -2.229
  558    HB2  ASN  74           HB2      ASN  74  85.498  -8.903  -2.089
  559    HB3  ASN  74           HB1      ASN  74  87.141  -9.505  -2.307
  560   HD21  ASN  74          HD21      ASN  74  87.560 -10.828  -4.290
  561   HD22  ASN  74          HD22      ASN  74  86.567 -10.633  -5.652
  562    H    HIS  75           HN       HIS  75  85.474 -12.687   0.191
  563    HA   HIS  75           HA       HIS  75  86.337 -12.899   2.363
  564    HD1  HIS  75           HD1      HIS  75  86.998 -12.668   4.281
  565    HD2  HIS  75           HD2      HIS  75  90.849 -12.591   2.682
  566    HE1  HIS  75           HE1      HIS  75  88.513 -13.723   6.014
  567    HE2  HIS  75           HE2      HIS  75  90.861 -13.683   5.053
  568    HB2  HIS  75           HB2      HIS  75  88.477 -12.181   0.957
  569    HB3  HIS  75           HB1      HIS  75  88.302 -10.684   1.871
  570    H1U  RCY  76           H1U      RCY  76  77.542  -6.568   2.555
  571    H1S  RCY  76           H1S      RCY  76  81.230  -6.588   4.182
  572    HB1  RCY  76           HB1      RCY  76  82.968 -10.038   3.108
  573    HB2  RCY  76           HB2      RCY  76  84.056  -8.651   3.078
  574    HA   RCY  76           HA       RCY  76  85.281  -9.433   4.954
  575    HN1  RCY  76           HN1      RCY  76  85.094 -12.109   3.982
  576    H    GLU  77           HN       GLU  77  83.432 -12.415   4.690
  577    HA   GLU  77           HA       GLU  77  81.710 -12.113   6.912
  578    HB2  GLU  77           HB2      GLU  77  82.125 -14.097   5.126
  579    HB3  GLU  77           HB1      GLU  77  82.978 -14.785   6.507
  580    HG2  GLU  77           HG2      GLU  77  80.967 -14.450   7.910
  581    HG3  GLU  77           HG1      GLU  77  80.112 -13.788   6.517
  582    H    LEU  78           HN       LEU  78  82.120 -13.681   8.956
  583    HA   LEU  78           HA       LEU  78  84.879 -13.704   9.904
  584    HG   LEU  78           HG       LEU  78  85.511 -12.742  12.151
  585    HB2  LEU  78           HB2      LEU  78  83.687 -11.293  10.210
  586    HB3  LEU  78           HB1      LEU  78  83.111 -12.083  11.675
  587   HD11  LEU  78          HD11      LEU  78  85.827 -11.228   9.611
  588   HD12  LEU  78          HD12      LEU  78  86.787 -12.561  10.253
  589   HD13  LEU  78          HD13      LEU  78  87.034 -10.923  10.859
  590   HD21  LEU  78          HD21      LEU  78  84.695  -9.831  11.979
  591   HD22  LEU  78          HD22      LEU  78  86.174 -10.355  12.784
  592   HD23  LEU  78          HD23      LEU  78  84.605 -10.897  13.381
  593    H    HIS  79           HN       HIS  79  82.040 -15.139   9.689
  594    HA   HIS  79           HA       HIS  79  80.962 -16.844  10.883
  595    HD1  HIS  79           HD1      HIS  79  85.555 -17.932  11.562
  596    HD2  HIS  79           HD2      HIS  79  82.396 -17.626   8.855
  597    HE1  HIS  79           HE1      HIS  79  86.532 -18.383   9.269
  598    HE2  HIS  79           HE2      HIS  79  84.619 -18.200   7.612
  599    HB2  HIS  79           HB2      HIS  79  83.432 -16.966  12.617
  600    HB3  HIS  79           HB1      HIS  79  82.343 -18.279  12.170
  601    H    GLU  80           HN       GLU  80  81.243 -13.905  11.960
  602    HA   GLU  80           HA       GLU  80  79.927 -14.514  14.572
  603    HB2  GLU  80           HB2      GLU  80  82.362 -13.740  14.817
  604    HB3  GLU  80           HB1      GLU  80  81.815 -12.181  14.198
  605    HG2  GLU  80           HG2      GLU  80  80.024 -12.247  16.026
  606    HG3  GLU  80           HG1      GLU  80  80.933 -13.588  16.725
  607    H    LEU  81           HN       LEU  81  80.423 -12.256  11.888
  608    HA   LEU  81           HA       LEU  81  78.189 -10.557  12.753
  609    HG   LEU  81           HG       LEU  81  80.737  -8.447  11.236
  610    HB2  LEU  81           HB2      LEU  81  80.036 -10.587  10.366
  611    HB3  LEU  81           HB1      LEU  81  78.617  -9.543  10.397
  612   HD11  LEU  81          HD11      LEU  81  78.215  -8.034  11.995
  613   HD12  LEU  81          HD12      LEU  81  79.551  -7.182  12.768
  614   HD13  LEU  81          HD13      LEU  81  78.841  -8.598  13.544
  615   HD21  LEU  81          HD21      LEU  81  81.690  -9.122  13.310
  616   HD22  LEU  81          HD22      LEU  81  81.462 -10.621  12.408
  617   HD23  LEU  81          HD23      LEU  81  80.326 -10.177  13.681
  618    H    ALA  82           HN       ALA  82  78.608 -13.429  10.938
  619    HA   ALA  82           HA       ALA  82  76.402 -13.153   9.112
  620    HB1  ALA  82           HB1      ALA  82  78.282 -14.903   9.054
  621    HB2  ALA  82           HB2      ALA  82  76.654 -15.487   8.706
  622    HB3  ALA  82           HB3      ALA  82  77.369 -15.763  10.294
  623    H    GLN  83           HN       GLN  83  75.300 -15.854  10.142
  624    HA   GLN  83           HA       GLN  83  73.460 -16.543  11.409
  625    HB2  GLN  83           HB2      GLN  83  74.381 -14.395  13.346
  626    HB3  GLN  83           HB1      GLN  83  73.307 -15.741  13.714
  627    HG2  GLN  83           HG2      GLN  83  75.983 -16.361  12.527
  628    HG3  GLN  83           HG1      GLN  83  75.914 -15.897  14.228
  629   HE21  GLN  83          HE21      GLN  83  73.270 -17.631  12.607
  630   HE22  GLN  83          HE22      GLN  83  73.466 -19.082  13.466
  631    H    TYR  84           HN       TYR  84  73.819 -13.233  10.495
  632    HA   TYR  84           HA       TYR  84  71.038 -12.537  11.159
  633    HD1  TYR  84           HD1      TYR  84  70.173 -10.410  11.774
  634    HD2  TYR  84           HD2      TYR  84  74.466 -10.331  11.907
  635    HE1  TYR  84           HE1      TYR  84  70.084  -9.366  14.022
  636    HE2  TYR  84           HE2      TYR  84  74.377  -9.288  14.155
  637    HH   TYR  84           HH       TYR  84  72.644  -9.252  16.097
  638    HB2  TYR  84           HB2      TYR  84  73.405 -11.121   9.991
  639    HB3  TYR  84           HB1      TYR  84  71.801 -10.481   9.632
  640    H    GLY  85           HN       GLY  85  72.889 -13.718   8.447
  641    HA2  GLY  85           HA2      GLY  85  71.407 -14.984   6.794
  642    HA3  GLY  85           HA1      GLY  85  70.455 -13.500   6.716
  643    H    ILE  86           HN       ILE  86  73.963 -14.230   6.595
  644    HA   ILE  86           HA       ILE  86  75.609 -13.350   5.167
  645    HB   ILE  86           HB       ILE  86  73.409 -13.532   3.091
  646   HG12  ILE  86          HG12      ILE  86  73.464 -15.630   4.329
  647   HG13  ILE  86          HG11      ILE  86  74.245 -15.875   2.766
  648   HG21  ILE  86          HG21      ILE  86  75.277 -13.964   1.566
  649   HG22  ILE  86          HG22      ILE  86  76.417 -13.888   2.910
  650   HG23  ILE  86          HG23      ILE  86  75.541 -12.440   2.414
  651   HD11  ILE  86          HD11      ILE  86  75.801 -16.853   4.195
  652   HD12  ILE  86          HD12      ILE  86  75.482 -15.704   5.494
  653   HD13  ILE  86          HD13      ILE  86  76.427 -15.207   4.090
  654    H1U  RCY  87           H1U      RCY  87  76.902  -2.854   4.047
  655    H1S  RCY  87           H1S      RCY  87  75.684  -5.200   7.092
  656    HB1  RCY  87           HB1      RCY  87  76.821  -8.247   5.538
  657    HB2  RCY  87           HB2      RCY  87  76.498  -9.427   6.807
  658    HA   RCY  87           HA       RCY  87  74.022  -9.105   5.561
  659    HN1  RCY  87           HN1      RCY  87  75.849 -11.245   5.955
  Start of MODEL   65
    1    HA   MET   1           HA       MET   1  68.611 -17.421   9.493
    2    HB2  MET   1           HB2      MET   1  65.972 -18.651  10.313
    3    HB3  MET   1           HB1      MET   1  66.293 -16.977   9.857
    4    HG2  MET   1           HG2      MET   1  66.907 -17.772   7.564
    5    HG3  MET   1           HG1      MET   1  66.424 -19.400   8.039
    6    HE1  MET   1           HE1      MET   1  63.914 -15.663   7.432
    7    HE2  MET   1           HE2      MET   1  65.057 -16.244   6.224
    8    HE3  MET   1           HE3      MET   1  65.629 -15.814   7.834
    9    H    ASN   2           HN       ASN   2  66.656 -17.123  11.791
   10    HA   ASN   2           HA       ASN   2  68.033 -18.464  14.023
   11    HB2  ASN   2           HB2      ASN   2  68.546 -16.261  15.130
   12    HB3  ASN   2           HB1      ASN   2  69.519 -16.577  13.694
   13   HD21  ASN   2          HD21      ASN   2  68.973 -13.900  14.686
   14   HD22  ASN   2          HD22      ASN   2  68.045 -13.100  13.511
   15    H    LEU   3           HN       LEU   3  66.837 -18.237  16.019
   16    HA   LEU   3           HA       LEU   3  63.980 -17.742  15.567
   17    HG   LEU   3           HG       LEU   3  62.845 -17.762  18.033
   18    HB2  LEU   3           HB2      LEU   3  64.961 -19.650  16.973
   19    HB3  LEU   3           HB1      LEU   3  65.306 -18.429  18.196
   20   HD11  LEU   3          HD11      LEU   3  62.024 -18.703  16.068
   21   HD12  LEU   3          HD12      LEU   3  61.490 -19.892  17.256
   22   HD13  LEU   3          HD13      LEU   3  62.930 -20.201  16.286
   23   HD21  LEU   3          HD21      LEU   3  63.736 -20.473  19.040
   24   HD22  LEU   3          HD22      LEU   3  62.124 -19.833  19.361
   25   HD23  LEU   3          HD23      LEU   3  63.546 -18.982  19.963
   26    H    GLU   4           HN       GLU   4  63.905 -15.459  15.268
   27    HA   GLU   4           HA       GLU   4  64.343 -13.890  17.779
   28    HB2  GLU   4           HB2      GLU   4  65.353 -13.420  15.027
   29    HB3  GLU   4           HB1      GLU   4  64.671 -12.004  15.824
   30    HG2  GLU   4           HG2      GLU   4  66.140 -12.398  17.775
   31    HG3  GLU   4           HG1      GLU   4  66.835 -13.800  16.961
   32    HA   PRO   5           HA       PRO   5  60.235 -12.328  17.788
   33    HB2  PRO   5           HB2      PRO   5  61.427  -9.701  16.947
   34    HB3  PRO   5           HB1      PRO   5  60.223 -10.034  18.207
   35    HG2  PRO   5           HG2      PRO   5  62.816  -9.623  18.769
   36    HG3  PRO   5           HG1      PRO   5  61.796 -10.714  19.720
   37    HD2  PRO   5           HD2      PRO   5  64.027 -11.376  17.918
   38    HD3  PRO   5           HD1      PRO   5  63.240 -12.388  19.149
   39    HA   PRO   6           HA       PRO   6  59.618 -12.552  13.284
   40    HB2  PRO   6           HB2      PRO   6  57.089 -13.538  13.331
   41    HB3  PRO   6           HB1      PRO   6  58.510 -14.548  13.666
   42    HG2  PRO   6           HG2      PRO   6  56.565 -13.341  15.562
   43    HG3  PRO   6           HG1      PRO   6  57.369 -14.918  15.618
   44    HD2  PRO   6           HD2      PRO   6  58.163 -12.702  17.093
   45    HD3  PRO   6           HD1      PRO   6  59.219 -14.073  16.690
   46    H    LYS   7           HN       LYS   7  58.968 -10.885  11.991
   47    HA   LYS   7           HA       LYS   7  56.447  -9.505  12.353
   48    HB2  LYS   7           HB2      LYS   7  58.793  -8.480  13.720
   49    HB3  LYS   7           HB1      LYS   7  58.246  -7.320  12.512
   50    HG2  LYS   7           HG2      LYS   7  56.434  -8.614  14.572
   51    HG3  LYS   7           HG1      LYS   7  57.146  -7.010  14.745
   52    HD2  LYS   7           HD2      LYS   7  55.346  -6.219  13.637
   53    HD3  LYS   7           HD1      LYS   7  56.018  -6.976  12.193
   54    HE2  LYS   7           HE2      LYS   7  54.374  -8.514  12.158
   55    HE3  LYS   7           HE1      LYS   7  54.678  -8.947  13.840
   56    HZ1  LYS   7           HZ1      LYS   7  52.438  -7.798  13.028
   57    HZ2  LYS   7           HZ2      LYS   7  53.345  -6.405  13.377
   58    HZ3  LYS   7           HZ3      LYS   7  53.076  -7.570  14.583
   59    H    ALA   8           HN       ALA   8  58.782 -10.674  10.495
   60    HA   ALA   8           HA       ALA   8  59.599  -8.867   8.574
   61    HB1  ALA   8           HB1      ALA   8  60.150 -11.241   8.427
   62    HB2  ALA   8           HB2      ALA   8  59.406 -10.721   6.916
   63    HB3  ALA   8           HB3      ALA   8  58.465 -11.638   8.093
   64    H    GLU   9           HN       GLU   9  57.014 -10.845   7.302
   65    HA   GLU   9           HA       GLU   9  55.191 -10.210   5.956
   66    HB2  GLU   9           HB2      GLU   9  54.989  -8.808   8.543
   67    HB3  GLU   9           HB1      GLU   9  54.073  -8.034   7.250
   68    HG2  GLU   9           HG2      GLU   9  53.908 -11.000   7.835
   69    HG3  GLU   9           HG1      GLU   9  52.809  -9.818   8.546
   70    H1U  RCY  10           H1U      RCY  10  54.379  -8.568  -1.742
   71    H1S  RCY  10           H1S      RCY  10  57.346  -5.470  -0.110
   72    HB1  RCY  10           HB1      RCY  10  56.208  -7.513   3.105
   73    HB2  RCY  10           HB2      RCY  10  57.855  -7.969   2.670
   74    HA   RCY  10           HA       RCY  10  58.770  -6.869   4.578
   75    HN1  RCY  10           HN1      RCY  10  57.905  -8.679   5.799
   76    H    ARG  11           HN       ARG  11  55.587  -5.732   3.747
   77    HA   ARG  11           HA       ARG  11  55.402  -3.879   6.002
   78    HE   ARG  11           HE       ARG  11  56.641   0.410   6.763
   79    HB2  ARG  11           HB2      ARG  11  57.127  -3.021   4.145
   80    HB3  ARG  11           HB1      ARG  11  55.643  -2.505   3.350
   81    HG2  ARG  11           HG2      ARG  11  56.134  -0.638   4.664
   82    HG3  ARG  11           HG1      ARG  11  55.044  -1.533   5.723
   83    HD2  ARG  11           HD2      ARG  11  56.868  -2.426   6.995
   84    HD3  ARG  11           HD1      ARG  11  58.051  -1.862   5.814
   85   HH11  ARG  11          HH21      ARG  11  58.762  -2.082   7.850
   86   HH12  ARG  11          HH22      ARG  11  59.488  -1.108   9.085
   87   HH21  ARG  11          HH11      ARG  11  57.578   1.696   8.369
   88   HH22  ARG  11          HH12      ARG  11  58.818   1.030   9.379
   89    H    SER  12           HN       SER  12  53.971  -2.020   3.953
   90    HA   SER  12           HA       SER  12  51.661  -3.703   3.205
   91    HG   SER  12           HG       SER  12  50.572  -3.338   6.361
   92    HB2  SER  12           HB2      SER  12  51.673  -1.762   5.468
   93    HB3  SER  12           HB1      SER  12  50.254  -1.762   4.425
   94    H    ALA  13           HN       ALA  13  53.731  -1.140   2.644
   95    HA   ALA  13           HA       ALA  13  52.014  -0.193   0.412
   96    HB1  ALA  13           HB1      ALA  13  51.760   1.328   2.458
   97    HB2  ALA  13           HB2      ALA  13  52.256   2.116   0.960
   98    HB3  ALA  13           HB3      ALA  13  53.450   1.769   2.211
   99    H    THR  14           HN       THR  14  53.412  -1.027  -1.141
  100    HA   THR  14           HA       THR  14  56.303  -0.376  -0.948
  101    HB   THR  14           HB       THR  14  56.482  -1.865  -2.956
  102    HG1  THR  14           HG1      THR  14  53.695  -1.910  -2.546
  103   HG21  THR  14          HG21      THR  14  55.765  -3.962  -1.730
  104   HG22  THR  14          HG22      THR  14  55.068  -2.914  -0.495
  105   HG23  THR  14          HG23      THR  14  56.804  -2.881  -0.803
  106    H    ARG  15           HN       ARG  15  57.368   0.548  -2.901
  107    HA   ARG  15           HA       ARG  15  55.558   2.113  -4.672
  108    HE   ARG  15           HE       ARG  15  57.436   3.605  -0.989
  109    HB2  ARG  15           HB2      ARG  15  57.680   3.224  -2.832
  110    HB3  ARG  15           HB1      ARG  15  57.205   4.081  -4.299
  111    HG2  ARG  15           HG2      ARG  15  54.962   4.334  -3.555
  112    HG3  ARG  15           HG1      ARG  15  55.168   3.135  -2.278
  113    HD2  ARG  15           HD2      ARG  15  56.588   5.812  -2.400
  114    HD3  ARG  15           HD1      ARG  15  55.202   5.444  -1.374
  115   HH11  ARG  15          HH21      ARG  15  55.988   6.629  -0.186
  116   HH12  ARG  15          HH22      ARG  15  56.759   6.738   1.362
  117   HH21  ARG  15          HH11      ARG  15  58.452   3.730   1.027
  118   HH22  ARG  15          HH12      ARG  15  58.154   5.097   2.048
  119    H    VAL  16           HN       VAL  16  57.835  -0.125  -4.586
  120    HA   VAL  16           HA       VAL  16  59.962   0.838  -6.230
  121    HB   VAL  16           HB       VAL  16  58.786  -1.946  -5.977
  122   HG11  VAL  16          HG11      VAL  16  61.277  -0.903  -7.337
  123   HG12  VAL  16          HG12      VAL  16  60.014  -1.928  -8.019
  124   HG13  VAL  16          HG13      VAL  16  61.126  -2.582  -6.817
  125   HG21  VAL  16          HG21      VAL  16  61.252  -0.686  -4.734
  126   HG22  VAL  16          HG22      VAL  16  60.653  -2.319  -4.443
  127   HG23  VAL  16          HG23      VAL  16  59.720  -0.927  -3.895
  128    H    MET  17           HN       MET  17  59.993   1.335  -8.377
  129    HA   MET  17           HA       MET  17  57.519   1.083  -9.927
  130    HB2  MET  17           HB2      MET  17  58.793   2.262 -11.691
  131    HB3  MET  17           HB1      MET  17  58.919   3.100 -10.144
  132    HG2  MET  17           HG2      MET  17  61.150   3.059 -10.837
  133    HG3  MET  17           HG1      MET  17  61.063   1.614  -9.829
  134    HE1  MET  17           HE1      MET  17  62.949   0.002 -10.932
  135    HE2  MET  17           HE2      MET  17  63.315   1.693 -11.265
  136    HE3  MET  17           HE3      MET  17  63.478   0.495 -12.546
  137    H    GLY  18           HN       GLY  18  60.322  -0.810  -9.421
  138    HA2  GLY  18           HA2      GLY  18  61.061  -2.797 -10.423
  139    HA3  GLY  18           HA1      GLY  18  59.420  -2.959 -11.048
  140    H    GLY  19           HN       GLY  19  59.079  -2.583 -13.211
  141    HA2  GLY  19           HA2      GLY  19  59.591  -2.141 -15.457
  142    HA3  GLY  19           HA1      GLY  19  60.618  -0.838 -14.858
  143    HA   PRO  20           HA       PRO  20  62.822  -4.963 -16.539
  144    HB2  PRO  20           HB2      PRO  20  63.495  -2.961 -18.667
  145    HB3  PRO  20           HB1      PRO  20  63.242  -4.712 -18.806
  146    HG2  PRO  20           HG2      PRO  20  61.372  -2.939 -19.540
  147    HG3  PRO  20           HG1      PRO  20  60.963  -4.518 -18.853
  148    HD2  PRO  20           HD2      PRO  20  60.701  -1.832 -17.636
  149    HD3  PRO  20           HD1      PRO  20  59.863  -3.342 -17.223
  150    H1U  RCY  21           H1U      RCY  21  67.958  -9.292 -10.912
  151    H1S  RCY  21           H1S      RCY  21  66.925  -4.563 -10.439
  152    HB1  RCY  21           HB1      RCY  21  67.816  -4.799 -13.914
  153    HB2  RCY  21           HB2      RCY  21  66.215  -5.536 -13.940
  154    HA   RCY  21           HA       RCY  21  66.329  -2.732 -14.890
  155    HN1  RCY  21           HN1      RCY  21  64.824  -5.179 -15.620
  156    H    THR  22           HN       THR  22  67.430  -2.042 -16.722
  157    HA   THR  22           HA       THR  22  69.275  -4.034 -17.992
  158    HB   THR  22           HB       THR  22  67.842  -3.531 -19.755
  159    HG1  THR  22           HG1      THR  22  68.943  -1.505 -20.744
  160   HG21  THR  22          HG21      THR  22  67.647  -0.763 -18.544
  161   HG22  THR  22          HG22      THR  22  66.382  -1.990 -18.617
  162   HG23  THR  22          HG23      THR  22  66.930  -1.199 -20.095
  163    HA   PRO  23           HA       PRO  23  72.394  -1.401 -16.046
  164    HB2  PRO  23           HB2      PRO  23  73.944  -2.496 -18.372
  165    HB3  PRO  23           HB1      PRO  23  74.422  -2.356 -16.667
  166    HG2  PRO  23           HG2      PRO  23  73.640  -4.682 -17.707
  167    HG3  PRO  23           HG1      PRO  23  73.227  -4.225 -16.046
  168    HD2  PRO  23           HD2      PRO  23  71.467  -4.379 -18.438
  169    HD3  PRO  23           HD1      PRO  23  71.048  -4.523 -16.717
  170    H    ARG  24           HN       ARG  24  73.766   0.459 -16.746
  171    HA   ARG  24           HA       ARG  24  73.101   1.565 -19.423
  172    HE   ARG  24           HE       ARG  24  68.523   1.904 -17.520
  173    HB2  ARG  24           HB2      ARG  24  72.611   2.982 -16.787
  174    HB3  ARG  24           HB1      ARG  24  72.595   3.785 -18.358
  175    HG2  ARG  24           HG2      ARG  24  70.773   2.340 -19.116
  176    HG3  ARG  24           HG1      ARG  24  70.819   1.450 -17.594
  177    HD2  ARG  24           HD2      ARG  24  70.439   3.767 -16.481
  178    HD3  ARG  24           HD1      ARG  24  69.927   4.286 -18.087
  179   HH11  ARG  24          HH21      ARG  24  68.890   5.111 -16.308
  180   HH12  ARG  24          HH22      ARG  24  67.278   5.202 -15.683
  181   HH21  ARG  24          HH11      ARG  24  66.414   2.005 -16.711
  182   HH22  ARG  24          HH12      ARG  24  65.876   3.444 -15.911
  183    H    LYS  25           HN       LYS  25  74.294   3.930 -17.353
  184    HA   LYS  25           HA       LYS  25  77.131   3.199 -17.926
  185    HB2  LYS  25           HB2      LYS  25  76.931   6.023 -18.198
  186    HB3  LYS  25           HB1      LYS  25  77.325   4.851 -19.450
  187    HG2  LYS  25           HG2      LYS  25  75.425   5.963 -20.309
  188    HG3  LYS  25           HG1      LYS  25  74.763   4.478 -19.625
  189    HD2  LYS  25           HD2      LYS  25  74.047   5.622 -17.632
  190    HD3  LYS  25           HD1      LYS  25  74.915   7.086 -18.093
  191    HE2  LYS  25           HE2      LYS  25  73.438   7.105 -20.195
  192    HE3  LYS  25           HE1      LYS  25  72.443   5.906 -19.369
  193    HZ1  LYS  25           HZ1      LYS  25  71.543   8.026 -18.888
  194    HZ2  LYS  25           HZ2      LYS  25  73.062   8.665 -18.475
  195    HZ3  LYS  25           HZ3      LYS  25  72.325   7.504 -17.477
  196    H    GLY  26           HN       GLY  26  75.665   6.161 -16.575
  197    HA2  GLY  26           HA2      GLY  26  75.596   6.767 -14.245
  198    HA3  GLY  26           HA1      GLY  26  76.645   5.395 -13.884
  199    HA   PRO  27           HA       PRO  27  79.095   9.384 -15.511
  200    HB2  PRO  27           HB2      PRO  27  77.965  11.120 -13.377
  201    HB3  PRO  27           HB1      PRO  27  78.304  11.499 -15.075
  202    HG2  PRO  27           HG2      PRO  27  75.814  11.174 -14.161
  203    HG3  PRO  27           HG1      PRO  27  76.290  10.695 -15.798
  204    HD2  PRO  27           HD2      PRO  27  75.785   8.971 -13.403
  205    HD3  PRO  27           HD1      PRO  27  75.474   8.636 -15.121
  206    HA   PRO  28           HA       PRO  28  82.272   9.021 -12.456
  207    HB2  PRO  28           HB2      PRO  28  82.173  11.927 -11.762
  208    HB3  PRO  28           HB1      PRO  28  83.553  10.935 -12.272
  209    HG2  PRO  28           HG2      PRO  28  82.395  12.656 -13.936
  210    HG3  PRO  28           HG1      PRO  28  83.006  11.093 -14.505
  211    HD2  PRO  28           HD2      PRO  28  80.176  11.954 -14.044
  212    HD3  PRO  28           HD1      PRO  28  80.831  10.832 -15.258
  213    H    LYS  29           HN       LYS  29  82.772   9.179 -10.087
  214    HA   LYS  29           HA       LYS  29  80.379   9.849  -8.424
  215    HB2  LYS  29           HB2      LYS  29  81.014   7.768  -7.061
  216    HB3  LYS  29           HB1      LYS  29  80.240   7.480  -8.619
  217    HG2  LYS  29           HG2      LYS  29  82.342   6.979  -9.665
  218    HG3  LYS  29           HG1      LYS  29  83.245   7.540  -8.258
  219    HD2  LYS  29           HD2      LYS  29  81.251   5.397  -7.758
  220    HD3  LYS  29           HD1      LYS  29  82.674   4.931  -8.689
  221    HE2  LYS  29           HE2      LYS  29  82.816   4.747  -6.109
  222    HE3  LYS  29           HE1      LYS  29  84.156   5.526  -6.950
  223    HZ1  LYS  29           HZ1      LYS  29  83.171   7.673  -6.477
  224    HZ2  LYS  29           HZ2      LYS  29  83.427   6.812  -5.035
  225    HZ3  LYS  29           HZ3      LYS  29  81.864   6.933  -5.689
  226    H1U  RCY  30           H1U      RCY  30  91.875  13.704  -6.872
  227    H1S  RCY  30           H1S      RCY  30  88.198  12.048  -7.532
  228    HB1  RCY  30           HB1      RCY  30  84.954  12.565  -8.732
  229    HB2  RCY  30           HB2      RCY  30  85.758  11.126  -8.105
  230    HA   RCY  30           HA       RCY  30  84.236  11.005  -6.236
  231    HN1  RCY  30           HN1      RCY  30  82.829  11.371  -8.841
  232    H    LYS  31           HN       LYS  31  82.522  11.956  -4.965
  233    HA   LYS  31           HA       LYS  31  82.754  14.833  -4.699
  234    HB2  LYS  31           HB2      LYS  31  80.321  15.305  -5.118
  235    HB3  LYS  31           HB1      LYS  31  81.210  14.857  -6.573
  236    HG2  LYS  31           HG2      LYS  31  80.449  12.423  -5.983
  237    HG3  LYS  31           HG1      LYS  31  79.229  13.230  -4.997
  238    HD2  LYS  31           HD2      LYS  31  79.691  13.664  -7.963
  239    HD3  LYS  31           HD1      LYS  31  78.339  12.789  -7.242
  240    HE2  LYS  31           HE2      LYS  31  77.839  14.950  -5.948
  241    HE3  LYS  31           HE1      LYS  31  78.954  15.742  -7.062
  242    HZ1  LYS  31           HZ1      LYS  31  76.478  15.677  -7.654
  243    HZ2  LYS  31           HZ2      LYS  31  76.756  14.054  -8.071
  244    HZ3  LYS  31           HZ3      LYS  31  77.601  15.295  -8.867
  245    H    GLN  32           HN       GLN  32  79.721  14.416  -3.714
  246    HA   GLN  32           HA       GLN  32  78.701  13.889  -1.671
  247    HB2  GLN  32           HB2      GLN  32  79.831  11.607  -2.299
  248    HB3  GLN  32           HB1      GLN  32  80.975  12.026  -1.024
  249    HG2  GLN  32           HG2      GLN  32  78.781  12.527   0.359
  250    HG3  GLN  32           HG1      GLN  32  78.040  11.441  -0.817
  251   HE21  GLN  32          HE21      GLN  32  78.403  10.813   2.026
  252   HE22  GLN  32          HE22      GLN  32  79.445   9.476   2.108
  253    H    ARG  33           HN       ARG  33  80.443  13.009   0.667
  254    HA   ARG  33           HA       ARG  33  81.973  15.501   1.183
  255    HE   ARG  33           HE       ARG  33  79.715  18.435   2.253
  256    HB2  ARG  33           HB2      ARG  33  79.647  15.841   2.028
  257    HB3  ARG  33           HB1      ARG  33  79.833  14.411   3.043
  258    HG2  ARG  33           HG2      ARG  33  81.211  15.478   4.529
  259    HG3  ARG  33           HG1      ARG  33  81.981  16.448   3.273
  260    HD2  ARG  33           HD2      ARG  33  79.109  16.952   4.012
  261    HD3  ARG  33           HD1      ARG  33  80.406  17.631   4.995
  262   HH11  ARG  33          HH21      ARG  33  82.004  18.369   4.831
  263   HH12  ARG  33          HH22      ARG  33  82.882  19.750   4.264
  264   HH21  ARG  33          HH11      ARG  33  80.849  20.239   1.498
  265   HH22  ARG  33          HH12      ARG  33  82.229  20.808   2.377
  266    H    GLN  34           HN       GLN  34  81.278  13.838   4.016
  267    HA   GLN  34           HA       GLN  34  82.963  11.557   3.875
  268    HB2  GLN  34           HB2      GLN  34  84.949  12.504   5.148
  269    HB3  GLN  34           HB1      GLN  34  84.840  12.991   3.460
  270    HG2  GLN  34           HG2      GLN  34  85.165  15.074   4.396
  271    HG3  GLN  34           HG1      GLN  34  83.408  14.990   4.537
  272   HE21  GLN  34          HE21      GLN  34  85.020  16.547   6.355
  273   HE22  GLN  34          HE22      GLN  34  84.899  15.843   7.895
  274    H    THR  35           HN       THR  35  80.757  13.393   5.352
  275    HA   THR  35           HA       THR  35  81.304  13.232   8.135
  276    HB   THR  35           HB       THR  35  79.407  14.495   7.698
  277    HG1  THR  35           HG1      THR  35  78.464  11.880   8.249
  278   HG21  THR  35          HG21      THR  35  79.070  14.045   5.396
  279   HG22  THR  35          HG22      THR  35  77.562  13.556   6.168
  280   HG23  THR  35          HG23      THR  35  78.746  12.337   5.694
  281    H    ARG  36           HN       ARG  36  80.537  10.778   5.837
  282    HA   ARG  36           HA       ARG  36  79.276   8.749   7.207
  283    HE   ARG  36           HE       ARG  36  83.641   6.595   5.353
  284    HB2  ARG  36           HB2      ARG  36  81.206   7.280   6.032
  285    HB3  ARG  36           HB1      ARG  36  79.920   8.049   5.103
  286    HG2  ARG  36           HG2      ARG  36  81.302   9.756   4.339
  287    HG3  ARG  36           HG1      ARG  36  82.404   9.616   5.709
  288    HD2  ARG  36           HD2      ARG  36  82.117   7.366   3.723
  289    HD3  ARG  36           HD1      ARG  36  83.205   8.717   3.408
  290   HH11  ARG  36          HH21      ARG  36  84.191   9.891   4.506
  291   HH12  ARG  36          HH22      ARG  36  85.658  10.019   5.418
  292   HH21  ARG  36          HH11      ARG  36  85.553   6.743   6.549
  293   HH22  ARG  36          HH12      ARG  36  86.429   8.237   6.575
  294    H    GLN  37           HN       GLN  37  82.686   9.645   7.510
  295    HA   GLN  37           HA       GLN  37  84.239   9.253   9.216
  296    HB2  GLN  37           HB2      GLN  37  81.819   9.874  10.451
  297    HB3  GLN  37           HB1      GLN  37  82.331   8.401  11.270
  298    HG2  GLN  37           HG2      GLN  37  83.993  10.913  10.912
  299    HG3  GLN  37           HG1      GLN  37  83.264  10.354  12.418
  300   HE21  GLN  37          HE21      GLN  37  86.127  10.252  10.604
  301   HE22  GLN  37          HE22      GLN  37  86.852   8.916  11.359
  302    H1U  RCY  38           H1U      RCY  38  80.172   0.593   6.426
  303    H1S  RCY  38           H1S      RCY  38  81.092   4.572   6.004
  304    HB1  RCY  38           HB1      RCY  38  82.666   3.443   8.541
  305    HB2  RCY  38           HB2      RCY  38  84.233   4.247   8.626
  306    HA   RCY  38           HA       RCY  38  81.864   4.546  10.370
  307    HN1  RCY  38           HN1      RCY  38  81.718   6.874  10.123
  308    H    LYS  39           HN       LYS  39  83.881   2.785  10.652
  309    HA   LYS  39           HA       LYS  39  85.541   2.110  12.166
  310    HB2  LYS  39           HB2      LYS  39  86.756   3.789  10.599
  311    HB3  LYS  39           HB1      LYS  39  86.662   4.902  11.964
  312    HG2  LYS  39           HG2      LYS  39  87.756   3.155  13.393
  313    HG3  LYS  39           HG1      LYS  39  87.966   2.163  11.949
  314    HD2  LYS  39           HD2      LYS  39  88.958   5.006  12.002
  315    HD3  LYS  39           HD1      LYS  39  89.933   3.705  12.689
  316    HE2  LYS  39           HE2      LYS  39  90.667   3.825  10.449
  317    HE3  LYS  39           HE1      LYS  39  89.520   2.486  10.440
  318    HZ1  LYS  39           HZ1      LYS  39  88.474   5.168   9.946
  319    HZ2  LYS  39           HZ2      LYS  39  87.987   3.675   9.298
  320    HZ3  LYS  39           HZ3      LYS  39  89.380   4.446   8.707
  321    H    SER  40           HN       SER  40  83.244   4.316  12.922
  322    HA   SER  40           HA       SER  40  83.948   5.662  15.240
  323    HG   SER  40           HG       SER  40  81.746   3.072  14.759
  324    HB2  SER  40           HB2      SER  40  81.583   5.160  16.036
  325    HB3  SER  40           HB1      SER  40  81.703   5.863  14.426
  326    H    LYS  41           HN       LYS  41  82.984   2.222  15.035
  327    HA   LYS  41           HA       LYS  41  84.513   1.751  17.552
  328    HB2  LYS  41           HB2      LYS  41  81.637   1.013  16.990
  329    HB3  LYS  41           HB1      LYS  41  82.595   0.136  18.182
  330    HG2  LYS  41           HG2      LYS  41  82.937   2.106  19.496
  331    HG3  LYS  41           HG1      LYS  41  82.314   3.148  18.216
  332    HD2  LYS  41           HD2      LYS  41  80.108   1.872  18.449
  333    HD3  LYS  41           HD1      LYS  41  80.772   1.200  19.940
  334    HE2  LYS  41           HE2      LYS  41  80.329   4.131  19.308
  335    HE3  LYS  41           HE1      LYS  41  79.474   3.167  20.511
  336    HZ1  LYS  41           HZ1      LYS  41  81.073   3.552  21.971
  337    HZ2  LYS  41           HZ2      LYS  41  81.808   4.609  20.862
  338    HZ3  LYS  41           HZ3      LYS  41  82.264   2.973  20.911
  339    HA   PRO  42           HA       PRO  42  86.115  -1.684  15.289
  340    HB2  PRO  42           HB2      PRO  42  86.530  -3.500  17.332
  341    HB3  PRO  42           HB1      PRO  42  87.593  -2.120  16.996
  342    HG2  PRO  42           HG2      PRO  42  85.463  -2.404  19.050
  343    HG3  PRO  42           HG1      PRO  42  87.045  -1.615  19.162
  344    HD2  PRO  42           HD2      PRO  42  84.733  -0.206  18.842
  345    HD3  PRO  42           HD1      PRO  42  86.287   0.349  18.181
  346    HA   PRO  43           HA       PRO  43  82.721  -4.458  14.562
  347    HB2  PRO  43           HB2      PRO  43  83.962  -6.479  13.236
  348    HB3  PRO  43           HB1      PRO  43  83.746  -4.867  12.523
  349    HG2  PRO  43           HG2      PRO  43  86.163  -6.052  13.796
  350    HG3  PRO  43           HG1      PRO  43  86.030  -5.043  12.346
  351    HD2  PRO  43           HD2      PRO  43  86.786  -4.066  14.807
  352    HD3  PRO  43           HD1      PRO  43  86.004  -3.076  13.555
  353    H    LYS  44           HN       LYS  44  81.686  -5.888  15.893
  354    HA   LYS  44           HA       LYS  44  83.211  -7.375  17.904
  355    HB2  LYS  44           HB2      LYS  44  80.898  -8.199  18.559
  356    HB3  LYS  44           HB1      LYS  44  81.109  -6.449  18.620
  357    HG2  LYS  44           HG2      LYS  44  79.977  -6.152  16.525
  358    HG3  LYS  44           HG1      LYS  44  79.991  -7.886  16.202
  359    HD2  LYS  44           HD2      LYS  44  77.774  -7.258  16.983
  360    HD3  LYS  44           HD1      LYS  44  78.562  -8.221  18.233
  361    HE2  LYS  44           HE2      LYS  44  78.996  -6.335  19.583
  362    HE3  LYS  44           HE1      LYS  44  78.749  -5.212  18.246
  363    HZ1  LYS  44           HZ1      LYS  44  76.384  -6.422  18.322
  364    HZ2  LYS  44           HZ2      LYS  44  76.734  -5.000  19.184
  365    HZ3  LYS  44           HZ3      LYS  44  76.802  -6.508  19.964
  366    H    LYS  45           HN       LYS  45  81.835  -7.980  14.783
  367    HA   LYS  45           HA       LYS  45  81.851 -10.908  15.121
  368    HB2  LYS  45           HB2      LYS  45  80.171  -9.634  13.686
  369    HB3  LYS  45           HB1      LYS  45  81.492  -9.336  12.558
  370    HG2  LYS  45           HG2      LYS  45  80.617 -11.298  11.670
  371    HG3  LYS  45           HG1      LYS  45  81.835 -11.954  12.765
  372    HD2  LYS  45           HD2      LYS  45  79.985 -13.205  13.398
  373    HD3  LYS  45           HD1      LYS  45  79.853 -11.847  14.517
  374    HE2  LYS  45           HE2      LYS  45  77.681 -12.311  13.442
  375    HE3  LYS  45           HE1      LYS  45  78.289 -10.724  12.973
  376    HZ1  LYS  45           HZ1      LYS  45  78.370 -11.346  10.861
  377    HZ2  LYS  45           HZ2      LYS  45  77.555 -12.772  11.294
  378    HZ3  LYS  45           HZ3      LYS  45  79.252 -12.748  11.229
  379    H    GLY  46           HN       GLY  46  83.272  -8.951  12.494
  380    HA2  GLY  46           HA2      GLY  46  85.914  -9.034  12.672
  381    HA3  GLY  46           HA1      GLY  46  85.625 -10.769  12.534
  382    H    VAL  47           HN       VAL  47  83.415  -8.719  10.862
  383    HA   VAL  47           HA       VAL  47  82.954  -8.605   8.558
  384    HB   VAL  47           HB       VAL  47  85.920  -8.269   8.157
  385   HG11  VAL  47          HG11      VAL  47  85.176  -6.565   6.577
  386   HG12  VAL  47          HG12      VAL  47  83.507  -6.752   7.117
  387   HG13  VAL  47          HG13      VAL  47  84.309  -8.067   6.258
  388   HG21  VAL  47          HG21      VAL  47  85.504  -5.844   8.887
  389   HG22  VAL  47          HG22      VAL  47  85.600  -7.040  10.180
  390   HG23  VAL  47          HG23      VAL  47  84.029  -6.437   9.650
  391    H    GLN  48           HN       GLN  48  84.043 -11.252   9.791
  392    HA   GLN  48           HA       GLN  48  85.577 -12.677   7.917
  393    HB2  GLN  48           HB2      GLN  48  84.562 -13.394  10.237
  394    HB3  GLN  48           HB1      GLN  48  83.228 -13.999   9.256
  395    HG2  GLN  48           HG2      GLN  48  86.148 -14.731   8.883
  396    HG3  GLN  48           HG1      GLN  48  84.928 -15.756   9.638
  397   HE21  GLN  48          HE21      GLN  48  83.003 -16.337   8.193
  398   HE22  GLN  48          HE22      GLN  48  83.281 -16.504   6.527
  399    H    GLY  49           HN       GLY  49  82.129 -11.883   7.852
  400    HA2  GLY  49           HA2      GLY  49  82.081 -12.630   4.986
  401    HA3  GLY  49           HA1      GLY  49  80.914 -13.433   6.038
  402    H1U  RCY  50           H1U      RCY  50  72.679 -13.425   4.025
  403    H1S  RCY  50           H1S      RCY  50  75.515 -10.620   6.504
  404    HB1  RCY  50           HB1      RCY  50  77.269  -9.342   7.461
  405    HB2  RCY  50           HB2      RCY  50  77.807 -11.013   7.306
  406    HA   RCY  50           HA       RCY  50  79.529  -8.975   5.999
  407    HN1  RCY  50           HN1      RCY  50  80.569 -11.084   7.767
  408    H    GLY  51           HN       GLY  51  81.221  -7.903   7.322
  409    HA2  GLY  51           HA2      GLY  51  81.233  -7.687  10.120
  410    HA3  GLY  51           HA1      GLY  51  81.762  -6.397   9.040
  411    H    ASP  52           HN       ASP  52  79.034  -7.662  10.863
  412    HA   ASP  52           HA       ASP  52  77.010  -5.876  10.043
  413    HB2  ASP  52           HB2      ASP  52  77.580  -7.031  12.789
  414    HB3  ASP  52           HB1      ASP  52  76.088  -6.191  12.361
  415    H    ASP  53           HN       ASP  53  79.060  -5.481  12.949
  416    HA   ASP  53           HA       ASP  53  79.240  -3.442  14.223
  417    HB2  ASP  53           HB2      ASP  53  81.116  -2.263  13.313
  418    HB3  ASP  53           HB1      ASP  53  81.304  -3.950  12.840
  419    H    ILE  54           HN       ILE  54  77.288  -2.322  14.402
  420    HA   ILE  54           HA       ILE  54  75.769  -1.053  12.465
  421    HB   ILE  54           HB       ILE  54  76.385   0.305  15.092
  422   HG12  ILE  54          HG12      ILE  54  74.679  -2.148  14.564
  423   HG13  ILE  54          HG11      ILE  54  76.090  -2.048  15.619
  424   HG21  ILE  54          HG21      ILE  54  74.830   1.321  13.341
  425   HG22  ILE  54          HG22      ILE  54  74.123   1.074  14.938
  426   HG23  ILE  54          HG23      ILE  54  73.760  -0.050  13.628
  427   HD11  ILE  54          HD11      ILE  54  74.223  -1.889  17.082
  428   HD12  ILE  54          HD12      ILE  54  73.377  -0.775  16.008
  429   HD13  ILE  54          HD13      ILE  54  74.798  -0.232  16.900
  430    HA   PRO  55           HA       PRO  55  79.006   1.898  11.213
  431    HB2  PRO  55           HB2      PRO  55  78.361   2.060   8.610
  432    HB3  PRO  55           HB1      PRO  55  79.156   0.617   9.272
  433    HG2  PRO  55           HG2      PRO  55  76.302   1.029   8.554
  434    HG3  PRO  55           HG1      PRO  55  77.317  -0.411   8.376
  435    HD2  PRO  55           HD2      PRO  55  75.486   0.042  10.458
  436    HD3  PRO  55           HD1      PRO  55  76.785  -1.171  10.469
  437    H    GLY  56           HN       GLY  56  78.816   4.048   9.897
  438    HA2  GLY  56           HA2      GLY  56  77.924   6.226   9.977
  439    HA3  GLY  56           HA1      GLY  56  76.488   5.433   9.330
  440    H    MET  57           HN       MET  57  77.587   4.440  12.470
  441    HA   MET  57           HA       MET  57  75.160   4.873  13.786
  442    HB2  MET  57           HB2      MET  57  77.237   3.667  14.674
  443    HB3  MET  57           HB1      MET  57  77.839   5.257  15.142
  444    HG2  MET  57           HG2      MET  57  76.708   4.304  17.057
  445    HG3  MET  57           HG1      MET  57  75.700   5.607  16.427
  446    HE1  MET  57           HE1      MET  57  73.017   5.055  16.481
  447    HE2  MET  57           HE2      MET  57  74.045   4.761  17.882
  448    HE3  MET  57           HE3      MET  57  72.822   3.576  17.430
  449    H    GLU  58           HN       GLU  58  77.377   7.206  12.653
  450    HA   GLU  58           HA       GLU  58  75.794   9.351  13.983
  451    HB2  GLU  58           HB2      GLU  58  78.816   9.423  13.757
  452    HB3  GLU  58           HB1      GLU  58  77.778  10.588  14.580
  453    HG2  GLU  58           HG2      GLU  58  77.024   8.719  16.100
  454    HG3  GLU  58           HG1      GLU  58  78.266   7.703  15.365
  455    H    GLY  59           HN       GLY  59  77.578   8.125  11.287
  456    HA2  GLY  59           HA2      GLY  59  77.302  10.699   9.819
  457    HA3  GLY  59           HA1      GLY  59  78.274   9.324   9.292
  458    H1U  RCY  60           H1U      RCY  60  75.931   5.322   1.031
  459    H1S  RCY  60           H1S      RCY  60  77.545   7.036   4.459
  460    HB1  RCY  60           HB1      RCY  60  75.129   6.422   5.855
  461    HB2  RCY  60           HB2      RCY  60  75.415   5.258   7.148
  462    HA   RCY  60           HA       RCY  60  74.518   8.060   7.307
  463    HN1  RCY  60           HN1      RCY  60  76.836   7.241   8.996
  464    H    GLY  61           HN       GLY  61  73.549   5.231   7.341
  465    HA2  GLY  61           HA2      GLY  61  72.930   4.305   9.929
  466    HA3  GLY  61           HA1      GLY  61  71.681   5.478   9.508
  467    H    THR  62           HN       THR  62  70.371   5.053   7.607
  468    HA   THR  62           HA       THR  62  70.520   2.258   6.589
  469    HB   THR  62           HB       THR  62  68.145   1.925   6.918
  470    HG1  THR  62           HG1      THR  62  67.920   4.336   8.307
  471   HG21  THR  62          HG21      THR  62  69.243   3.126   9.470
  472   HG22  THR  62          HG22      THR  62  69.734   1.549   8.853
  473   HG23  THR  62          HG23      THR  62  68.056   1.830   9.318
  474    H    ASP  63           HN       ASP  63  67.632   3.531   5.696
  475    HA   ASP  63           HA       ASP  63  68.253   3.793   2.959
  476    HB2  ASP  63           HB2      ASP  63  66.089   5.421   4.303
  477    HB3  ASP  63           HB1      ASP  63  66.087   4.731   2.680
  478    H    ILE  64           HN       ILE  64  68.065   6.301   5.472
  479    HA   ILE  64           HA       ILE  64  70.166   7.861   4.322
  480    HB   ILE  64           HB       ILE  64  68.593   8.419   2.565
  481   HG12  ILE  64          HG12      ILE  64  68.243  10.820   4.292
  482   HG13  ILE  64          HG11      ILE  64  69.899  10.265   4.039
  483   HG21  ILE  64          HG21      ILE  64  66.708   8.974   4.868
  484   HG22  ILE  64          HG22      ILE  64  66.502   7.799   3.568
  485   HG23  ILE  64          HG23      ILE  64  66.399   9.525   3.221
  486   HD11  ILE  64          HD11      ILE  64  67.929  10.735   1.786
  487   HD12  ILE  64          HD12      ILE  64  69.658  10.414   1.642
  488   HD13  ILE  64          HD13      ILE  64  69.098  11.940   2.328
  489    H    THR  65           HN       THR  65  69.707   6.967   6.891
  490    HA   THR  65           HA       THR  65  68.277   8.502   8.714
  491    HB   THR  65           HB       THR  65  71.172   7.635   8.988
  492    HG1  THR  65           HG1      THR  65  68.769   6.417   9.866
  493   HG21  THR  65          HG21      THR  65  70.502   7.649  11.467
  494   HG22  THR  65          HG22      THR  65  69.128   8.637  10.971
  495   HG23  THR  65          HG23      THR  65  70.773   9.218  10.711
  496    H    VAL  66           HN       VAL  66  70.850   9.498   6.660
  497    HA   VAL  66           HA       VAL  66  70.592  12.269   7.684
  498    HB   VAL  66           HB       VAL  66  73.238  10.854   7.211
  499   HG11  VAL  66          HG11      VAL  66  72.477  13.718   7.776
  500   HG12  VAL  66          HG12      VAL  66  73.561  13.093   6.534
  501   HG13  VAL  66          HG13      VAL  66  74.064  13.095   8.224
  502   HG21  VAL  66          HG21      VAL  66  72.336  10.186   9.342
  503   HG22  VAL  66          HG22      VAL  66  71.835  11.836   9.711
  504   HG23  VAL  66          HG23      VAL  66  73.549  11.424   9.666
  505    H    ILE  67           HN       ILE  67  73.021  11.053   5.456
  506    HA   ILE  67           HA       ILE  67  71.427  12.056   3.149
  507    HB   ILE  67           HB       ILE  67  74.245  12.896   3.885
  508   HG12  ILE  67          HG12      ILE  67  72.372  14.195   4.871
  509   HG13  ILE  67          HG11      ILE  67  73.287  15.156   3.708
  510   HG21  ILE  67          HG21      ILE  67  74.419  12.480   1.572
  511   HG22  ILE  67          HG22      ILE  67  73.992  14.190   1.645
  512   HG23  ILE  67          HG23      ILE  67  72.759  12.988   1.264
  513   HD11  ILE  67          HD11      ILE  67  70.509  14.117   3.534
  514   HD12  ILE  67          HD12      ILE  67  71.454  14.067   2.046
  515   HD13  ILE  67          HD13      ILE  67  71.200  15.601   2.877
  516    H1U  RCY  68           H1U      RCY  68  68.186   2.167   1.777
  517    H1S  RCY  68           H1S      RCY  68  71.247   5.261   0.626
  518    HB1  RCY  68           HB1      RCY  68  71.452   7.155   0.522
  519    HB2  RCY  68           HB2      RCY  68  70.715   7.827   1.976
  520    HA   RCY  68           HA       RCY  68  73.574   8.227   2.061
  521    HN1  RCY  68           HN1      RCY  68  71.183   9.894   2.384
  522    HA   PRO  69           HA       PRO  69  74.893  10.402  -1.641
  523    HB2  PRO  69           HB2      PRO  69  76.058   7.686  -2.148
  524    HB3  PRO  69           HB1      PRO  69  76.816   9.283  -2.298
  525    HG2  PRO  69           HG2      PRO  69  77.284   7.714  -0.197
  526    HG3  PRO  69           HG1      PRO  69  77.171   9.474  -0.032
  527    HD2  PRO  69           HD2      PRO  69  75.247   7.383   0.845
  528    HD3  PRO  69           HD1      PRO  69  75.498   9.023   1.479
  529    H    TRP  70           HN       TRP  70  72.595   7.937  -1.549
  530    HA   TRP  70           HA       TRP  70  72.559   7.267  -4.366
  531    HD1  TRP  70           HD1      TRP  70  72.138   5.180  -5.255
  532    HE1  TRP  70           HE1      TRP  70  70.426   4.200  -6.913
  533    HE3  TRP  70           HE3      TRP  70  67.799   6.769  -3.082
  534    HZ2  TRP  70           HZ2      TRP  70  67.586   4.103  -7.271
  535    HZ3  TRP  70           HZ3      TRP  70  65.610   6.221  -4.099
  536    HH2  TRP  70           HH2      TRP  70  65.495   4.892  -6.187
  537    HB2  TRP  70           HB2      TRP  70  71.497   5.916  -2.461
  538    HB3  TRP  70           HB1      TRP  70  70.184   7.093  -2.506
  539    H    GLU  71           HN       GLU  71  71.119   9.823  -2.420
  540    HA   GLU  71           HA       GLU  71  69.266  10.678  -4.495
  541    HB2  GLU  71           HB2      GLU  71  70.315  11.961  -1.967
  542    HB3  GLU  71           HB1      GLU  71  69.265  12.837  -3.081
  543    HG2  GLU  71           HG2      GLU  71  67.605  10.967  -2.898
  544    HG3  GLU  71           HG1      GLU  71  68.628  10.234  -1.662
  545    H    ALA  72           HN       ALA  72  72.629  11.231  -3.776
  546    HA   ALA  72           HA       ALA  72  72.861  13.631  -5.413
  547    HB1  ALA  72           HB1      ALA  72  75.271  13.364  -5.081
  548    HB2  ALA  72           HB2      ALA  72  75.025  11.735  -4.453
  549    HB3  ALA  72           HB3      ALA  72  74.432  13.127  -3.548
  550    H1U  RCY  73           H1U      RCY  73  78.846  14.316  -8.626
  551    H1S  RCY  73           H1S      RCY  73  75.633  11.535  -6.252
  552    HB1  RCY  73           HB1      RCY  73  76.353   9.483  -8.583
  553    HB2  RCY  73           HB2      RCY  73  75.257   8.221  -8.021
  554    HA   RCY  73           HA       RCY  73  74.646  10.949  -8.740
  555    HN1  RCY  73           HN1      RCY  73  74.492  10.475  -5.860
  556    H    ASN  74           HN       ASN  74  73.006   8.529  -6.669
  557    HA   ASN  74           HA       ASN  74  71.033   7.318  -7.059
  558    HB2  ASN  74           HB2      ASN  74  70.337   9.700  -7.915
  559    HB3  ASN  74           HB1      ASN  74  70.498   8.978  -9.516
  560   HD21  ASN  74          HD21      ASN  74  68.360   8.564 -10.156
  561   HD22  ASN  74          HD22      ASN  74  67.228   7.710  -9.223
  562    H    HIS  75           HN       HIS  75  69.869   6.436  -9.415
  563    HA   HIS  75           HA       HIS  75  70.193   4.604 -10.865
  564    HD1  HIS  75           HD1      HIS  75  72.142   8.398 -10.891
  565    HD2  HIS  75           HD2      HIS  75  74.323   5.324 -12.678
  566    HE1  HIS  75           HE1      HIS  75  74.567   9.129 -10.858
  567    HE2  HIS  75           HE2      HIS  75  75.906   7.266 -11.943
  568    HB2  HIS  75           HB2      HIS  75  71.515   5.193 -12.805
  569    HB3  HIS  75           HB1      HIS  75  70.684   6.642 -12.246
  570    H1U  RCY  76           H1U      RCY  76  72.357  -3.288  -3.505
  571    H1S  RCY  76           H1S      RCY  76  72.555  -0.467  -6.580
  572    HB1  RCY  76           HB1      RCY  76  71.965   0.707  -8.173
  573    HB2  RCY  76           HB2      RCY  76  72.096   2.317  -7.466
  574    HA   RCY  76           HA       RCY  76  73.922   2.660  -9.339
  575    HN1  RCY  76           HN1      RCY  76  70.975   2.804  -9.834
  576    H    GLU  77           HN       GLU  77  73.216   2.245 -11.965
  577    HA   GLU  77           HA       GLU  77  72.617  -0.542 -12.508
  578    HB2  GLU  77           HB2      GLU  77  73.643   0.161 -14.833
  579    HB3  GLU  77           HB1      GLU  77  72.082   0.806 -14.333
  580    HG2  GLU  77           HG2      GLU  77  74.403   2.365 -13.383
  581    HG3  GLU  77           HG1      GLU  77  74.198   2.354 -15.135
  582    H    LEU  78           HN       LEU  78  75.377   0.567 -14.226
  583    HA   LEU  78           HA       LEU  78  77.501  -0.431 -14.412
  584    HG   LEU  78           HG       LEU  78  78.836   1.335 -13.692
  585    HB2  LEU  78           HB2      LEU  78  77.168   0.129 -11.463
  586    HB3  LEU  78           HB1      LEU  78  78.658  -0.574 -12.093
  587   HD11  LEU  78          HD11      LEU  78  76.346   2.184 -12.208
  588   HD12  LEU  78          HD12      LEU  78  76.594   2.067 -13.950
  589   HD13  LEU  78          HD13      LEU  78  77.375   3.356 -13.032
  590   HD21  LEU  78          HD21      LEU  78  78.577   2.152 -10.779
  591   HD22  LEU  78          HD22      LEU  78  79.518   2.993 -12.010
  592   HD23  LEU  78          HD23      LEU  78  79.991   1.375 -11.491
  593    H    HIS  79           HN       HIS  79  78.030  -2.031 -11.595
  594    HA   HIS  79           HA       HIS  79  77.925  -4.282 -10.958
  595    HD1  HIS  79           HD1      HIS  79  76.977  -7.200 -12.089
  596    HD2  HIS  79           HD2      HIS  79  74.680  -5.113  -9.303
  597    HE1  HIS  79           HE1      HIS  79  76.435  -8.840 -10.237
  598    HE2  HIS  79           HE2      HIS  79  75.036  -7.582  -8.535
  599    HB2  HIS  79           HB2      HIS  79  75.391  -3.758 -11.603
  600    HB3  HIS  79           HB1      HIS  79  75.750  -4.849 -12.941
  601    H    GLU  80           HN       GLU  80  78.990  -3.138 -13.763
  602    HA   GLU  80           HA       GLU  80  79.187  -5.547 -15.377
  603    HB2  GLU  80           HB2      GLU  80  79.435  -3.010 -16.063
  604    HB3  GLU  80           HB1      GLU  80  81.122  -3.258 -15.619
  605    HG2  GLU  80           HG2      GLU  80  79.549  -4.882 -17.640
  606    HG3  GLU  80           HG1      GLU  80  80.824  -3.720 -18.005
  607    H    LEU  81           HN       LEU  81  81.509  -3.733 -13.347
  608    HA   LEU  81           HA       LEU  81  83.517  -5.835 -13.562
  609    HG   LEU  81           HG       LEU  81  85.173  -2.609 -13.244
  610    HB2  LEU  81           HB2      LEU  81  83.263  -3.315 -11.915
  611    HB3  LEU  81           HB1      LEU  81  84.582  -4.454 -11.648
  612   HD11  LEU  81          HD11      LEU  81  85.922  -5.184 -13.314
  613   HD12  LEU  81          HD12      LEU  81  86.482  -4.018 -14.513
  614   HD13  LEU  81          HD13      LEU  81  85.138  -5.096 -14.891
  615   HD21  LEU  81          HD21      LEU  81  82.786  -2.604 -14.216
  616   HD22  LEU  81          HD22      LEU  81  83.300  -3.995 -15.170
  617   HD23  LEU  81          HD23      LEU  81  84.113  -2.443 -15.367
  618    H    ALA  82           HN       ALA  82  80.665  -5.527 -11.816
  619    HA   ALA  82           HA       ALA  82  81.413  -6.654  -9.286
  620    HB1  ALA  82           HB1      ALA  82  78.991  -7.251  -9.118
  621    HB2  ALA  82           HB2      ALA  82  78.787  -6.758 -10.799
  622    HB3  ALA  82           HB3      ALA  82  79.251  -5.570  -9.581
  623    H    GLN  83           HN       GLN  83  81.155  -8.874  -8.571
  624    HA   GLN  83           HA       GLN  83  80.726 -10.960 -10.597
  625    HB2  GLN  83           HB2      GLN  83  83.063 -11.951  -9.706
  626    HB3  GLN  83           HB1      GLN  83  82.976 -10.892 -11.114
  627    HG2  GLN  83           HG2      GLN  83  83.550  -8.962  -9.794
  628    HG3  GLN  83           HG1      GLN  83  83.397  -9.875  -8.292
  629   HE21  GLN  83          HE21      GLN  83  84.784 -12.252  -9.005
  630   HE22  GLN  83          HE22      GLN  83  86.414 -11.872  -9.287
  631    H    TYR  84           HN       TYR  84  82.669 -11.341  -7.674
  632    HA   TYR  84           HA       TYR  84  80.445 -12.049  -5.956
  633    HD1  TYR  84           HD2      TYR  84  78.517 -14.217  -6.487
  634    HD2  TYR  84           HD1      TYR  84  82.174 -15.125  -4.424
  635    HE1  TYR  84           HE2      TYR  84  77.225 -15.326  -4.684
  636    HE2  TYR  84           HE1      TYR  84  80.881 -16.235  -2.621
  637    HH   TYR  84           HH       TYR  84  77.905 -15.787  -1.953
  638    HB2  TYR  84           HB2      TYR  84  80.690 -14.023  -7.603
  639    HB3  TYR  84           HB1      TYR  84  82.189 -14.385  -6.751
  640    H    GLY  85           HN       GLY  85  81.871 -10.418  -4.900
  641    HA2  GLY  85           HA2      GLY  85  83.289 -11.328  -2.725
  642    HA3  GLY  85           HA1      GLY  85  84.516 -11.251  -3.994
  643    H    ILE  86           HN       ILE  86  82.431  -9.030  -4.970
  644    HA   ILE  86           HA       ILE  86  84.063  -6.791  -4.270
  645    HB   ILE  86           HB       ILE  86  81.801  -5.549  -4.969
  646   HG12  ILE  86          HG12      ILE  86  81.386  -8.211  -6.314
  647   HG13  ILE  86          HG11      ILE  86  80.662  -7.898  -4.737
  648   HG21  ILE  86          HG21      ILE  86  82.453  -5.928  -7.349
  649   HG22  ILE  86          HG22      ILE  86  83.518  -7.230  -6.820
  650   HG23  ILE  86          HG23      ILE  86  83.837  -5.571  -6.317
  651   HD11  ILE  86          HD11      ILE  86  79.213  -7.331  -6.769
  652   HD12  ILE  86          HD12      ILE  86  80.332  -6.001  -7.068
  653   HD13  ILE  86          HD13      ILE  86  79.402  -6.051  -5.570
  654    H1U  RCY  87           H1U      RCY  87  80.929   1.064  -4.326
  655    H1S  RCY  87           H1S      RCY  87  82.294  -3.308  -2.684
  656    HB1  RCY  87           HB1      RCY  87  84.631  -4.828   0.168
  657    HB2  RCY  87           HB2      RCY  87  83.283  -3.746   0.522
  658    HA   RCY  87           HA       RCY  87  82.749  -6.220  -0.094
  659    HN1  RCY  87           HN1      RCY  87  84.090  -5.543  -2.482
  Start of MODEL   66
    1    HA   MET   1           HA       MET   1  57.145 -15.548   8.402
    2    HB2  MET   1           HB2      MET   1  55.257 -16.606   9.837
    3    HB3  MET   1           HB1      MET   1  55.836 -15.003  10.291
    4    HG2  MET   1           HG2      MET   1  53.507 -15.339   8.403
    5    HG3  MET   1           HG1      MET   1  53.274 -15.355  10.152
    6    HE1  MET   1           HE1      MET   1  52.800 -12.903  11.442
    7    HE2  MET   1           HE2      MET   1  54.367 -12.098  11.467
    8    HE3  MET   1           HE3      MET   1  54.279 -13.847  11.660
    9    H    ASN   2           HN       ASN   2  54.063 -15.597   6.657
   10    HA   ASN   2           HA       ASN   2  54.940 -17.912   5.118
   11    HB2  ASN   2           HB2      ASN   2  52.836 -19.235   5.792
   12    HB3  ASN   2           HB1      ASN   2  54.164 -19.208   6.954
   13   HD21  ASN   2          HD21      ASN   2  53.900 -17.884   8.898
   14   HD22  ASN   2          HD22      ASN   2  52.377 -17.299   9.364
   15    H    LEU   3           HN       LEU   3  53.721 -15.058   5.029
   16    HA   LEU   3           HA       LEU   3  51.838 -15.681   2.812
   17    HG   LEU   3           HG       LEU   3  49.752 -16.025   3.528
   18    HB2  LEU   3           HB2      LEU   3  51.000 -14.742   5.349
   19    HB3  LEU   3           HB1      LEU   3  50.932 -13.341   4.283
   20   HD11  LEU   3          HD11      LEU   3  48.511 -13.670   4.967
   21   HD12  LEU   3          HD12      LEU   3  48.527 -15.360   5.471
   22   HD13  LEU   3          HD13      LEU   3  47.548 -14.860   4.092
   23   HD21  LEU   3          HD21      LEU   3  50.307 -14.315   1.747
   24   HD22  LEU   3          HD22      LEU   3  49.159 -13.225   2.525
   25   HD23  LEU   3          HD23      LEU   3  48.599 -14.746   1.831
   26    H    GLU   4           HN       GLU   4  54.241 -13.683   4.284
   27    HA   GLU   4           HA       GLU   4  54.014 -11.388   2.569
   28    HB2  GLU   4           HB2      GLU   4  56.332 -10.903   3.304
   29    HB3  GLU   4           HB1      GLU   4  55.311 -11.351   4.668
   30    HG2  GLU   4           HG2      GLU   4  57.218 -12.659   5.033
   31    HG3  GLU   4           HG1      GLU   4  56.158 -13.778   4.175
   32    HA   PRO   5           HA       PRO   5  55.412 -12.568  -1.443
   33    HB2  PRO   5           HB2      PRO   5  57.741 -10.756  -0.879
   34    HB3  PRO   5           HB1      PRO   5  56.738 -10.871  -2.339
   35    HG2  PRO   5           HG2      PRO   5  56.381  -8.951  -0.494
   36    HG3  PRO   5           HG1      PRO   5  55.043  -9.631  -1.434
   37    HD2  PRO   5           HD2      PRO   5  55.622  -9.934   1.435
   38    HD3  PRO   5           HD1      PRO   5  54.122 -10.287   0.551
   39    HA   PRO   6           HA       PRO   6  58.430 -15.708  -0.329
   40    HB2  PRO   6           HB2      PRO   6  58.574 -17.006  -2.708
   41    HB3  PRO   6           HB1      PRO   6  57.150 -17.117  -1.653
   42    HG2  PRO   6           HG2      PRO   6  57.558 -15.452  -4.090
   43    HG3  PRO   6           HG1      PRO   6  56.129 -16.363  -3.571
   44    HD2  PRO   6           HD2      PRO   6  56.403 -13.643  -3.224
   45    HD3  PRO   6           HD1      PRO   6  55.392 -14.670  -2.183
   46    H    LYS   7           HN       LYS   7  60.641 -15.570  -0.243
   47    HA   LYS   7           HA       LYS   7  62.033 -13.825  -2.175
   48    HB2  LYS   7           HB2      LYS   7  64.033 -14.401  -0.658
   49    HB3  LYS   7           HB1      LYS   7  62.733 -13.455   0.064
   50    HG2  LYS   7           HG2      LYS   7  62.482 -16.418   0.233
   51    HG3  LYS   7           HG1      LYS   7  63.719 -15.666   1.242
   52    HD2  LYS   7           HD2      LYS   7  60.970 -14.469   1.182
   53    HD3  LYS   7           HD1      LYS   7  61.252 -15.918   2.148
   54    HE2  LYS   7           HE2      LYS   7  63.067 -14.795   3.351
   55    HE3  LYS   7           HE1      LYS   7  62.863 -13.356   2.352
   56    HZ1  LYS   7           HZ1      LYS   7  61.071 -12.716   3.499
   57    HZ2  LYS   7           HZ2      LYS   7  61.639 -13.768   4.706
   58    HZ3  LYS   7           HZ3      LYS   7  60.443 -14.288   3.618
   59    H    ALA   8           HN       ALA   8  61.558 -17.186  -1.515
   60    HA   ALA   8           HA       ALA   8  62.533 -19.123  -2.445
   61    HB1  ALA   8           HB1      ALA   8  62.519 -17.273  -4.851
   62    HB2  ALA   8           HB2      ALA   8  61.167 -18.271  -4.314
   63    HB3  ALA   8           HB3      ALA   8  62.641 -19.032  -4.912
   64    H    GLU   9           HN       GLU   9  64.314 -17.772  -4.956
   65    HA   GLU   9           HA       GLU   9  66.819 -17.704  -3.321
   66    HB2  GLU   9           HB2      GLU   9  66.286 -19.203  -5.895
   67    HB3  GLU   9           HB1      GLU   9  67.919 -18.812  -5.353
   68    HG2  GLU   9           HG2      GLU   9  65.939 -20.233  -3.567
   69    HG3  GLU   9           HG1      GLU   9  67.008 -21.110  -4.663
   70    H1U  RCY  10           H1U      RCY  10  62.568  -7.912  -7.719
   71    H1S  RCY  10           H1S      RCY  10  63.779 -11.398  -9.331
   72    HB1  RCY  10           HB1      RCY  10  64.082 -13.628  -6.364
   73    HB2  RCY  10           HB2      RCY  10  64.158 -14.994  -7.477
   74    HA   RCY  10           HA       RCY  10  66.728 -14.827  -7.182
   75    HN1  RCY  10           HN1      RCY  10  64.799 -16.161  -5.513
   76    H    ARG  11           HN       ARG  11  65.376 -12.138  -6.353
   77    HA   ARG  11           HA       ARG  11  66.395 -11.489  -3.748
   78    HE   ARG  11           HE       ARG  11  68.714 -11.994  -3.076
   79    HB2  ARG  11           HB2      ARG  11  68.579 -11.792  -4.819
   80    HB3  ARG  11           HB1      ARG  11  68.111 -10.710  -6.129
   81    HG2  ARG  11           HG2      ARG  11  69.531  -9.606  -4.366
   82    HG3  ARG  11           HG1      ARG  11  67.966  -8.828  -4.607
   83    HD2  ARG  11           HD2      ARG  11  68.799  -9.372  -2.165
   84    HD3  ARG  11           HD1      ARG  11  67.107  -9.625  -2.594
   85   HH11  ARG  11          HH21      ARG  11  67.059 -10.084  -0.732
   86   HH12  ARG  11          HH22      ARG  11  66.770 -11.412   0.341
   87   HH21  ARG  11          HH11      ARG  11  68.345 -13.740  -1.689
   88   HH22  ARG  11          HH12      ARG  11  67.498 -13.482  -0.200
   89    H    SER  12           HN       SER  12  64.826 -10.790  -6.647
   90    HA   SER  12           HA       SER  12  64.664  -7.949  -6.612
   91    HG   SER  12           HG       SER  12  63.617  -9.391  -9.538
   92    HB2  SER  12           HB2      SER  12  62.464  -9.864  -7.430
   93    HB3  SER  12           HB1      SER  12  62.683  -8.206  -7.980
   94    H    ALA  13           HN       ALA  13  61.496  -8.483  -6.409
   95    HA   ALA  13           HA       ALA  13  59.880  -7.950  -4.793
   96    HB1  ALA  13           HB1      ALA  13  60.889 -10.155  -3.897
   97    HB2  ALA  13           HB2      ALA  13  60.002  -9.147  -2.753
   98    HB3  ALA  13           HB3      ALA  13  61.766  -9.136  -2.755
   99    H    THR  14           HN       THR  14  60.930  -5.695  -5.330
  100    HA   THR  14           HA       THR  14  61.673  -4.457  -2.717
  101    HB   THR  14           HB       THR  14  63.775  -4.572  -3.840
  102    HG1  THR  14           HG1      THR  14  64.068  -2.541  -3.497
  103   HG21  THR  14          HG21      THR  14  62.218  -3.710  -6.288
  104   HG22  THR  14          HG22      THR  14  63.081  -5.229  -6.045
  105   HG23  THR  14          HG23      THR  14  63.981  -3.723  -6.218
  106    H    ARG  15           HN       ARG  15  59.186  -4.179  -3.126
  107    HA   ARG  15           HA       ARG  15  58.814  -1.430  -4.098
  108    HE   ARG  15           HE       ARG  15  55.461  -0.690  -7.773
  109    HB2  ARG  15           HB2      ARG  15  58.219  -3.644  -5.792
  110    HB3  ARG  15           HB1      ARG  15  56.674  -3.005  -5.241
  111    HG2  ARG  15           HG2      ARG  15  58.828  -1.148  -6.240
  112    HG3  ARG  15           HG1      ARG  15  57.745  -1.959  -7.372
  113    HD2  ARG  15           HD2      ARG  15  56.553  -0.561  -5.007
  114    HD3  ARG  15           HD1      ARG  15  57.112   0.412  -6.368
  115   HH11  ARG  15          HH21      ARG  15  55.472  -1.586  -4.443
  116   HH12  ARG  15          HH22      ARG  15  53.887  -2.283  -4.488
  117   HH21  ARG  15          HH11      ARG  15  53.391  -1.595  -7.851
  118   HH22  ARG  15          HH12      ARG  15  52.709  -2.289  -6.417
  119    H    VAL  16           HN       VAL  16  58.375  -3.620  -1.788
  120    HA   VAL  16           HA       VAL  16  55.876  -2.308  -0.831
  121    HB   VAL  16           HB       VAL  16  56.392  -5.298  -0.772
  122   HG11  VAL  16          HG11      VAL  16  55.211  -4.722   1.215
  123   HG12  VAL  16          HG12      VAL  16  53.972  -5.259   0.081
  124   HG13  VAL  16          HG13      VAL  16  54.215  -3.536   0.370
  125   HG21  VAL  16          HG21      VAL  16  54.408  -3.594  -2.311
  126   HG22  VAL  16          HG22      VAL  16  54.347  -5.354  -2.222
  127   HG23  VAL  16          HG23      VAL  16  55.717  -4.557  -2.994
  128    H    MET  17           HN       MET  17  58.683  -4.351  -0.043
  129    HA   MET  17           HA       MET  17  59.638  -2.876   2.110
  130    HB2  MET  17           HB2      MET  17  57.193  -4.356   2.805
  131    HB3  MET  17           HB1      MET  17  58.547  -4.774   3.849
  132    HG2  MET  17           HG2      MET  17  58.099  -1.879   3.256
  133    HG3  MET  17           HG1      MET  17  56.988  -2.669   4.374
  134    HE1  MET  17           HE1      MET  17  57.548  -2.258   6.936
  135    HE2  MET  17           HE2      MET  17  57.680  -0.863   5.868
  136    HE3  MET  17           HE3      MET  17  58.895  -1.127   7.116
  137    H    GLY  18           HN       GLY  18  58.816  -6.277   2.623
  138    HA2  GLY  18           HA2      GLY  18  60.537  -7.887   1.449
  139    HA3  GLY  18           HA1      GLY  18  61.708  -6.928   2.356
  140    H    GLY  19           HN       GLY  19  58.699  -8.794   2.884
  141    HA2  GLY  19           HA2      GLY  19  58.069 -10.158   4.686
  142    HA3  GLY  19           HA1      GLY  19  59.793 -10.468   4.897
  143    HA   PRO  20           HA       PRO  20  57.919  -8.282   8.685
  144    HB2  PRO  20           HB2      PRO  20  60.129 -10.006   9.752
  145    HB3  PRO  20           HB1      PRO  20  58.533  -9.662  10.449
  146    HG2  PRO  20           HG2      PRO  20  59.057 -11.972   9.225
  147    HG3  PRO  20           HG1      PRO  20  57.470 -11.194   9.111
  148    HD2  PRO  20           HD2      PRO  20  59.584 -11.448   7.038
  149    HD3  PRO  20           HD1      PRO  20  57.830 -11.241   6.843
  150    H1U  RCY  21           H1U      RCY  21  60.820  -5.595   1.477
  151    H1S  RCY  21           H1S      RCY  21  62.035  -4.152   5.031
  152    HB1  RCY  21           HB1      RCY  21  60.933  -3.846   7.106
  153    HB2  RCY  21           HB2      RCY  21  60.433  -5.406   6.454
  154    HA   RCY  21           HA       RCY  21  61.604  -5.799   9.059
  155    HN1  RCY  21           HN1      RCY  21  58.741  -6.207   8.337
  156    H    THR  22           HN       THR  22  61.329  -4.703  10.966
  157    HA   THR  22           HA       THR  22  59.135  -2.788  11.292
  158    HB   THR  22           HB       THR  22  59.877  -4.212  13.181
  159    HG1  THR  22           HG1      THR  22  60.657  -1.843  14.209
  160   HG21  THR  22          HG21      THR  22  62.326  -4.098  12.423
  161   HG22  THR  22          HG22      THR  22  62.032  -3.992  14.159
  162   HG23  THR  22          HG23      THR  22  62.387  -2.533  13.234
  163    HA   PRO  23           HA       PRO  23  61.124   0.830   9.634
  164    HB2  PRO  23           HB2      PRO  23  60.208   2.050  12.218
  165    HB3  PRO  23           HB1      PRO  23  60.043   2.668  10.562
  166    HG2  PRO  23           HG2      PRO  23  58.007   1.503  11.856
  167    HG3  PRO  23           HG1      PRO  23  58.230   1.344  10.107
  168    HD2  PRO  23           HD2      PRO  23  58.585  -0.695  12.219
  169    HD3  PRO  23           HD1      PRO  23  58.327  -0.913  10.475
  170    H    ARG  24           HN       ARG  24  62.823   2.477  10.318
  171    HA   ARG  24           HA       ARG  24  64.861   1.132  11.964
  172    HE   ARG  24           HE       ARG  24  64.565   6.509   8.434
  173    HB2  ARG  24           HB2      ARG  24  66.137   3.339  11.292
  174    HB3  ARG  24           HB1      ARG  24  65.845   2.096  10.075
  175    HG2  ARG  24           HG2      ARG  24  63.942   3.283   9.204
  176    HG3  ARG  24           HG1      ARG  24  63.971   4.427  10.546
  177    HD2  ARG  24           HD2      ARG  24  66.100   5.328   9.802
  178    HD3  ARG  24           HD1      ARG  24  66.224   4.098   8.544
  179   HH11  ARG  24          HH21      ARG  24  65.145   3.296   7.328
  180   HH12  ARG  24          HH22      ARG  24  64.311   3.520   5.826
  181   HH21  ARG  24          HH11      ARG  24  63.473   6.820   6.479
  182   HH22  ARG  24          HH12      ARG  24  63.365   5.515   5.346
  183    H    LYS  25           HN       LYS  25  65.931   2.276  13.760
  184    HA   LYS  25           HA       LYS  25  64.087   4.203  15.130
  185    HB2  LYS  25           HB2      LYS  25  65.047   3.283  17.262
  186    HB3  LYS  25           HB1      LYS  25  64.116   2.105  16.339
  187    HG2  LYS  25           HG2      LYS  25  67.013   2.259  15.696
  188    HG3  LYS  25           HG1      LYS  25  66.607   1.600  17.282
  189    HD2  LYS  25           HD2      LYS  25  65.241  -0.115  16.322
  190    HD3  LYS  25           HD1      LYS  25  65.284   0.649  14.733
  191    HE2  LYS  25           HE2      LYS  25  67.556   0.077  14.392
  192    HE3  LYS  25           HE1      LYS  25  67.811  -0.272  16.102
  193    HZ1  LYS  25           HZ1      LYS  25  66.716  -1.945  14.024
  194    HZ2  LYS  25           HZ2      LYS  25  65.818  -1.959  15.466
  195    HZ3  LYS  25           HZ3      LYS  25  67.465  -2.377  15.483
  196    H    GLY  26           HN       GLY  26  65.785   4.967  17.187
  197    HA2  GLY  26           HA2      GLY  26  67.670   6.289  17.693
  198    HA3  GLY  26           HA1      GLY  26  68.393   5.762  16.172
  199    HA   PRO  27           HA       PRO  27  66.616  10.352  16.377
  200    HB2  PRO  27           HB2      PRO  27  69.485  10.644  15.545
  201    HB3  PRO  27           HB1      PRO  27  68.480  11.738  16.515
  202    HG2  PRO  27           HG2      PRO  27  70.291  10.089  17.616
  203    HG3  PRO  27           HG1      PRO  27  68.787  10.540  18.434
  204    HD2  PRO  27           HD2      PRO  27  69.568   7.934  17.301
  205    HD3  PRO  27           HD1      PRO  27  68.283   8.312  18.467
  206    HA   PRO  28           HA       PRO  28  66.115   9.760  11.962
  207    HB2  PRO  28           HB2      PRO  28  64.812  12.067  11.354
  208    HB3  PRO  28           HB1      PRO  28  64.039  10.746  12.253
  209    HG2  PRO  28           HG2      PRO  28  65.201  13.290  13.273
  210    HG3  PRO  28           HG1      PRO  28  63.724  12.445  13.766
  211    HD2  PRO  28           HD2      PRO  28  66.093  12.306  15.167
  212    HD3  PRO  28           HD1      PRO  28  64.853  11.033  15.202
  213    H    LYS  29           HN       LYS  29  67.589  10.058  10.365
  214    HA   LYS  29           HA       LYS  29  69.471  10.938   9.259
  215    HB2  LYS  29           HB2      LYS  29  67.668  13.365   9.466
  216    HB3  LYS  29           HB1      LYS  29  69.048  13.227   8.377
  217    HG2  LYS  29           HG2      LYS  29  67.880  11.020   7.589
  218    HG3  LYS  29           HG1      LYS  29  66.438  11.732   8.313
  219    HD2  LYS  29           HD2      LYS  29  68.146  13.310   6.395
  220    HD3  LYS  29           HD1      LYS  29  66.896  12.214   5.805
  221    HE2  LYS  29           HE2      LYS  29  65.172  13.497   6.653
  222    HE3  LYS  29           HE1      LYS  29  66.155  14.131   7.973
  223    HZ1  LYS  29           HZ1      LYS  29  67.057  14.862   5.327
  224    HZ2  LYS  29           HZ2      LYS  29  66.896  15.815   6.724
  225    HZ3  LYS  29           HZ3      LYS  29  65.541  15.496   5.750
  226    H1U  RCY  30           H1U      RCY  30  73.087  12.817   5.027
  227    H1S  RCY  30           H1S      RCY  30  72.972  13.343   9.657
  228    HB1  RCY  30           HB1      RCY  30  71.906  12.057  12.375
  229    HB2  RCY  30           HB2      RCY  30  73.057  13.322  12.799
  230    HA   RCY  30           HA       RCY  30  71.417  14.504  11.597
  231    HN1  RCY  30           HN1      RCY  30  71.012  12.952   9.237
  232    H    LYS  31           HN       LYS  31  71.681  14.268   8.567
  233    HA   LYS  31           HA       LYS  31  74.004  14.351   7.303
  234    HB2  LYS  31           HB2      LYS  31  73.293  16.857   6.548
  235    HB3  LYS  31           HB1      LYS  31  72.475  15.407   5.970
  236    HG2  LYS  31           HG2      LYS  31  70.822  17.027   6.782
  237    HG3  LYS  31           HG1      LYS  31  70.841  15.611   7.834
  238    HD2  LYS  31           HD2      LYS  31  72.272  16.787   9.437
  239    HD3  LYS  31           HD1      LYS  31  72.336  18.194   8.375
  240    HE2  LYS  31           HE2      LYS  31  70.628  18.812   9.833
  241    HE3  LYS  31           HE1      LYS  31  69.708  18.060   8.529
  242    HZ1  LYS  31           HZ1      LYS  31  70.638  16.609  10.944
  243    HZ2  LYS  31           HZ2      LYS  31  69.573  16.041   9.749
  244    HZ3  LYS  31           HZ3      LYS  31  69.093  17.293  10.793
  245    H    GLN  32           HN       GLN  32  75.774  14.463   8.784
  246    HA   GLN  32           HA       GLN  32  76.334  16.665  10.490
  247    HB2  GLN  32           HB2      GLN  32  77.506  14.307  10.213
  248    HB3  GLN  32           HB1      GLN  32  78.560  15.194   9.114
  249    HG2  GLN  32           HG2      GLN  32  78.040  15.800  12.037
  250    HG3  GLN  32           HG1      GLN  32  79.564  15.292  11.307
  251   HE21  GLN  32          HE21      GLN  32  77.440  18.038  11.846
  252   HE22  GLN  32          HE22      GLN  32  78.461  19.205  11.157
  253    H    ARG  33           HN       ARG  33  77.089  16.084   7.102
  254    HA   ARG  33           HA       ARG  33  77.122  18.858   6.429
  255    HE   ARG  33           HE       ARG  33  82.623  15.947   5.815
  256    HB2  ARG  33           HB2      ARG  33  79.582  19.052   5.911
  257    HB3  ARG  33           HB1      ARG  33  79.214  19.002   7.634
  258    HG2  ARG  33           HG2      ARG  33  79.955  16.777   7.857
  259    HG3  ARG  33           HG1      ARG  33  79.835  16.469   6.124
  260    HD2  ARG  33           HD2      ARG  33  81.681  18.143   5.771
  261    HD3  ARG  33           HD1      ARG  33  81.866  18.231   7.522
  262   HH11  ARG  33          HH21      ARG  33  82.031  17.277   8.940
  263   HH12  ARG  33          HH22      ARG  33  82.959  16.075   9.774
  264   HH21  ARG  33          HH11      ARG  33  83.838  14.370   6.885
  265   HH22  ARG  33          HH12      ARG  33  83.981  14.429   8.610
  266    H    GLN  34           HN       GLN  34  77.023  15.663   5.679
  267    HA   GLN  34           HA       GLN  34  78.237  15.258   3.213
  268    HB2  GLN  34           HB2      GLN  34  75.472  14.350   3.079
  269    HB3  GLN  34           HB1      GLN  34  76.949  13.395   3.204
  270    HG2  GLN  34           HG2      GLN  34  76.999  13.856   5.655
  271    HG3  GLN  34           HG1      GLN  34  75.462  14.706   5.500
  272   HE21  GLN  34          HE21      GLN  34  74.917  12.799   7.123
  273   HE22  GLN  34          HE22      GLN  34  74.337  11.372   6.409
  274    H    THR  35           HN       THR  35  77.824  15.898   1.076
  275    HA   THR  35           HA       THR  35  75.425  17.352   0.338
  276    HB   THR  35           HB       THR  35  77.934  19.019   0.267
  277    HG1  THR  35           HG1      THR  35  76.188  19.650   2.243
  278   HG21  THR  35          HG21      THR  35  75.990  19.681  -1.107
  279   HG22  THR  35          HG22      THR  35  76.292  20.849   0.180
  280   HG23  THR  35          HG23      THR  35  74.977  19.684   0.337
  281    H    ARG  36           HN       ARG  36  76.085  15.285  -1.040
  282    HA   ARG  36           HA       ARG  36  76.902  14.429  -3.078
  283    HE   ARG  36           HE       ARG  36  76.879  16.595  -8.349
  284    HB2  ARG  36           HB2      ARG  36  75.284  15.993  -3.964
  285    HB3  ARG  36           HB1      ARG  36  76.398  17.342  -3.744
  286    HG2  ARG  36           HG2      ARG  36  77.818  16.608  -5.484
  287    HG3  ARG  36           HG1      ARG  36  77.133  14.982  -5.475
  288    HD2  ARG  36           HD2      ARG  36  75.382  15.577  -6.803
  289    HD3  ARG  36           HD1      ARG  36  75.186  17.138  -6.007
  290   HH11  ARG  36          HH21      ARG  36  76.053  18.638  -5.697
  291   HH12  ARG  36          HH22      ARG  36  76.740  20.060  -6.407
  292   HH21  ARG  36          HH11      ARG  36  77.782  18.441  -9.290
  293   HH22  ARG  36          HH12      ARG  36  77.719  19.949  -8.441
  294    H    GLN  37           HN       GLN  37  79.076  13.945  -2.404
  295    HA   GLN  37           HA       GLN  37  81.104  15.459  -3.833
  296    HB2  GLN  37           HB2      GLN  37  82.443  15.849  -1.651
  297    HB3  GLN  37           HB1      GLN  37  81.118  16.957  -2.008
  298    HG2  GLN  37           HG2      GLN  37  79.642  15.804  -0.496
  299    HG3  GLN  37           HG1      GLN  37  80.798  14.489  -0.283
  300   HE21  GLN  37          HE21      GLN  37  82.188  17.666  -0.469
  301   HE22  GLN  37          HE22      GLN  37  82.491  17.858   1.190
  302    H1U  RCY  38           H1U      RCY  38  84.915   5.756   1.112
  303    H1S  RCY  38           H1S      RCY  38  83.957   8.904  -1.205
  304    HB1  RCY  38           HB1      RCY  38  80.613  10.634  -2.762
  305    HB2  RCY  38           HB2      RCY  38  81.943  11.076  -1.694
  306    HA   RCY  38           HA       RCY  38  83.327  11.711  -3.564
  307    HN1  RCY  38           HN1      RCY  38  81.060  13.115  -4.597
  308    H    LYS  39           HN       LYS  39  80.531  11.920  -5.589
  309    HA   LYS  39           HA       LYS  39  80.600   9.533  -7.038
  310    HB2  LYS  39           HB2      LYS  39  80.328  11.834  -8.823
  311    HB3  LYS  39           HB1      LYS  39  79.134  10.614  -8.386
  312    HG2  LYS  39           HG2      LYS  39  78.748  11.807  -6.232
  313    HG3  LYS  39           HG1      LYS  39  79.872  13.062  -6.755
  314    HD2  LYS  39           HD2      LYS  39  77.600  12.316  -8.563
  315    HD3  LYS  39           HD1      LYS  39  77.275  13.347  -7.169
  316    HE2  LYS  39           HE2      LYS  39  79.515  13.935  -9.110
  317    HE3  LYS  39           HE1      LYS  39  77.879  14.547  -9.353
  318    HZ1  LYS  39           HZ1      LYS  39  78.505  15.066  -6.717
  319    HZ2  LYS  39           HZ2      LYS  39  78.399  16.191  -7.986
  320    HZ3  LYS  39           HZ3      LYS  39  79.894  15.485  -7.595
  321    H    SER  40           HN       SER  40  81.391   9.633  -9.513
  322    HA   SER  40           HA       SER  40  83.221   9.605 -10.981
  323    HG   SER  40           HG       SER  40  85.489  10.767 -11.283
  324    HB2  SER  40           HB2      SER  40  83.289  12.090 -10.090
  325    HB3  SER  40           HB1      SER  40  84.718  11.530  -9.228
  326    H    LYS  41           HN       LYS  41  83.204   7.469  -9.430
  327    HA   LYS  41           HA       LYS  41  85.763   7.299  -7.939
  328    HB2  LYS  41           HB2      LYS  41  84.275   4.794  -8.170
  329    HB3  LYS  41           HB1      LYS  41  84.732   5.687  -6.721
  330    HG2  LYS  41           HG2      LYS  41  82.822   7.264  -7.177
  331    HG3  LYS  41           HG1      LYS  41  82.316   6.188  -8.480
  332    HD2  LYS  41           HD2      LYS  41  82.113   4.329  -6.866
  333    HD3  LYS  41           HD1      LYS  41  82.603   5.411  -5.562
  334    HE2  LYS  41           HE2      LYS  41  80.637   6.898  -6.256
  335    HE3  LYS  41           HE1      LYS  41  80.087   5.536  -7.233
  336    HZ1  LYS  41           HZ1      LYS  41  80.541   5.549  -4.300
  337    HZ2  LYS  41           HZ2      LYS  41  80.162   4.163  -5.206
  338    HZ3  LYS  41           HZ3      LYS  41  79.047   5.439  -5.096
  339    HA   PRO  42           HA       PRO  42  87.983   5.364 -11.220
  340    HB2  PRO  42           HB2      PRO  42  89.432   3.444  -9.864
  341    HB3  PRO  42           HB1      PRO  42  89.824   5.174  -9.855
  342    HG2  PRO  42           HG2      PRO  42  88.409   3.546  -7.810
  343    HG3  PRO  42           HG1      PRO  42  89.576   4.862  -7.600
  344    HD2  PRO  42           HD2      PRO  42  86.887   5.218  -7.280
  345    HD3  PRO  42           HD1      PRO  42  87.966   6.513  -7.847
  346    HA   PRO  43           HA       PRO  43  85.946   1.758 -12.742
  347    HB2  PRO  43           HB2      PRO  43  88.050   0.332 -13.866
  348    HB3  PRO  43           HB1      PRO  43  87.243   1.715 -14.630
  349    HG2  PRO  43           HG2      PRO  43  89.811   1.616 -13.139
  350    HG3  PRO  43           HG1      PRO  43  89.372   2.552 -14.578
  351    HD2  PRO  43           HD2      PRO  43  89.493   3.684 -12.112
  352    HD3  PRO  43           HD1      PRO  43  88.326   4.224 -13.341
  353    H    LYS  44           HN       LYS  44  85.197   0.010 -11.675
  354    HA   LYS  44           HA       LYS  44  85.142  -1.497  -9.810
  355    HB2  LYS  44           HB2      LYS  44  87.102  -2.598 -11.835
  356    HB3  LYS  44           HB1      LYS  44  86.439  -3.549 -10.505
  357    HG2  LYS  44           HG2      LYS  44  84.129  -2.907 -11.344
  358    HG3  LYS  44           HG1      LYS  44  84.919  -2.256 -12.781
  359    HD2  LYS  44           HD2      LYS  44  85.693  -4.373 -13.465
  360    HD3  LYS  44           HD1      LYS  44  85.469  -5.073 -11.862
  361    HE2  LYS  44           HE2      LYS  44  83.005  -4.787 -12.121
  362    HE3  LYS  44           HE1      LYS  44  83.273  -4.201 -13.763
  363    HZ1  LYS  44           HZ1      LYS  44  83.113  -6.341 -14.323
  364    HZ2  LYS  44           HZ2      LYS  44  83.355  -6.888 -12.733
  365    HZ3  LYS  44           HZ3      LYS  44  84.688  -6.497 -13.711
  366    H    LYS  45           HN       LYS  45  88.000  -3.055  -9.893
  367    HA   LYS  45           HA       LYS  45  88.860  -2.436  -7.331
  368    HB2  LYS  45           HB2      LYS  45  89.763  -4.140  -9.179
  369    HB3  LYS  45           HB1      LYS  45  90.980  -2.886  -9.400
  370    HG2  LYS  45           HG2      LYS  45  91.984  -4.132  -7.720
  371    HG3  LYS  45           HG1      LYS  45  91.074  -2.975  -6.747
  372    HD2  LYS  45           HD2      LYS  45  89.173  -4.653  -6.715
  373    HD3  LYS  45           HD1      LYS  45  90.284  -5.815  -7.441
  374    HE2  LYS  45           HE2      LYS  45  90.381  -6.181  -5.074
  375    HE3  LYS  45           HE1      LYS  45  91.865  -5.333  -5.506
  376    HZ1  LYS  45           HZ1      LYS  45  91.103  -4.159  -3.688
  377    HZ2  LYS  45           HZ2      LYS  45  89.470  -4.295  -4.139
  378    HZ3  LYS  45           HZ3      LYS  45  90.501  -3.238  -4.980
  379    H    GLY  46           HN       GLY  46  90.602  -1.072  -6.524
  380    HA2  GLY  46           HA2      GLY  46  92.264   0.735  -7.087
  381    HA3  GLY  46           HA1      GLY  46  91.050   1.372  -8.197
  382    H    VAL  47           HN       VAL  47  92.139   1.325  -4.927
  383    HA   VAL  47           HA       VAL  47  89.670   2.686  -3.985
  384    HB   VAL  47           HB       VAL  47  91.322   0.808  -2.780
  385   HG11  VAL  47          HG11      VAL  47  93.016   2.666  -2.504
  386   HG12  VAL  47          HG12      VAL  47  92.508   1.912  -0.993
  387   HG13  VAL  47          HG13      VAL  47  91.854   3.482  -1.457
  388   HG21  VAL  47          HG21      VAL  47  90.033   1.407  -0.708
  389   HG22  VAL  47          HG22      VAL  47  89.015   1.251  -2.140
  390   HG23  VAL  47          HG23      VAL  47  89.452   2.850  -1.539
  391    H    GLN  48           HN       GLN  48  92.990   3.291  -4.832
  392    HA   GLN  48           HA       GLN  48  94.114   5.336  -5.107
  393    HB2  GLN  48           HB2      GLN  48  91.571   6.003  -5.657
  394    HB3  GLN  48           HB1      GLN  48  91.757   6.919  -4.162
  395    HG2  GLN  48           HG2      GLN  48  93.868   7.907  -5.115
  396    HG3  GLN  48           HG1      GLN  48  93.485   7.116  -6.644
  397   HE21  GLN  48          HE21      GLN  48  92.431   8.502  -8.063
  398   HE22  GLN  48          HE22      GLN  48  91.366   9.743  -7.609
  399    H    GLY  49           HN       GLY  49  91.830   5.788  -2.384
  400    HA2  GLY  49           HA2      GLY  49  94.003   5.688  -0.439
  401    HA3  GLY  49           HA1      GLY  49  93.357   7.314  -0.675
  402    H1U  RCY  50           H1U      RCY  50  84.599   4.950   1.696
  403    H1S  RCY  50           H1S      RCY  50  87.991   2.300   1.043
  404    HB1  RCY  50           HB1      RCY  50  90.361   3.714   3.354
  405    HB2  RCY  50           HB2      RCY  50  91.859   3.486   2.452
  406    HA   RCY  50           HA       RCY  50  90.184   5.960   2.053
  407    HN1  RCY  50           HN1      RCY  50  93.116   5.931   1.799
  408    H    GLY  51           HN       GLY  51  92.537   4.411   4.206
  409    HA2  GLY  51           HA2      GLY  51  93.358   5.097   6.306
  410    HA3  GLY  51           HA1      GLY  51  92.890   6.747   5.888
  411    H    ASP  52           HN       ASP  52  91.244   7.573   7.079
  412    HA   ASP  52           HA       ASP  52  88.946   5.916   7.816
  413    HB2  ASP  52           HB2      ASP  52  90.885   6.937   9.907
  414    HB3  ASP  52           HB1      ASP  52  89.225   6.472  10.283
  415    H    ASP  53           HN       ASP  53  90.467   8.877   7.222
  416    HA   ASP  53           HA       ASP  53  88.792  10.724   8.585
  417    HB2  ASP  53           HB2      ASP  53  90.910  11.191   7.188
  418    HB3  ASP  53           HB1      ASP  53  89.839  11.175   5.786
  419    H    ILE  54           HN       ILE  54  87.555  12.264   6.572
  420    HA   ILE  54           HA       ILE  54  85.662  10.421   5.219
  421    HB   ILE  54           HB       ILE  54  84.258  12.650   6.519
  422   HG12  ILE  54          HG12      ILE  54  85.524  10.502   8.254
  423   HG13  ILE  54          HG11      ILE  54  85.959  12.212   8.268
  424   HG21  ILE  54          HG21      ILE  54  83.812   9.678   6.834
  425   HG22  ILE  54          HG22      ILE  54  83.345  10.539   5.368
  426   HG23  ILE  54          HG23      ILE  54  82.619  10.974   6.914
  427   HD11  ILE  54          HD11      ILE  54  83.439  12.630   8.732
  428   HD12  ILE  54          HD12      ILE  54  84.435  12.025  10.056
  429   HD13  ILE  54          HD13      ILE  54  83.388  10.921   9.165
  430    HA   PRO  55           HA       PRO  55  86.618  14.148   2.685
  431    HB2  PRO  55           HB2      PRO  55  87.755  12.907   0.577
  432    HB3  PRO  55           HB1      PRO  55  88.661  13.220   2.071
  433    HG2  PRO  55           HG2      PRO  55  87.493  10.689   1.069
  434    HG3  PRO  55           HG1      PRO  55  88.961  10.961   2.019
  435    HD2  PRO  55           HD2      PRO  55  86.458  10.126   3.030
  436    HD3  PRO  55           HD1      PRO  55  87.837  10.704   3.990
  437    H    GLY  56           HN       GLY  56  84.563  11.500   2.426
  438    HA2  GLY  56           HA2      GLY  56  82.893  12.868   0.453
  439    HA3  GLY  56           HA1      GLY  56  83.558  11.339  -0.123
  440    H    MET  57           HN       MET  57  81.053  12.767   1.683
  441    HA   MET  57           HA       MET  57  80.328  10.133   2.908
  442    HB2  MET  57           HB2      MET  57  80.574  12.123   4.436
  443    HB3  MET  57           HB1      MET  57  79.220  12.868   3.588
  444    HG2  MET  57           HG2      MET  57  77.864  11.775   5.027
  445    HG3  MET  57           HG1      MET  57  78.314  10.293   4.183
  446    HE1  MET  57           HE1      MET  57  80.740   8.476   6.217
  447    HE2  MET  57           HE2      MET  57  81.287   9.550   4.931
  448    HE3  MET  57           HE3      MET  57  79.769   8.674   4.753
  449    H    GLU  58           HN       GLU  58  79.142  12.763   0.850
  450    HA   GLU  58           HA       GLU  58  77.268  12.863  -0.558
  451    HB2  GLU  58           HB2      GLU  58  78.130  10.024  -0.540
  452    HB3  GLU  58           HB1      GLU  58  76.472  10.291  -1.068
  453    HG2  GLU  58           HG2      GLU  58  78.737  11.955  -2.165
  454    HG3  GLU  58           HG1      GLU  58  78.337  10.386  -2.866
  455    H    GLY  59           HN       GLY  59  74.904  12.315  -0.640
  456    HA2  GLY  59           HA2      GLY  59  73.877  11.877   2.127
  457    HA3  GLY  59           HA1      GLY  59  73.017  12.756   0.860
  458    H1U  RCY  60           H1U      RCY  60  74.806   5.279   5.037
  459    H1S  RCY  60           H1S      RCY  60  72.925   8.874   3.334
  460    HB1  RCY  60           HB1      RCY  60  71.186   7.588   1.995
  461    HB2  RCY  60           HB2      RCY  60  69.527   8.145   1.815
  462    HA   RCY  60           HA       RCY  60  71.593   8.606   0.012
  463    HN1  RCY  60           HN1      RCY  60  71.257  11.162   1.535
  464    H    GLY  61           HN       GLY  61  68.527   9.429   1.410
  465    HA2  GLY  61           HA2      GLY  61  66.507  10.112   0.433
  466    HA3  GLY  61           HA1      GLY  61  67.465  10.945  -0.793
  467    H    THR  62           HN       THR  62  68.739   9.145  -2.187
  468    HA   THR  62           HA       THR  62  66.608   7.345  -3.243
  469    HB   THR  62           HB       THR  62  67.314   8.664  -5.030
  470    HG1  THR  62           HG1      THR  62  69.427   6.973  -5.449
  471   HG21  THR  62          HG21      THR  62  69.802   9.185  -5.347
  472   HG22  THR  62          HG22      THR  62  70.030   8.564  -3.712
  473   HG23  THR  62          HG23      THR  62  69.005   9.973  -3.985
  474    H    ASP  63           HN       ASP  63  66.822   5.338  -2.359
  475    HA   ASP  63           HA       ASP  63  69.314   4.276  -1.364
  476    HB2  ASP  63           HB2      ASP  63  67.968   2.075  -1.399
  477    HB3  ASP  63           HB1      ASP  63  67.344   3.379  -0.389
  478    H    ILE  64           HN       ILE  64  69.632   5.173  -4.051
  479    HA   ILE  64           HA       ILE  64  70.591   2.661  -5.302
  480    HB   ILE  64           HB       ILE  64  68.743   4.668  -6.636
  481   HG12  ILE  64          HG12      ILE  64  67.821   2.184  -7.245
  482   HG13  ILE  64          HG11      ILE  64  68.536   1.871  -5.663
  483   HG21  ILE  64          HG21      ILE  64  70.561   2.551  -7.798
  484   HG22  ILE  64          HG22      ILE  64  70.443   4.252  -8.248
  485   HG23  ILE  64          HG23      ILE  64  69.140   3.137  -8.662
  486   HD11  ILE  64          HD11      ILE  64  67.269   4.070  -4.972
  487   HD12  ILE  64          HD12      ILE  64  66.384   2.547  -5.069
  488   HD13  ILE  64          HD13      ILE  64  66.278   3.714  -6.387
  489    H    THR  65           HN       THR  65  70.622   6.081  -4.879
  490    HA   THR  65           HA       THR  65  72.090   7.760  -5.636
  491    HB   THR  65           HB       THR  65  74.279   7.405  -4.816
  492    HG1  THR  65           HG1      THR  65  74.833   5.637  -6.064
  493   HG21  THR  65          HG21      THR  65  73.957   6.088  -2.737
  494   HG22  THR  65          HG22      THR  65  72.451   5.448  -3.396
  495   HG23  THR  65          HG23      THR  65  72.600   7.170  -3.048
  496    H    VAL  66           HN       VAL  66  71.173   5.755  -7.684
  497    HA   VAL  66           HA       VAL  66  71.538   5.415  -9.976
  498    HB   VAL  66           HB       VAL  66  73.902   7.290  -9.794
  499   HG11  VAL  66          HG11      VAL  66  71.844   6.679 -11.938
  500   HG12  VAL  66          HG12      VAL  66  73.528   6.157 -11.935
  501   HG13  VAL  66          HG13      VAL  66  73.135   7.870 -12.089
  502   HG21  VAL  66          HG21      VAL  66  72.118   9.073 -10.346
  503   HG22  VAL  66          HG22      VAL  66  72.216   8.530  -8.671
  504   HG23  VAL  66          HG23      VAL  66  70.945   7.911  -9.725
  505    H    ILE  67           HN       ILE  67  74.402   5.450  -7.903
  506    HA   ILE  67           HA       ILE  67  75.303   2.945  -9.252
  507    HB   ILE  67           HB       ILE  67  77.226   5.082  -8.308
  508   HG12  ILE  67          HG12      ILE  67  76.107   4.627 -11.093
  509   HG13  ILE  67          HG11      ILE  67  75.867   6.061 -10.095
  510   HG21  ILE  67          HG21      ILE  67  78.872   3.762  -9.267
  511   HG22  ILE  67          HG22      ILE  67  77.764   3.052 -10.442
  512   HG23  ILE  67          HG23      ILE  67  77.734   2.511  -8.763
  513   HD11  ILE  67          HD11      ILE  67  78.471   5.068 -11.279
  514   HD12  ILE  67          HD12      ILE  67  78.381   6.350 -10.072
  515   HD13  ILE  67          HD13      ILE  67  77.631   6.573 -11.652
  516    H1U  RCY  68           H1U      RCY  68  77.821   2.264  -0.310
  517    H1S  RCY  68           H1S      RCY  68  75.095   3.891  -3.313
  518    HB1  RCY  68           HB1      RCY  68  73.893   0.740  -4.017
  519    HB2  RCY  68           HB2      RCY  68  73.165   1.064  -5.588
  520    HA   RCY  68           HA       RCY  68  75.785   2.345  -4.829
  521    HN1  RCY  68           HN1      RCY  68  74.481   1.761  -7.455
  522    HA   PRO  69           HA       PRO  69  78.429  -1.126  -4.417
  523    HB2  PRO  69           HB2      PRO  69  76.189  -2.381  -2.855
  524    HB3  PRO  69           HB1      PRO  69  77.927  -2.354  -2.497
  525    HG2  PRO  69           HG2      PRO  69  76.116  -0.633  -1.400
  526    HG3  PRO  69           HG1      PRO  69  77.837  -0.277  -1.594
  527    HD2  PRO  69           HD2      PRO  69  75.611   1.015  -2.901
  528    HD3  PRO  69           HD1      PRO  69  77.344   1.367  -3.093
  529    H    TRP  70           HN       TRP  70  75.084  -2.447  -4.701
  530    HA   TRP  70           HA       TRP  70  75.952  -4.714  -6.240
  531    HD1  TRP  70           HD1      TRP  70  73.734  -2.890  -3.533
  532    HE1  TRP  70           HE1      TRP  70  72.089  -0.907  -3.525
  533    HE3  TRP  70           HE3      TRP  70  71.973  -3.188  -8.316
  534    HZ2  TRP  70           HZ2      TRP  70  70.262   0.385  -5.314
  535    HZ3  TRP  70           HZ3      TRP  70  70.285  -1.574  -9.137
  536    HH2  TRP  70           HH2      TRP  70  69.427   0.210  -7.647
  537    HB2  TRP  70           HB2      TRP  70  73.416  -4.718  -6.911
  538    HB3  TRP  70           HB1      TRP  70  73.865  -5.038  -5.237
  539    H    GLU  71           HN       GLU  71  76.535  -1.789  -7.155
  540    HA   GLU  71           HA       GLU  71  76.144  -2.370 -10.027
  541    HB2  GLU  71           HB2      GLU  71  74.805  -0.163  -8.521
  542    HB3  GLU  71           HB1      GLU  71  75.460   0.238 -10.107
  543    HG2  GLU  71           HG2      GLU  71  73.647  -2.138  -9.613
  544    HG3  GLU  71           HG1      GLU  71  73.054  -0.559 -10.130
  545    H    ALA  72           HN       ALA  72  77.585  -0.461  -7.449
  546    HA   ALA  72           HA       ALA  72  79.447   0.934  -9.201
  547    HB1  ALA  72           HB1      ALA  72  80.289   1.931  -7.246
  548    HB2  ALA  72           HB2      ALA  72  79.863   0.545  -6.242
  549    HB3  ALA  72           HB3      ALA  72  78.602   1.627  -6.833
  550    H1U  RCY  73           H1U      RCY  73  79.160   1.963  -4.287
  551    H1S  RCY  73           H1S      RCY  73  83.978   1.563  -4.852
  552    HB1  RCY  73           HB1      RCY  73  84.286  -1.985  -6.209
  553    HB2  RCY  73           HB2      RCY  73  82.987  -1.042  -5.479
  554    HA   RCY  73           HA       RCY  73  83.257  -1.372  -8.471
  555    HN1  RCY  73           HN1      RCY  73  81.540   0.235  -6.966
  556    H    ASN  74           HN       ASN  74  80.480  -2.352  -6.602
  557    HA   ASN  74           HA       ASN  74  79.566  -4.481  -6.198
  558    HB2  ASN  74           HB2      ASN  74  81.129  -5.201  -8.699
  559    HB3  ASN  74           HB1      ASN  74  79.719  -6.045  -8.058
  560   HD21  ASN  74          HD21      ASN  74  79.676  -4.964 -10.697
  561   HD22  ASN  74          HD22      ASN  74  78.582  -3.667 -10.735
  562    H    HIS  75           HN       HIS  75  81.693  -6.590  -7.607
  563    HA   HIS  75           HA       HIS  75  83.121  -8.182  -6.617
  564    HD1  HIS  75           HD1      HIS  75  85.364  -6.329  -3.413
  565    HD2  HIS  75           HD2      HIS  75  86.090  -8.949  -6.576
  566    HE1  HIS  75           HE1      HIS  75  87.084  -7.992  -2.583
  567    HE2  HIS  75           HE2      HIS  75  87.536  -9.593  -4.499
  568    HB2  HIS  75           HB2      HIS  75  84.716  -6.395  -7.045
  569    HB3  HIS  75           HB1      HIS  75  84.249  -5.576  -5.555
  570    H1U  RCY  76           H1U      RCY  76  75.112  -6.647  -1.465
  571    H1S  RCY  76           H1S      RCY  76  78.997  -3.796  -2.158
  572    HB1  RCY  76           HB1      RCY  76  80.805  -7.189  -1.118
  573    HB2  RCY  76           HB2      RCY  76  80.570  -7.138  -2.865
  574    HA   RCY  76           HA       RCY  76  83.230  -6.467  -1.593
  575    HN1  RCY  76           HN1      RCY  76  83.564  -6.025  -3.882
  576    H    GLU  77           HN       GLU  77  84.752  -8.448  -2.545
  577    HA   GLU  77           HA       GLU  77  83.575 -11.082  -2.327
  578    HB2  GLU  77           HB2      GLU  77  85.648 -10.677  -3.598
  579    HB3  GLU  77           HB1      GLU  77  86.472 -10.205  -2.112
  580    HG2  GLU  77           HG2      GLU  77  86.219 -12.418  -1.182
  581    HG3  GLU  77           HG1      GLU  77  85.171 -12.911  -2.512
  582    H    LEU  78           HN       LEU  78  86.324 -10.161  -0.313
  583    HA   LEU  78           HA       LEU  78  84.860 -10.175   2.181
  584    HG   LEU  78           HG       LEU  78  85.601 -11.487   4.015
  585    HB2  LEU  78           HB2      LEU  78  84.677 -12.569   1.663
  586    HB3  LEU  78           HB1      LEU  78  86.422 -12.669   1.438
  587   HD11  LEU  78          HD11      LEU  78  83.880 -13.078   4.119
  588   HD12  LEU  78          HD12      LEU  78  85.229 -13.929   4.872
  589   HD13  LEU  78          HD13      LEU  78  84.797 -14.269   3.196
  590   HD21  LEU  78          HD21      LEU  78  87.443 -12.808   4.822
  591   HD22  LEU  78          HD22      LEU  78  87.936 -12.152   3.261
  592   HD23  LEU  78          HD23      LEU  78  87.414 -13.832   3.387
  593    H    HIS  79           HN       HIS  79  86.311  -9.822   3.998
  594    HA   HIS  79           HA       HIS  79  89.164  -9.342   3.255
  595    HD1  HIS  79           HD1      HIS  79  88.564  -7.754   1.328
  596    HD2  HIS  79           HD2      HIS  79  85.666  -6.021   3.777
  597    HE1  HIS  79           HE1      HIS  79  86.893  -6.642  -0.217
  598    HE2  HIS  79           HE2      HIS  79  85.124  -5.583   1.261
  599    HB2  HIS  79           HB2      HIS  79  87.681  -7.416   5.035
  600    HB3  HIS  79           HB1      HIS  79  89.167  -7.160   4.122
  601    H    GLU  80           HN       GLU  80  87.314  -8.673   6.231
  602    HA   GLU  80           HA       GLU  80  88.668 -10.948   7.575
  603    HB2  GLU  80           HB2      GLU  80  89.010  -8.031   8.269
  604    HB3  GLU  80           HB1      GLU  80  89.186  -9.281   9.501
  605    HG2  GLU  80           HG2      GLU  80  90.957 -10.355   8.249
  606    HG3  GLU  80           HG1      GLU  80  90.702  -9.277   6.876
  607    H    LEU  81           HN       LEU  81  86.908  -8.069   8.745
  608    HA   LEU  81           HA       LEU  81  85.203  -9.687  10.435
  609    HG   LEU  81           HG       LEU  81  86.950  -6.817  10.126
  610    HB2  LEU  81           HB2      LEU  81  84.601  -6.855   9.576
  611    HB3  LEU  81           HB1      LEU  81  84.206  -7.645  11.102
  612   HD11  LEU  81          HD11      LEU  81  85.480  -5.078  11.174
  613   HD12  LEU  81          HD12      LEU  81  86.940  -5.405  12.108
  614   HD13  LEU  81          HD13      LEU  81  85.394  -6.080  12.623
  615   HD21  LEU  81          HD21      LEU  81  86.089  -8.590  12.419
  616   HD22  LEU  81          HD22      LEU  81  87.630  -7.732  12.434
  617   HD23  LEU  81          HD23      LEU  81  87.296  -8.925  11.178
  618    H    ALA  82           HN       ALA  82  85.050  -8.564   7.150
  619    HA   ALA  82           HA       ALA  82  82.200  -8.767   6.782
  620    HB1  ALA  82           HB1      ALA  82  84.516  -8.977   4.837
  621    HB2  ALA  82           HB2      ALA  82  83.519  -7.556   5.153
  622    HB3  ALA  82           HB3      ALA  82  82.824  -8.959   4.342
  623    H    GLN  83           HN       GLN  83  83.513 -11.076   8.171
  624    HA   GLN  83           HA       GLN  83  83.827 -13.383   6.664
  625    HB2  GLN  83           HB2      GLN  83  84.035 -13.450   9.077
  626    HB3  GLN  83           HB1      GLN  83  82.333 -13.043   9.282
  627    HG2  GLN  83           HG2      GLN  83  82.716 -15.382   7.566
  628    HG3  GLN  83           HG1      GLN  83  83.379 -15.619   9.183
  629   HE21  GLN  83          HE21      GLN  83  80.813 -16.686   7.850
  630   HE22  GLN  83          HE22      GLN  83  79.584 -16.288   8.950
  631    H    TYR  84           HN       TYR  84  80.734 -11.930   7.693
  632    HA   TYR  84           HA       TYR  84  79.390 -12.672   5.289
  633    HD1  TYR  84           HD1      TYR  84  79.347 -14.923   4.017
  634    HD2  TYR  84           HD2      TYR  84  76.156 -14.526   6.864
  635    HE1  TYR  84           HE1      TYR  84  77.711 -15.587   2.275
  636    HE2  TYR  84           HE2      TYR  84  74.519 -15.191   5.123
  637    HH   TYR  84           HH       TYR  84  75.515 -15.686   1.761
  638    HB2  TYR  84           HB2      TYR  84  79.702 -14.941   6.576
  639    HB3  TYR  84           HB1      TYR  84  78.385 -14.343   7.584
  640    H    GLY  85           HN       GLY  85  79.690 -10.562   7.453
  641    HA2  GLY  85           HA2      GLY  85  77.069 -10.266   8.661
  642    HA3  GLY  85           HA1      GLY  85  78.311  -9.014   8.578
  643    H    ILE  86           HN       ILE  86  76.818 -10.804   5.901
  644    HA   ILE  86           HA       ILE  86  76.612  -8.963   3.963
  645    HB   ILE  86           HB       ILE  86  74.259  -9.850   3.449
  646   HG12  ILE  86          HG12      ILE  86  74.857 -11.770   5.698
  647   HG13  ILE  86          HG11      ILE  86  73.913 -10.308   5.986
  648   HG21  ILE  86          HG21      ILE  86  76.596 -11.712   3.958
  649   HG22  ILE  86          HG22      ILE  86  76.206 -10.880   2.453
  650   HG23  ILE  86          HG23      ILE  86  75.161 -12.173   3.042
  651   HD11  ILE  86          HD11      ILE  86  72.246 -10.972   4.386
  652   HD12  ILE  86          HD12      ILE  86  72.540 -12.365   5.427
  653   HD13  ILE  86          HD13      ILE  86  73.246 -12.306   3.811
  654    H1U  RCY  87           H1U      RCY  87  78.619  -1.113   1.131
  655    H1S  RCY  87           H1S      RCY  87  74.852  -1.070   3.316
  656    HB1  RCY  87           HB1      RCY  87  76.067  -4.708   3.676
  657    HB2  RCY  87           HB2      RCY  87  76.162  -4.050   5.307
  658    HA   RCY  87           HA       RCY  87  74.650  -5.573   6.149
  659    HN1  RCY  87           HN1      RCY  87  76.291  -6.814   4.155
  Start of MODEL   67
    1    HA   MET   1           HA       MET   1  61.194   5.700  17.582
    2    HB2  MET   1           HB2      MET   1  62.676   7.268  19.135
    3    HB3  MET   1           HB1      MET   1  61.196   8.224  19.207
    4    HG2  MET   1           HG2      MET   1  59.981   6.063  19.808
    5    HG3  MET   1           HG1      MET   1  61.572   5.334  20.022
    6    HE1  MET   1           HE1      MET   1  59.502   8.566  22.479
    7    HE2  MET   1           HE2      MET   1  58.732   7.113  21.846
    8    HE3  MET   1           HE3      MET   1  59.386   8.312  20.733
    9    H    ASN   2           HN       ASN   2  59.307   7.533  19.102
   10    HA   ASN   2           HA       ASN   2  57.134   8.342  18.744
   11    HB2  ASN   2           HB2      ASN   2  58.541  10.221  17.803
   12    HB3  ASN   2           HB1      ASN   2  58.321   9.500  16.209
   13   HD21  ASN   2          HD21      ASN   2  55.553   8.845  18.004
   14   HD22  ASN   2          HD22      ASN   2  54.591  10.144  17.484
   15    H    LEU   3           HN       LEU   3  55.777   6.652  18.300
   16    HA   LEU   3           HA       LEU   3  55.879   4.804  16.228
   17    HG   LEU   3           HG       LEU   3  55.087   3.452  17.839
   18    HB2  LEU   3           HB2      LEU   3  53.881   5.723  18.119
   19    HB3  LEU   3           HB1      LEU   3  53.119   5.362  16.573
   20   HD11  LEU   3          HD11      LEU   3  52.976   2.222  18.601
   21   HD12  LEU   3          HD12      LEU   3  52.114   3.736  18.324
   22   HD13  LEU   3          HD13      LEU   3  53.406   3.662  19.522
   23   HD21  LEU   3          HD21      LEU   3  53.785   1.832  16.437
   24   HD22  LEU   3          HD22      LEU   3  54.578   3.086  15.483
   25   HD23  LEU   3          HD23      LEU   3  52.847   3.187  15.808
   26    H    GLU   4           HN       GLU   4  56.528   5.771  14.256
   27    HA   GLU   4           HA       GLU   4  54.858   7.881  13.059
   28    HB2  GLU   4           HB2      GLU   4  57.470   6.601  12.502
   29    HB3  GLU   4           HB1      GLU   4  56.553   7.024  11.058
   30    HG2  GLU   4           HG2      GLU   4  57.908   8.937  11.632
   31    HG3  GLU   4           HG1      GLU   4  56.239   9.333  12.044
   32    HA   PRO   5           HA       PRO   5  51.915   5.698  10.628
   33    HB2  PRO   5           HB2      PRO   5  53.653   6.324   8.257
   34    HB3  PRO   5           HB1      PRO   5  51.891   6.464   8.423
   35    HG2  PRO   5           HG2      PRO   5  53.528   8.582   8.632
   36    HG3  PRO   5           HG1      PRO   5  52.022   8.448   9.553
   37    HD2  PRO   5           HD2      PRO   5  54.794   8.337  10.529
   38    HD3  PRO   5           HD1      PRO   5  53.291   8.566  11.448
   39    HA   PRO   6           HA       PRO   6  54.297   1.837  10.394
   40    HB2  PRO   6           HB2      PRO   6  52.206   0.121  10.674
   41    HB3  PRO   6           HB1      PRO   6  52.897   1.018  12.040
   42    HG2  PRO   6           HG2      PRO   6  50.421   1.562  10.487
   43    HG3  PRO   6           HG1      PRO   6  50.730   1.740  12.222
   44    HD2  PRO   6           HD2      PRO   6  50.742   3.844  10.421
   45    HD3  PRO   6           HD1      PRO   6  51.599   3.857  11.977
   46    H    LYS   7           HN       LYS   7  54.796   0.482   8.687
   47    HA   LYS   7           HA       LYS   7  52.837   0.116   6.492
   48    HB2  LYS   7           HB2      LYS   7  54.794   0.652   4.870
   49    HB3  LYS   7           HB1      LYS   7  53.945   2.008   5.611
   50    HG2  LYS   7           HG2      LYS   7  55.677   2.228   7.307
   51    HG3  LYS   7           HG1      LYS   7  56.496   0.787   6.703
   52    HD2  LYS   7           HD2      LYS   7  57.115   1.855   4.675
   53    HD3  LYS   7           HD1      LYS   7  55.979   3.180   4.934
   54    HE2  LYS   7           HE2      LYS   7  58.449   3.682   5.419
   55    HE3  LYS   7           HE1      LYS   7  57.296   4.107   6.684
   56    HZ1  LYS   7           HZ1      LYS   7  57.841   2.173   7.896
   57    HZ2  LYS   7           HZ2      LYS   7  59.320   2.877   7.443
   58    HZ3  LYS   7           HZ3      LYS   7  58.733   1.517   6.610
   59    H    ALA   8           HN       ALA   8  55.040  -1.140   8.592
   60    HA   ALA   8           HA       ALA   8  56.135  -3.207   8.731
   61    HB1  ALA   8           HB1      ALA   8  53.772  -3.877   7.942
   62    HB2  ALA   8           HB2      ALA   8  55.067  -5.045   7.682
   63    HB3  ALA   8           HB3      ALA   8  54.492  -4.051   6.342
   64    H    GLU   9           HN       GLU   9  58.245  -2.851   8.115
   65    HA   GLU   9           HA       GLU   9  58.977  -2.302   5.351
   66    HB2  GLU   9           HB2      GLU   9  60.265  -2.266   7.940
   67    HB3  GLU   9           HB1      GLU   9  61.266  -3.170   6.804
   68    HG2  GLU   9           HG2      GLU   9  60.098  -0.439   6.199
   69    HG3  GLU   9           HG1      GLU   9  61.724  -0.686   6.837
   70    H1U  RCY  10           H1U      RCY  10  62.372 -11.144   2.094
   71    H1S  RCY  10           H1S      RCY  10  60.256  -8.693   4.488
   72    HB1  RCY  10           HB1      RCY  10  57.985  -7.485   7.448
   73    HB2  RCY  10           HB2      RCY  10  59.735  -7.296   7.340
   74    HA   RCY  10           HA       RCY  10  59.537  -6.776   4.938
   75    HN1  RCY  10           HN1      RCY  10  57.760  -5.001   6.570
   76    H    ARG  11           HN       ARG  11  57.012  -8.554   6.098
   77    HA   ARG  11           HA       ARG  11  55.203  -9.527   4.942
   78    HE   ARG  11           HE       ARG  11  51.717  -8.532   5.172
   79    HB2  ARG  11           HB2      ARG  11  54.722  -6.553   4.641
   80    HB3  ARG  11           HB1      ARG  11  53.541  -7.766   4.148
   81    HG2  ARG  11           HG2      ARG  11  53.768  -8.720   6.522
   82    HG3  ARG  11           HG1      ARG  11  54.596  -7.216   6.926
   83    HD2  ARG  11           HD2      ARG  11  52.290  -6.864   7.462
   84    HD3  ARG  11           HD1      ARG  11  52.580  -5.994   5.956
   85   HH11  ARG  11          HH21      ARG  11  50.591  -5.930   7.133
   86   HH12  ARG  11          HH22      ARG  11  48.916  -6.242   6.818
   87   HH21  ARG  11          HH11      ARG  11  49.536  -8.955   4.750
   88   HH22  ARG  11          HH12      ARG  11  48.319  -7.954   5.470
   89    H    SER  12           HN       SER  12  55.122  -6.797   2.758
   90    HA   SER  12           HA       SER  12  55.716  -8.646   0.513
   91    HG   SER  12           HG       SER  12  55.571  -6.023  -1.365
   92    HB2  SER  12           HB2      SER  12  53.699  -7.296   0.289
   93    HB3  SER  12           HB1      SER  12  54.616  -5.820   0.578
   94    H    ALA  13           HN       ALA  13  56.749  -6.974  -1.382
   95    HA   ALA  13           HA       ALA  13  58.740  -5.962  -2.097
   96    HB1  ALA  13           HB1      ALA  13  57.968  -4.362  -0.150
   97    HB2  ALA  13           HB2      ALA  13  59.602  -4.225  -0.798
   98    HB3  ALA  13           HB3      ALA  13  59.324  -5.085   0.717
   99    H    THR  14           HN       THR  14  58.584  -8.367   0.259
  100    HA   THR  14           HA       THR  14  61.164  -9.442  -0.504
  101    HB   THR  14           HB       THR  14  60.936  -8.714   2.417
  102    HG1  THR  14           HG1      THR  14  60.887  -6.813   1.097
  103   HG21  THR  14          HG21      THR  14  63.386  -9.008   2.312
  104   HG22  THR  14          HG22      THR  14  63.266  -9.360   0.588
  105   HG23  THR  14          HG23      THR  14  62.545 -10.458   1.765
  106    H    ARG  15           HN       ARG  15  58.558 -10.465  -0.611
  107    HA   ARG  15           HA       ARG  15  58.144 -12.224   1.705
  108    HE   ARG  15           HE       ARG  15  55.401 -13.590  -1.845
  109    HB2  ARG  15           HB2      ARG  15  56.251 -11.255   0.360
  110    HB3  ARG  15           HB1      ARG  15  56.756 -12.270  -0.991
  111    HG2  ARG  15           HG2      ARG  15  56.457 -14.283   0.418
  112    HG3  ARG  15           HG1      ARG  15  55.920 -13.261   1.752
  113    HD2  ARG  15           HD2      ARG  15  54.035 -14.275   0.423
  114    HD3  ARG  15           HD1      ARG  15  53.996 -12.513   0.491
  115   HH11  ARG  15          HH21      ARG  15  52.440 -12.552  -0.416
  116   HH12  ARG  15          HH22      ARG  15  51.683 -12.187  -1.931
  117   HH21  ARG  15          HH11      ARG  15  54.429 -13.119  -3.831
  118   HH22  ARG  15          HH12      ARG  15  52.809 -12.508  -3.864
  119    H    VAL  16           HN       VAL  16  59.379 -12.474  -1.601
  120    HA   VAL  16           HA       VAL  16  60.898 -14.842  -0.945
  121    HB   VAL  16           HB       VAL  16  58.546 -15.762  -1.203
  122   HG11  VAL  16          HG11      VAL  16  57.500 -15.767  -3.341
  123   HG12  VAL  16          HG12      VAL  16  58.961 -15.189  -4.142
  124   HG13  VAL  16          HG13      VAL  16  58.039 -14.105  -3.100
  125   HG21  VAL  16          HG21      VAL  16  60.822 -16.945  -1.754
  126   HG22  VAL  16          HG22      VAL  16  60.289 -16.796  -3.428
  127   HG23  VAL  16          HG23      VAL  16  59.315 -17.703  -2.270
  128    H    MET  17           HN       MET  17  60.963 -12.119  -2.306
  129    HA   MET  17           HA       MET  17  62.054 -11.138  -4.134
  130    HB2  MET  17           HB2      MET  17  63.312 -13.897  -4.235
  131    HB3  MET  17           HB1      MET  17  63.889 -12.499  -5.140
  132    HG2  MET  17           HG2      MET  17  63.520 -12.303  -2.163
  133    HG3  MET  17           HG1      MET  17  64.977 -13.046  -2.821
  134    HE1  MET  17           HE1      MET  17  66.969 -10.626  -4.489
  135    HE2  MET  17           HE2      MET  17  65.652 -11.046  -5.582
  136    HE3  MET  17           HE3      MET  17  66.295 -12.261  -4.479
  137    H    GLY  18           HN       GLY  18  62.081 -11.104  -6.501
  138    HA2  GLY  18           HA2      GLY  18  59.855 -12.723  -7.626
  139    HA3  GLY  18           HA1      GLY  18  60.496 -11.238  -8.331
  140    H    GLY  19           HN       GLY  19  60.233 -14.263  -9.188
  141    HA2  GLY  19           HA2      GLY  19  62.788 -15.356  -9.621
  142    HA3  GLY  19           HA1      GLY  19  61.420 -15.603 -10.709
  143    HA   PRO  20           HA       PRO  20  62.816 -12.988 -13.964
  144    HB2  PRO  20           HB2      PRO  20  61.103 -10.706 -13.051
  145    HB3  PRO  20           HB1      PRO  20  61.226 -11.451 -14.658
  146    HG2  PRO  20           HG2      PRO  20  59.159 -11.935 -13.050
  147    HG3  PRO  20           HG1      PRO  20  59.831 -13.188 -14.106
  148    HD2  PRO  20           HD2      PRO  20  60.058 -12.904 -11.148
  149    HD3  PRO  20           HD1      PRO  20  60.097 -14.373 -12.148
  150    H1U  RCY  21           H1U      RCY  21  64.277  -5.744  -8.387
  151    H1S  RCY  21           H1S      RCY  21  67.491  -8.190 -11.098
  152    HB1  RCY  21           HB1      RCY  21  67.639 -11.293 -12.906
  153    HB2  RCY  21           HB2      RCY  21  66.443 -12.212 -11.993
  154    HA   RCY  21           HA       RCY  21  65.281  -9.707 -12.135
  155    HN1  RCY  21           HN1      RCY  21  64.710 -11.831 -14.148
  156    H    THR  22           HN       THR  22  65.062  -8.060 -13.662
  157    HA   THR  22           HA       THR  22  65.968  -8.087 -16.342
  158    HB   THR  22           HB       THR  22  65.882  -5.680 -14.507
  159    HG1  THR  22           HG1      THR  22  63.923  -6.720 -14.402
  160   HG21  THR  22          HG21      THR  22  65.559  -5.999 -17.505
  161   HG22  THR  22          HG22      THR  22  66.944  -5.278 -16.684
  162   HG23  THR  22          HG23      THR  22  65.368  -4.488 -16.616
  163    HA   PRO  23           HA       PRO  23  70.395  -8.162 -15.217
  164    HB2  PRO  23           HB2      PRO  23  70.816  -8.309 -18.136
  165    HB3  PRO  23           HB1      PRO  23  71.306  -9.452 -16.874
  166    HG2  PRO  23           HG2      PRO  23  69.339  -9.974 -18.640
  167    HG3  PRO  23           HG1      PRO  23  69.352 -10.624 -16.993
  168    HD2  PRO  23           HD2      PRO  23  67.725  -8.368 -18.116
  169    HD3  PRO  23           HD1      PRO  23  67.284  -9.576 -16.886
  170    H    ARG  24           HN       ARG  24  71.312  -6.194 -14.756
  171    HA   ARG  24           HA       ARG  24  70.685  -3.759 -16.065
  172    HE   ARG  24           HE       ARG  24  75.699  -6.830 -14.622
  173    HB2  ARG  24           HB2      ARG  24  72.946  -2.993 -15.043
  174    HB3  ARG  24           HB1      ARG  24  71.681  -3.527 -13.940
  175    HG2  ARG  24           HG2      ARG  24  73.789  -4.575 -13.296
  176    HG3  ARG  24           HG1      ARG  24  72.704  -5.810 -13.937
  177    HD2  ARG  24           HD2      ARG  24  73.904  -6.025 -15.925
  178    HD3  ARG  24           HD1      ARG  24  74.597  -4.408 -15.799
  179   HH11  ARG  24          HH21      ARG  24  75.338  -3.411 -14.372
  180   HH12  ARG  24          HH22      ARG  24  76.792  -3.190 -13.457
  181   HH21  ARG  24          HH11      ARG  24  77.600  -6.562 -13.429
  182   HH22  ARG  24          HH12      ARG  24  78.073  -4.975 -12.924
  183    H    LYS  25           HN       LYS  25  73.130  -2.571 -16.782
  184    HA   LYS  25           HA       LYS  25  73.382  -3.146 -19.495
  185    HB2  LYS  25           HB2      LYS  25  75.193  -1.899 -17.469
  186    HB3  LYS  25           HB1      LYS  25  75.896  -2.323 -19.029
  187    HG2  LYS  25           HG2      LYS  25  75.037  -0.019 -19.076
  188    HG3  LYS  25           HG1      LYS  25  74.109  -1.044 -20.172
  189    HD2  LYS  25           HD2      LYS  25  72.356  -1.307 -18.471
  190    HD3  LYS  25           HD1      LYS  25  73.288  -0.324 -17.342
  191    HE2  LYS  25           HE2      LYS  25  71.594   1.076 -18.394
  192    HE3  LYS  25           HE1      LYS  25  73.185   1.568 -18.974
  193    HZ1  LYS  25           HZ1      LYS  25  71.123  -0.013 -20.378
  194    HZ2  LYS  25           HZ2      LYS  25  72.750  -0.056 -20.865
  195    HZ3  LYS  25           HZ3      LYS  25  71.893   1.411 -20.885
  196    H    GLY  26           HN       GLY  26  76.386  -3.805 -17.842
  197    HA2  GLY  26           HA2      GLY  26  76.650  -6.465 -17.503
  198    HA3  GLY  26           HA1      GLY  26  76.547  -6.390 -19.262
  199    HA   PRO  27           HA       PRO  27  80.779  -5.402 -19.833
  200    HB2  PRO  27           HB2      PRO  27  80.689  -2.854 -21.036
  201    HB3  PRO  27           HB1      PRO  27  80.594  -4.410 -21.879
  202    HG2  PRO  27           HG2      PRO  27  78.430  -2.546 -21.102
  203    HG3  PRO  27           HG1      PRO  27  78.555  -3.619 -22.506
  204    HD2  PRO  27           HD2      PRO  27  76.944  -4.199 -20.401
  205    HD3  PRO  27           HD1      PRO  27  77.766  -5.471 -21.334
  206    HA   PRO  28           HA       PRO  28  82.778  -3.113 -16.647
  207    HB2  PRO  28           HB2      PRO  28  83.834  -1.288 -18.787
  208    HB3  PRO  28           HB1      PRO  28  84.696  -2.052 -17.437
  209    HG2  PRO  28           HG2      PRO  28  84.817  -3.007 -19.941
  210    HG3  PRO  28           HG1      PRO  28  84.887  -4.057 -18.517
  211    HD2  PRO  28           HD2      PRO  28  82.734  -3.785 -20.509
  212    HD3  PRO  28           HD1      PRO  28  83.014  -5.082 -19.327
  213    H    LYS  29           HN       LYS  29  82.578  -1.108 -15.445
  214    HA   LYS  29           HA       LYS  29  81.002   1.083 -16.628
  215    HB2  LYS  29           HB2      LYS  29  79.193   0.961 -15.029
  216    HB3  LYS  29           HB1      LYS  29  79.330  -0.619 -15.800
  217    HG2  LYS  29           HG2      LYS  29  80.841  -1.284 -13.844
  218    HG3  LYS  29           HG1      LYS  29  80.291   0.193 -13.051
  219    HD2  LYS  29           HD2      LYS  29  77.916  -0.603 -13.439
  220    HD3  LYS  29           HD1      LYS  29  78.595  -2.148 -13.953
  221    HE2  LYS  29           HE2      LYS  29  79.781  -2.300 -11.751
  222    HE3  LYS  29           HE1      LYS  29  78.944  -0.833 -11.243
  223    HZ1  LYS  29           HZ1      LYS  29  77.412  -2.277 -10.516
  224    HZ2  LYS  29           HZ2      LYS  29  77.938  -3.531 -11.536
  225    HZ3  LYS  29           HZ3      LYS  29  76.912  -2.317 -12.137
  226    H1U  RCY  30           H1U      RCY  30  81.018   6.233  -7.716
  227    H1S  RCY  30           H1S      RCY  30  78.878   3.958 -11.448
  228    HB1  RCY  30           HB1      RCY  30  82.258   4.292 -12.077
  229    HB2  RCY  30           HB2      RCY  30  82.644   2.570 -12.029
  230    HA   RCY  30           HA       RCY  30  82.764   4.491 -14.314
  231    HN1  RCY  30           HN1      RCY  30  81.655   2.998 -15.741
  232    H    LYS  31           HN       LYS  31  84.925   4.862 -14.176
  233    HA   LYS  31           HA       LYS  31  86.742   2.589 -13.552
  234    HB2  LYS  31           HB2      LYS  31  87.554   4.508 -15.705
  235    HB3  LYS  31           HB1      LYS  31  88.025   2.826 -15.475
  236    HG2  LYS  31           HG2      LYS  31  85.192   3.601 -16.189
  237    HG3  LYS  31           HG1      LYS  31  86.418   3.311 -17.424
  238    HD2  LYS  31           HD2      LYS  31  86.196   1.246 -15.302
  239    HD3  LYS  31           HD1      LYS  31  84.843   1.348 -16.429
  240    HE2  LYS  31           HE2      LYS  31  86.823  -0.197 -17.066
  241    HE3  LYS  31           HE1      LYS  31  86.214   0.906 -18.300
  242    HZ1  LYS  31           HZ1      LYS  31  87.963   2.451 -17.777
  243    HZ2  LYS  31           HZ2      LYS  31  88.645   0.933 -18.121
  244    HZ3  LYS  31           HZ3      LYS  31  88.519   1.465 -16.513
  245    H    GLN  32           HN       GLN  32  86.261   6.051 -13.856
  246    HA   GLN  32           HA       GLN  32  88.787   6.777 -12.639
  247    HB2  GLN  32           HB2      GLN  32  87.163   8.230 -14.090
  248    HB3  GLN  32           HB1      GLN  32  86.340   8.535 -12.560
  249    HG2  GLN  32           HG2      GLN  32  88.696   9.121 -11.648
  250    HG3  GLN  32           HG1      GLN  32  89.165   9.240 -13.344
  251   HE21  GLN  32          HE21      GLN  32  87.273  10.560 -14.652
  252   HE22  GLN  32          HE22      GLN  32  86.847  12.029 -13.916
  253    H    ARG  33           HN       ARG  33  86.907   4.836 -11.224
  254    HA   ARG  33           HA       ARG  33  86.093   4.462  -9.047
  255    HE   ARG  33           HE       ARG  33  90.676   4.156  -7.433
  256    HB2  ARG  33           HB2      ARG  33  88.670   4.816  -8.861
  257    HB3  ARG  33           HB1      ARG  33  88.248   6.373  -8.150
  258    HG2  ARG  33           HG2      ARG  33  86.940   5.282  -6.412
  259    HG3  ARG  33           HG1      ARG  33  87.194   3.707  -7.163
  260    HD2  ARG  33           HD2      ARG  33  89.358   5.492  -6.011
  261    HD3  ARG  33           HD1      ARG  33  88.744   4.010  -5.280
  262   HH11  ARG  33          HH21      ARG  33  88.027   2.395  -6.103
  263   HH12  ARG  33          HH22      ARG  33  88.525   0.879  -6.775
  264   HH21  ARG  33          HH11      ARG  33  91.342   2.186  -8.318
  265   HH22  ARG  33          HH12      ARG  33  90.402   0.760  -8.030
  266    H    GLN  34           HN       GLN  34  84.895   6.725 -10.489
  267    HA   GLN  34           HA       GLN  34  84.620   9.091  -9.026
  268    HB2  GLN  34           HB2      GLN  34  82.155   8.986  -9.891
  269    HB3  GLN  34           HB1      GLN  34  83.465   9.056 -11.070
  270    HG2  GLN  34           HG2      GLN  34  83.370   6.670 -11.425
  271    HG3  GLN  34           HG1      GLN  34  82.232   6.468 -10.093
  272   HE21  GLN  34          HE21      GLN  34  79.996   7.063 -10.457
  273   HE22  GLN  34          HE22      GLN  34  79.404   7.431 -12.005
  274    H    THR  35           HN       THR  35  84.776   8.557  -6.772
  275    HA   THR  35           HA       THR  35  82.214   8.141  -5.483
  276    HB   THR  35           HB       THR  35  84.308   5.955  -5.249
  277    HG1  THR  35           HG1      THR  35  82.190   4.828  -5.893
  278   HG21  THR  35          HG21      THR  35  81.713   6.465  -3.778
  279   HG22  THR  35          HG22      THR  35  83.327   6.301  -3.086
  280   HG23  THR  35          HG23      THR  35  82.522   4.898  -3.789
  281    H    ARG  36           HN       ARG  36  85.567   8.856  -5.488
  282    HA   ARG  36           HA       ARG  36  86.002   9.064  -2.650
  283    HE   ARG  36           HE       ARG  36  90.370  10.689  -3.952
  284    HB2  ARG  36           HB2      ARG  36  87.327  10.482  -4.981
  285    HB3  ARG  36           HB1      ARG  36  87.903  10.559  -3.316
  286    HG2  ARG  36           HG2      ARG  36  88.206   8.128  -3.279
  287    HG3  ARG  36           HG1      ARG  36  87.566   8.007  -4.919
  288    HD2  ARG  36           HD2      ARG  36  90.019   7.966  -4.970
  289    HD3  ARG  36           HD1      ARG  36  89.422   9.441  -5.731
  290   HH11  ARG  36          HH21      ARG  36  90.245   7.307  -3.294
  291   HH12  ARG  36          HH22      ARG  36  91.214   7.414  -1.862
  292   HH21  ARG  36          HH11      ARG  36  91.635  10.849  -2.086
  293   HH22  ARG  36          HH12      ARG  36  92.001   9.420  -1.178
  294    H    GLN  37           HN       GLN  37  83.685  10.078  -2.454
  295    HA   GLN  37           HA       GLN  37  83.999  12.829  -1.693
  296    HB2  GLN  37           HB2      GLN  37  83.905  13.319  -4.057
  297    HB3  GLN  37           HB1      GLN  37  82.513  12.258  -4.273
  298    HG2  GLN  37           HG2      GLN  37  81.079  13.720  -3.059
  299    HG3  GLN  37           HG1      GLN  37  82.438  14.640  -2.413
  300   HE21  GLN  37          HE21      GLN  37  81.339  16.587  -3.399
  301   HE22  GLN  37          HE22      GLN  37  81.546  16.895  -5.056
  302    H1U  RCY  38           H1U      RCY  38  78.847   5.951  -3.433
  303    H1S  RCY  38           H1S      RCY  38  79.141   7.419   1.175
  304    HB1  RCY  38           HB1      RCY  38  81.509   9.532   0.858
  305    HB2  RCY  38           HB2      RCY  38  80.487   9.804  -0.553
  306    HA   RCY  38           HA       RCY  38  80.076  12.121   0.188
  307    HN1  RCY  38           HN1      RCY  38  82.966  12.174   0.223
  308    H    LYS  39           HN       LYS  39  79.217  11.861   2.450
  309    HA   LYS  39           HA       LYS  39  81.307  12.460   4.511
  310    HB2  LYS  39           HB2      LYS  39  78.748  13.894   3.857
  311    HB3  LYS  39           HB1      LYS  39  79.310  13.869   5.527
  312    HG2  LYS  39           HG2      LYS  39  81.538  14.714   4.721
  313    HG3  LYS  39           HG1      LYS  39  80.831  14.895   3.115
  314    HD2  LYS  39           HD2      LYS  39  80.494  17.027   3.982
  315    HD3  LYS  39           HD1      LYS  39  78.975  16.246   4.420
  316    HE2  LYS  39           HE2      LYS  39  79.808  17.397   6.379
  317    HE3  LYS  39           HE1      LYS  39  80.001  15.664   6.645
  318    HZ1  LYS  39           HZ1      LYS  39  82.095  16.245   7.138
  319    HZ2  LYS  39           HZ2      LYS  39  82.011  17.718   6.296
  320    HZ3  LYS  39           HZ3      LYS  39  82.312  16.272   5.456
  321    H    SER  40           HN       SER  40  78.015  12.564   5.464
  322    HA   SER  40           HA       SER  40  76.856  11.204   6.992
  323    HG   SER  40           HG       SER  40  77.353  10.274   3.859
  324    HB2  SER  40           HB2      SER  40  77.976   8.882   5.423
  325    HB3  SER  40           HB1      SER  40  76.404   9.016   6.205
  326    H    LYS  41           HN       LYS  41  78.946  11.992   8.314
  327    HA   LYS  41           HA       LYS  41  81.117  10.522   9.045
  328    HB2  LYS  41           HB2      LYS  41  79.332  11.452  11.275
  329    HB3  LYS  41           HB1      LYS  41  81.083  11.588  11.118
  330    HG2  LYS  41           HG2      LYS  41  80.514  13.762  10.606
  331    HG3  LYS  41           HG1      LYS  41  80.391  13.062   8.991
  332    HD2  LYS  41           HD2      LYS  41  77.920  12.537   9.707
  333    HD3  LYS  41           HD1      LYS  41  78.194  13.806  10.901
  334    HE2  LYS  41           HE2      LYS  41  78.418  14.042   7.890
  335    HE3  LYS  41           HE1      LYS  41  77.268  14.864   8.945
  336    HZ1  LYS  41           HZ1      LYS  41  79.298  15.840  10.066
  337    HZ2  LYS  41           HZ2      LYS  41  78.933  16.424   8.513
  338    HZ3  LYS  41           HZ3      LYS  41  80.186  15.296   8.727
  339    HA   PRO  42           HA       PRO  42  78.914   6.706  10.219
  340    HB2  PRO  42           HB2      PRO  42  80.781   4.955   9.347
  341    HB3  PRO  42           HB1      PRO  42  79.695   5.795   8.223
  342    HG2  PRO  42           HG2      PRO  42  82.549   6.315   8.830
  343    HG3  PRO  42           HG1      PRO  42  81.667   6.482   7.305
  344    HD2  PRO  42           HD2      PRO  42  82.313   8.581   9.066
  345    HD3  PRO  42           HD1      PRO  42  81.131   8.660   7.743
  346    HA   PRO  43           HA       PRO  43  80.558   5.643  14.182
  347    HB2  PRO  43           HB2      PRO  43  81.152   2.872  13.616
  348    HB3  PRO  43           HB1      PRO  43  79.776   3.535  14.511
  349    HG2  PRO  43           HG2      PRO  43  79.928   2.616  11.742
  350    HG3  PRO  43           HG1      PRO  43  78.517   2.830  12.788
  351    HD2  PRO  43           HD2      PRO  43  79.047   4.476  10.673
  352    HD3  PRO  43           HD1      PRO  43  78.198   5.034  12.134
  353    H    LYS  44           HN       LYS  44  82.600   4.813  15.248
  354    HA   LYS  44           HA       LYS  44  84.942   5.883  14.588
  355    HB2  LYS  44           HB2      LYS  44  84.702   4.285  16.458
  356    HB3  LYS  44           HB1      LYS  44  84.739   2.945  15.312
  357    HG2  LYS  44           HG2      LYS  44  86.995   3.553  14.609
  358    HG3  LYS  44           HG1      LYS  44  86.963   4.980  15.645
  359    HD2  LYS  44           HD2      LYS  44  86.436   2.299  16.875
  360    HD3  LYS  44           HD1      LYS  44  88.099   2.743  16.489
  361    HE2  LYS  44           HE2      LYS  44  87.832   4.833  17.793
  362    HE3  LYS  44           HE1      LYS  44  86.186   4.354  18.205
  363    HZ1  LYS  44           HZ1      LYS  44  88.662   2.865  18.891
  364    HZ2  LYS  44           HZ2      LYS  44  87.081   2.357  19.252
  365    HZ3  LYS  44           HZ3      LYS  44  87.709   3.765  19.967
  366    H    LYS  45           HN       LYS  45  86.646   5.660  13.152
  367    HA   LYS  45           HA       LYS  45  87.909   4.617  11.391
  368    HB2  LYS  45           HB2      LYS  45  86.454   2.507  11.725
  369    HB3  LYS  45           HB1      LYS  45  85.399   3.199  10.489
  370    HG2  LYS  45           HG2      LYS  45  87.435   3.409   9.004
  371    HG3  LYS  45           HG1      LYS  45  88.323   2.470  10.205
  372    HD2  LYS  45           HD2      LYS  45  87.040   0.539   9.832
  373    HD3  LYS  45           HD1      LYS  45  85.718   1.446   9.097
  374    HE2  LYS  45           HE2      LYS  45  88.462   1.327   7.838
  375    HE3  LYS  45           HE1      LYS  45  87.226   0.116   7.497
  376    HZ1  LYS  45           HZ1      LYS  45  86.955   3.046   7.096
  377    HZ2  LYS  45           HZ2      LYS  45  85.737   1.898   6.805
  378    HZ3  LYS  45           HZ3      LYS  45  87.157   1.887   5.873
  379    H    GLY  46           HN       GLY  46  88.080   5.338   9.202
  380    HA2  GLY  46           HA2      GLY  46  86.081   6.346   7.543
  381    HA3  GLY  46           HA1      GLY  46  86.494   7.688   8.611
  382    H    VAL  47           HN       VAL  47  89.317   6.876   8.855
  383    HA   VAL  47           HA       VAL  47  90.480   8.408   6.817
  384    HB   VAL  47           HB       VAL  47  92.610   7.237   7.369
  385   HG11  VAL  47          HG11      VAL  47  92.517   7.719   9.852
  386   HG12  VAL  47          HG12      VAL  47  90.785   7.996   9.665
  387   HG13  VAL  47          HG13      VAL  47  91.940   9.035   8.829
  388   HG21  VAL  47          HG21      VAL  47  92.380   5.507   9.264
  389   HG22  VAL  47          HG22      VAL  47  91.937   4.971   7.643
  390   HG23  VAL  47          HG23      VAL  47  90.681   5.403   8.803
  391    H    GLN  48           HN       GLN  48  90.703   8.064   4.663
  392    HA   GLN  48           HA       GLN  48  91.389   5.499   3.537
  393    HB2  GLN  48           HB2      GLN  48  88.873   5.317   4.162
  394    HB3  GLN  48           HB1      GLN  48  88.606   6.414   2.807
  395    HG2  GLN  48           HG2      GLN  48  88.411   4.264   1.841
  396    HG3  GLN  48           HG1      GLN  48  90.055   4.762   1.439
  397   HE21  GLN  48          HE21      GLN  48  88.562   3.334   4.409
  398   HE22  GLN  48          HE22      GLN  48  89.696   2.078   4.547
  399    H    GLY  49           HN       GLY  49  89.252   8.110   2.352
  400    HA2  GLY  49           HA2      GLY  49  90.904   9.853   1.095
  401    HA3  GLY  49           HA1      GLY  49  91.008   8.462   0.013
  402    H1U  RCY  50           H1U      RCY  50  80.068   6.811   1.292
  403    H1S  RCY  50           H1S      RCY  50  84.363   7.988   0.822
  404    HB1  RCY  50           HB1      RCY  50  85.858  11.578   1.588
  405    HB2  RCY  50           HB2      RCY  50  86.303   9.881   1.757
  406    HA   RCY  50           HA       RCY  50  86.901  10.246  -0.859
  407    HN1  RCY  50           HN1      RCY  50  88.795  10.855   1.380
  408    H    GLY  51           HN       GLY  51  85.253  12.537  -0.300
  409    HA2  GLY  51           HA2      GLY  51  87.147  14.770  -0.924
  410    HA3  GLY  51           HA1      GLY  51  85.638  14.554  -1.813
  411    H    ASP  52           HN       ASP  52  84.145  13.740   0.590
  412    HA   ASP  52           HA       ASP  52  83.032  14.685   2.432
  413    HB2  ASP  52           HB2      ASP  52  85.508  15.574   2.864
  414    HB3  ASP  52           HB1      ASP  52  84.782  17.118   2.415
  415    H    ASP  53           HN       ASP  53  81.112  15.195   1.407
  416    HA   ASP  53           HA       ASP  53  80.595  18.000   0.855
  417    HB2  ASP  53           HB2      ASP  53  80.057  17.824  -1.491
  418    HB3  ASP  53           HB1      ASP  53  81.691  17.195  -1.279
  419    H    ILE  54           HN       ILE  54  78.446  16.716  -1.117
  420    HA   ILE  54           HA       ILE  54  76.757  15.333   0.877
  421    HB   ILE  54           HB       ILE  54  74.851  16.951   0.330
  422   HG12  ILE  54          HG12      ILE  54  76.952  18.992  -0.252
  423   HG13  ILE  54          HG11      ILE  54  76.473  17.923  -1.570
  424   HG21  ILE  54          HG21      ILE  54  77.220  18.133   1.806
  425   HG22  ILE  54          HG22      ILE  54  76.150  16.907   2.485
  426   HG23  ILE  54          HG23      ILE  54  75.516  18.500   2.072
  427   HD11  ILE  54          HD11      ILE  54  75.098  19.985  -1.524
  428   HD12  ILE  54          HD12      ILE  54  74.567  19.580   0.108
  429   HD13  ILE  54          HD13      ILE  54  74.120  18.544  -1.247
  430    HA   PRO  55           HA       PRO  55  76.338  13.809  -3.498
  431    HB2  PRO  55           HB2      PRO  55  76.294  11.171  -2.185
  432    HB3  PRO  55           HB1      PRO  55  77.363  11.765  -3.467
  433    HG2  PRO  55           HG2      PRO  55  78.199  11.317  -0.945
  434    HG3  PRO  55           HG1      PRO  55  78.908  12.556  -1.993
  435    HD2  PRO  55           HD2      PRO  55  76.978  12.888   0.279
  436    HD3  PRO  55           HD1      PRO  55  78.319  13.943  -0.227
  437    H    GLY  56           HN       GLY  56  74.829  12.154  -0.703
  438    HA2  GLY  56           HA2      GLY  56  72.157  12.718  -1.875
  439    HA3  GLY  56           HA1      GLY  56  72.570  11.042  -1.505
  440    H    MET  57           HN       MET  57  73.969  13.397   0.547
  441    HA   MET  57           HA       MET  57  73.607  13.964   2.782
  442    HB2  MET  57           HB2      MET  57  70.724  13.287   2.118
  443    HB3  MET  57           HB1      MET  57  71.269  14.117   3.572
  444    HG2  MET  57           HG2      MET  57  72.297  15.877   2.102
  445    HG3  MET  57           HG1      MET  57  71.544  15.087   0.716
  446    HE1  MET  57           HE1      MET  57  71.369  18.042   2.256
  447    HE2  MET  57           HE2      MET  57  69.711  18.521   1.902
  448    HE3  MET  57           HE3      MET  57  70.714  17.835   0.627
  449    H    GLU  58           HN       GLU  58  71.674  11.062   1.927
  450    HA   GLU  58           HA       GLU  58  73.121   9.601   4.071
  451    HB2  GLU  58           HB2      GLU  58  70.110   9.858   3.850
  452    HB3  GLU  58           HB1      GLU  58  70.900   8.590   4.784
  453    HG2  GLU  58           HG2      GLU  58  70.527  10.272   6.388
  454    HG3  GLU  58           HG1      GLU  58  72.203  10.542   5.910
  455    H    GLY  59           HN       GLY  59  71.265   9.620   1.107
  456    HA2  GLY  59           HA2      GLY  59  72.550   7.449  -0.079
  457    HA3  GLY  59           HA1      GLY  59  71.181   6.743   0.779
  458    H1U  RCY  60           H1U      RCY  60  75.341   5.369  -5.891
  459    H1S  RCY  60           H1S      RCY  60  72.393   7.279  -3.744
  460    HB1  RCY  60           HB1      RCY  60  69.591   9.846  -4.248
  461    HB2  RCY  60           HB2      RCY  60  69.776   8.231  -3.567
  462    HA   RCY  60           HA       RCY  60  69.476  10.859  -2.114
  463    HN1  RCY  60           HN1      RCY  60  70.824   9.974  -0.410
  464    H    GLY  61           HN       GLY  61  68.565   8.560  -0.066
  465    HA2  GLY  61           HA2      GLY  61  65.981   8.741   0.242
  466    HA3  GLY  61           HA1      GLY  61  65.934   8.020  -1.368
  467    H    THR  62           HN       THR  62  68.060   7.283   1.408
  468    HA   THR  62           HA       THR  62  68.137   4.529   1.031
  469    HB   THR  62           HB       THR  62  69.451   4.720   2.860
  470    HG1  THR  62           HG1      THR  62  67.726   3.876   4.015
  471   HG21  THR  62          HG21      THR  62  68.049   7.374   3.283
  472   HG22  THR  62          HG22      THR  62  69.557   7.113   2.406
  473   HG23  THR  62          HG23      THR  62  69.495   6.855   4.149
  474    H    ASP  63           HN       ASP  63  66.733   2.891   1.367
  475    HA   ASP  63           HA       ASP  63  63.973   3.244   1.491
  476    HB2  ASP  63           HB2      ASP  63  65.493   0.891   2.651
  477    HB3  ASP  63           HB1      ASP  63  63.805   0.890   2.142
  478    H    ILE  64           HN       ILE  64  66.093   2.443   4.295
  479    HA   ILE  64           HA       ILE  64  63.884   2.936   6.128
  480    HB   ILE  64           HB       ILE  64  66.684   2.021   6.376
  481   HG12  ILE  64          HG12      ILE  64  64.147   1.451   7.944
  482   HG13  ILE  64          HG11      ILE  64  64.694   0.539   6.537
  483   HG21  ILE  64          HG21      ILE  64  66.752   2.598   8.805
  484   HG22  ILE  64          HG22      ILE  64  65.311   3.590   8.580
  485   HG23  ILE  64          HG23      ILE  64  66.816   4.023   7.768
  486   HD11  ILE  64          HD11      ILE  64  66.487   0.909   8.931
  487   HD12  ILE  64          HD12      ILE  64  66.571  -0.324   7.673
  488   HD13  ILE  64          HD13      ILE  64  65.292  -0.387   8.885
  489    H    THR  65           HN       THR  65  66.066   4.855   4.450
  490    HA   THR  65           HA       THR  65  65.999   7.237   4.403
  491    HB   THR  65           HB       THR  65  65.233   7.307   7.314
  492    HG1  THR  65           HG1      THR  65  63.236   7.525   5.423
  493   HG21  THR  65          HG21      THR  65  64.564   9.152   5.008
  494   HG22  THR  65          HG22      THR  65  65.968   9.365   6.053
  495   HG23  THR  65          HG23      THR  65  64.342   9.471   6.728
  496    H    VAL  66           HN       VAL  66  67.470   5.161   6.700
  497    HA   VAL  66           HA       VAL  66  69.882   6.866   6.639
  498    HB   VAL  66           HB       VAL  66  70.125   6.452   9.181
  499   HG11  VAL  66          HG11      VAL  66  67.951   8.321   8.187
  500   HG12  VAL  66          HG12      VAL  66  69.681   8.663   8.141
  501   HG13  VAL  66          HG13      VAL  66  68.858   8.491   9.691
  502   HG21  VAL  66          HG21      VAL  66  67.955   6.257  10.372
  503   HG22  VAL  66          HG22      VAL  66  68.280   4.834   9.381
  504   HG23  VAL  66          HG23      VAL  66  67.136   6.054   8.823
  505    H    ILE  67           HN       ILE  67  68.498   3.834   7.991
  506    HA   ILE  67           HA       ILE  67  70.949   2.449   6.991
  507    HB   ILE  67           HB       ILE  67  69.679   2.181   9.729
  508   HG12  ILE  67          HG12      ILE  67  71.508   3.962   9.051
  509   HG13  ILE  67          HG11      ILE  67  71.673   3.064  10.560
  510   HG21  ILE  67          HG21      ILE  67  71.648   0.468   9.950
  511   HG22  ILE  67          HG22      ILE  67  71.533   0.377   8.193
  512   HG23  ILE  67          HG23      ILE  67  70.143  -0.052   9.190
  513   HD11  ILE  67          HD11      ILE  67  73.736   3.189   8.987
  514   HD12  ILE  67          HD12      ILE  67  72.869   2.010   8.002
  515   HD13  ILE  67          HD13      ILE  67  73.305   1.619   9.666
  516    H1U  RCY  68           H1U      RCY  68  71.893   1.806  -1.773
  517    H1S  RCY  68           H1S      RCY  68  70.767   2.264   2.101
  518    HB1  RCY  68           HB1      RCY  68  67.408  -0.178   3.279
  519    HB2  RCY  68           HB2      RCY  68  69.103  -0.646   3.403
  520    HA   RCY  68           HA       RCY  68  67.218   0.223   5.536
  521    HN1  RCY  68           HN1      RCY  68  69.704   1.618   5.245
  522    HA   PRO  69           HA       PRO  69  68.079  -3.723   7.288
  523    HB2  PRO  69           HB2      PRO  69  67.342  -4.930   4.643
  524    HB3  PRO  69           HB1      PRO  69  66.780  -5.358   6.271
  525    HG2  PRO  69           HG2      PRO  69  65.268  -3.929   4.603
  526    HG3  PRO  69           HG1      PRO  69  65.270  -3.624   6.348
  527    HD2  PRO  69           HD2      PRO  69  66.442  -1.987   4.159
  528    HD3  PRO  69           HD1      PRO  69  65.883  -1.485   5.769
  529    H    TRP  70           HN       TRP  70  69.296  -3.312   3.961
  530    HA   TRP  70           HA       TRP  70  71.336  -5.344   4.215
  531    HD1  TRP  70           HD1      TRP  70  72.327  -6.234   1.009
  532    HE1  TRP  70           HE1      TRP  70  70.512  -7.774   0.021
  533    HE3  TRP  70           HE3      TRP  70  68.138  -3.861   2.709
  534    HZ2  TRP  70           HZ2      TRP  70  67.655  -7.973  -0.040
  535    HZ3  TRP  70           HZ3      TRP  70  65.888  -4.744   2.174
  536    HH2  TRP  70           HH2      TRP  70  65.639  -6.793   0.804
  537    HB2  TRP  70           HB2      TRP  70  70.805  -3.098   2.281
  538    HB3  TRP  70           HB1      TRP  70  72.332  -3.978   2.210
  539    H    GLU  71           HN       GLU  71  71.063  -2.832   6.113
  540    HA   GLU  71           HA       GLU  71  74.007  -2.460   6.345
  541    HB2  GLU  71           HB2      GLU  71  71.943  -0.294   5.981
  542    HB3  GLU  71           HB1      GLU  71  73.410   0.028   6.905
  543    HG2  GLU  71           HG2      GLU  71  74.810  -0.338   5.051
  544    HG3  GLU  71           HG1      GLU  71  73.570  -1.237   4.176
  545    H    ALA  72           HN       ALA  72  70.989  -3.039   7.737
  546    HA   ALA  72           HA       ALA  72  71.382  -1.888  10.345
  547    HB1  ALA  72           HB1      ALA  72  69.170  -2.641   9.545
  548    HB2  ALA  72           HB2      ALA  72  69.600  -3.439  11.057
  549    HB3  ALA  72           HB3      ALA  72  69.744  -4.309   9.529
  550    H1U  RCY  73           H1U      RCY  73  77.133  -1.836   5.865
  551    H1S  RCY  73           H1S      RCY  73  75.547  -5.207   7.766
  552    HB1  RCY  73           HB1      RCY  73  73.874  -7.613   9.600
  553    HB2  RCY  73           HB2      RCY  73  75.333  -6.723   9.172
  554    HA   RCY  73           HA       RCY  73  73.454  -6.056  11.179
  555    HN1  RCY  73           HN1      RCY  73  72.891  -4.506   8.762
  556    H    ASN  74           HN       ASN  74  74.913  -3.411   9.443
  557    HA   ASN  74           HA       ASN  74  76.995  -2.329   9.717
  558    HB2  ASN  74           HB2      ASN  74  77.427  -1.845  12.199
  559    HB3  ASN  74           HB1      ASN  74  75.871  -1.322  11.556
  560   HD21  ASN  74          HD21      ASN  74  77.440  -3.719  13.646
  561   HD22  ASN  74          HD22      ASN  74  76.008  -4.307  14.343
  562    H    HIS  75           HN       HIS  75  77.008  -5.382   9.668
  563    HA   HIS  75           HA       HIS  75  79.539  -5.850  11.189
  564    HD1  HIS  75           HD1      HIS  75  77.948  -5.442  12.604
  565    HD2  HIS  75           HD2      HIS  75  77.387  -9.572  12.765
  566    HE1  HIS  75           HE1      HIS  75  77.161  -5.966  14.954
  567    HE2  HIS  75           HE2      HIS  75  76.816  -8.477  15.065
  568    HB2  HIS  75           HB2      HIS  75  77.410  -7.702  10.104
  569    HB3  HIS  75           HB1      HIS  75  78.996  -8.299  10.594
  570    H1U  RCY  76           H1U      RCY  76  76.423  -2.395   8.555
  571    H1S  RCY  76           H1S      RCY  76  80.445  -3.557   9.985
  572    HB1  RCY  76           HB1      RCY  76  81.412  -3.713   6.836
  573    HB2  RCY  76           HB2      RCY  76  83.059  -4.340   6.867
  574    HA   RCY  76           HA       RCY  76  80.991  -5.996   6.931
  575    HN1  RCY  76           HN1      RCY  76  81.050  -5.001   9.732
  576    H    GLU  77           HN       GLU  77  81.878  -8.026   6.904
  577    HA   GLU  77           HA       GLU  77  83.949  -8.942   8.653
  578    HB2  GLU  77           HB2      GLU  77  82.628  -9.912   6.175
  579    HB3  GLU  77           HB1      GLU  77  84.241 -10.557   6.474
  580    HG2  GLU  77           HG2      GLU  77  82.170 -10.500   8.664
  581    HG3  GLU  77           HG1      GLU  77  82.219 -11.823   7.498
  582    H    LEU  78           HN       LEU  78  86.209  -9.166   8.264
  583    HA   LEU  78           HA       LEU  78  87.543  -7.019   7.060
  584    HG   LEU  78           HG       LEU  78  89.736  -8.651   9.389
  585    HB2  LEU  78           HB2      LEU  78  88.338  -9.792   7.853
  586    HB3  LEU  78           HB1      LEU  78  89.453  -8.896   6.826
  587   HD11  LEU  78          HD11      LEU  78  89.589  -6.453   7.352
  588   HD12  LEU  78          HD12      LEU  78  91.002  -7.140   8.152
  589   HD13  LEU  78          HD13      LEU  78  89.940  -6.040   9.030
  590   HD21  LEU  78          HD21      LEU  78  87.129  -8.223   9.491
  591   HD22  LEU  78          HD22      LEU  78  87.595  -6.562   9.125
  592   HD23  LEU  78          HD23      LEU  78  88.209  -7.350  10.578
  593    H    HIS  79           HN       HIS  79  86.674 -10.157   5.636
  594    HA   HIS  79           HA       HIS  79  86.123  -9.333   3.059
  595    HD1  HIS  79           HD1      HIS  79  89.606  -8.275   0.648
  596    HD2  HIS  79           HD2      HIS  79  86.325  -7.108   2.945
  597    HE1  HIS  79           HE1      HIS  79  88.812  -6.068  -0.308
  598    HE2  HIS  79           HE2      HIS  79  86.815  -5.347   1.081
  599    HB2  HIS  79           HB2      HIS  79  89.026  -9.240   3.598
  600    HB3  HIS  79           HB1      HIS  79  88.607 -10.183   2.173
  601    H    GLU  80           HN       GLU  80  85.955 -11.528   5.161
  602    HA   GLU  80           HA       GLU  80  86.869 -13.929   3.752
  603    HB2  GLU  80           HB2      GLU  80  86.767 -13.813   6.240
  604    HB3  GLU  80           HB1      GLU  80  85.011 -13.676   6.137
  605    HG2  GLU  80           HG2      GLU  80  84.824 -15.857   5.129
  606    HG3  GLU  80           HG1      GLU  80  86.574 -15.979   4.943
  607    H    LEU  81           HN       LEU  81  83.812 -12.207   4.242
  608    HA   LEU  81           HA       LEU  81  82.138 -14.214   3.046
  609    HG   LEU  81           HG       LEU  81  82.880 -10.844   4.048
  610    HB2  LEU  81           HB2      LEU  81  80.553 -12.238   2.692
  611    HB3  LEU  81           HB1      LEU  81  81.042 -12.551   4.354
  612   HD11  LEU  81          HD11      LEU  81  82.159  -9.205   2.078
  613   HD12  LEU  81          HD12      LEU  81  81.532 -10.699   1.381
  614   HD13  LEU  81          HD13      LEU  81  83.245 -10.563   1.779
  615   HD21  LEU  81          HD21      LEU  81  80.103  -9.743   3.531
  616   HD22  LEU  81          HD22      LEU  81  81.419  -8.957   4.403
  617   HD23  LEU  81          HD23      LEU  81  80.621 -10.369   5.097
  618    H    ALA  82           HN       ALA  82  84.665 -12.918   1.613
  619    HA   ALA  82           HA       ALA  82  83.633 -11.802  -0.832
  620    HB1  ALA  82           HB1      ALA  82  85.927 -12.266  -1.714
  621    HB2  ALA  82           HB2      ALA  82  86.286 -13.139  -0.224
  622    HB3  ALA  82           HB3      ALA  82  85.945 -11.409  -0.172
  623    H    GLN  83           HN       GLN  83  82.268 -14.269  -0.131
  624    HA   GLN  83           HA       GLN  83  83.201 -16.502  -1.630
  625    HB2  GLN  83           HB2      GLN  83  80.771 -17.201  -1.638
  626    HB3  GLN  83           HB1      GLN  83  81.419 -16.826  -0.044
  627    HG2  GLN  83           HG2      GLN  83  79.482 -15.574   0.062
  628    HG3  GLN  83           HG1      GLN  83  80.539 -14.377  -0.688
  629   HE21  GLN  83          HE21      GLN  83  79.092 -17.283  -2.225
  630   HE22  GLN  83          HE22      GLN  83  78.208 -16.417  -3.387
  631    H    TYR  84           HN       TYR  84  81.330 -13.653  -2.583
  632    HA   TYR  84           HA       TYR  84  82.118 -13.925  -5.336
  633    HD1  TYR  84           HD1      TYR  84  81.591 -15.163  -7.548
  634    HD2  TYR  84           HD2      TYR  84  77.976 -13.278  -6.193
  635    HE1  TYR  84           HE1      TYR  84  81.094 -14.447  -9.869
  636    HE2  TYR  84           HE2      TYR  84  77.480 -12.562  -8.515
  637    HH   TYR  84           HH       TYR  84  79.371 -13.700 -11.232
  638    HB2  TYR  84           HB2      TYR  84  80.437 -15.735  -5.309
  639    HB3  TYR  84           HB1      TYR  84  79.229 -14.602  -4.703
  640    H    GLY  85           HN       GLY  85  80.832 -12.252  -2.749
  641    HA2  GLY  85           HA2      GLY  85  79.341 -10.196  -4.133
  642    HA3  GLY  85           HA1      GLY  85  79.996 -10.064  -2.499
  643    H    ILE  86           HN       ILE  86  82.691 -10.873  -3.689
  644    HA   ILE  86           HA       ILE  86  84.633  -9.685  -4.254
  645    HB   ILE  86           HB       ILE  86  82.744  -8.513  -6.315
  646   HG12  ILE  86          HG12      ILE  86  84.577 -10.898  -6.625
  647   HG13  ILE  86          HG11      ILE  86  82.899 -11.072  -6.111
  648   HG21  ILE  86          HG21      ILE  86  84.865  -8.324  -7.646
  649   HG22  ILE  86          HG22      ILE  86  85.761  -8.790  -6.200
  650   HG23  ILE  86          HG23      ILE  86  84.839  -7.287  -6.220
  651   HD11  ILE  86          HD11      ILE  86  83.760  -9.654  -8.648
  652   HD12  ILE  86          HD12      ILE  86  82.108 -10.018  -8.151
  653   HD13  ILE  86          HD13      ILE  86  83.206 -11.327  -8.587
  654    H1U  RCY  87           H1U      RCY  87  77.812  -3.570   0.404
  655    H1S  RCY  87           H1S      RCY  87  79.665  -5.775  -2.407
  656    HB1  RCY  87           HB1      RCY  87  82.298  -4.719  -5.822
  657    HB2  RCY  87           HB2      RCY  87  82.226  -3.554  -4.501
  658    HA   RCY  87           HA       RCY  87  84.028  -5.041  -3.977
  659    HN1  RCY  87           HN1      RCY  87  82.588  -7.035  -5.346
  Start of MODEL   68
    1    HA   MET   1           HA       MET   1  62.358   4.532 -14.219
    2    HB2  MET   1           HB2      MET   1  61.473   5.849 -16.792
    3    HB3  MET   1           HB1      MET   1  60.313   5.169 -15.650
    4    HG2  MET   1           HG2      MET   1  61.257   6.597 -13.858
    5    HG3  MET   1           HG1      MET   1  62.379   7.300 -15.023
    6    HE1  MET   1           HE1      MET   1  59.652   8.114 -13.061
    7    HE2  MET   1           HE2      MET   1  59.137   9.591 -13.873
    8    HE3  MET   1           HE3      MET   1  60.845   9.335 -13.522
    9    H    ASN   2           HN       ASN   2  60.362   3.070 -14.755
   10    HA   ASN   2           HA       ASN   2  61.284   0.554 -15.660
   11    HB2  ASN   2           HB2      ASN   2  58.919  -0.118 -15.676
   12    HB3  ASN   2           HB1      ASN   2  59.264   0.864 -14.252
   13   HD21  ASN   2          HD21      ASN   2  57.214   0.596 -16.987
   14   HD22  ASN   2          HD22      ASN   2  56.507   2.137 -16.896
   15    H    LEU   3           HN       LEU   3  61.827  -0.038 -17.699
   16    HA   LEU   3           HA       LEU   3  60.078   0.585 -19.949
   17    HG   LEU   3           HG       LEU   3  61.182   1.114 -22.114
   18    HB2  LEU   3           HB2      LEU   3  61.607   2.646 -19.572
   19    HB3  LEU   3           HB1      LEU   3  62.909   1.614 -20.162
   20   HD11  LEU   3          HD11      LEU   3  59.684   2.893 -22.600
   21   HD12  LEU   3          HD12      LEU   3  60.428   3.952 -21.402
   22   HD13  LEU   3          HD13      LEU   3  59.459   2.573 -20.880
   23   HD21  LEU   3          HD21      LEU   3  62.151   3.139 -23.322
   24   HD22  LEU   3          HD22      LEU   3  63.336   2.076 -22.563
   25   HD23  LEU   3          HD23      LEU   3  62.888   3.595 -21.786
   26    H    GLU   4           HN       GLU   4  63.102  -0.755 -18.720
   27    HA   GLU   4           HA       GLU   4  63.543  -2.391 -21.098
   28    HB2  GLU   4           HB2      GLU   4  64.823  -2.261 -18.367
   29    HB3  GLU   4           HB1      GLU   4  65.258  -3.511 -19.533
   30    HG2  GLU   4           HG2      GLU   4  66.758  -1.513 -19.647
   31    HG3  GLU   4           HG1      GLU   4  65.914  -1.826 -21.164
   32    HA   PRO   5           HA       PRO   5  60.683  -5.713 -20.346
   33    HB2  PRO   5           HB2      PRO   5  63.132  -7.385 -20.809
   34    HB3  PRO   5           HB1      PRO   5  61.502  -7.567 -21.487
   35    HG2  PRO   5           HG2      PRO   5  63.512  -6.472 -22.881
   36    HG3  PRO   5           HG1      PRO   5  61.833  -5.945 -23.068
   37    HD2  PRO   5           HD2      PRO   5  64.103  -4.509 -21.843
   38    HD3  PRO   5           HD1      PRO   5  62.556  -3.868 -22.438
   39    HA   PRO   6           HA       PRO   6  62.212  -6.481 -16.091
   40    HB2  PRO   6           HB2      PRO   6  59.863  -6.114 -14.807
   41    HB3  PRO   6           HB1      PRO   6  60.833  -4.748 -15.392
   42    HG2  PRO   6           HG2      PRO   6  58.367  -5.934 -16.534
   43    HG3  PRO   6           HG1      PRO   6  58.904  -4.248 -16.506
   44    HD2  PRO   6           HD2      PRO   6  59.138  -6.003 -18.691
   45    HD3  PRO   6           HD1      PRO   6  59.999  -4.460 -18.502
   46    H    LYS   7           HN       LYS   7  62.159  -8.419 -14.911
   47    HA   LYS   7           HA       LYS   7  59.912 -10.253 -15.041
   48    HB2  LYS   7           HB2      LYS   7  61.464 -12.088 -16.093
   49    HB3  LYS   7           HB1      LYS   7  60.638 -10.949 -17.157
   50    HG2  LYS   7           HG2      LYS   7  62.610  -9.599 -17.384
   51    HG3  LYS   7           HG1      LYS   7  63.436 -10.483 -16.101
   52    HD2  LYS   7           HD2      LYS   7  63.617 -12.451 -17.437
   53    HD3  LYS   7           HD1      LYS   7  62.476 -11.832 -18.632
   54    HE2  LYS   7           HE2      LYS   7  64.090 -10.006 -19.171
   55    HE3  LYS   7           HE1      LYS   7  65.243 -10.733 -18.051
   56    HZ1  LYS   7           HZ1      LYS   7  65.830 -12.207 -19.578
   57    HZ2  LYS   7           HZ2      LYS   7  64.876 -11.370 -20.708
   58    HZ3  LYS   7           HZ3      LYS   7  64.221 -12.677 -19.843
   59    H    ALA   8           HN       ALA   8  62.954 -11.816 -14.986
   60    HA   ALA   8           HA       ALA   8  64.305 -12.598 -13.225
   61    HB1  ALA   8           HB1      ALA   8  63.814 -10.084 -12.434
   62    HB2  ALA   8           HB2      ALA   8  64.614 -11.247 -11.377
   63    HB3  ALA   8           HB3      ALA   8  62.889 -10.927 -11.191
   64    H    GLU   9           HN       GLU   9  63.334 -12.888 -10.454
   65    HA   GLU   9           HA       GLU   9  60.903 -14.562 -10.780
   66    HB2  GLU   9           HB2      GLU   9  63.061 -15.937 -11.138
   67    HB3  GLU   9           HB1      GLU   9  63.352 -15.692  -9.416
   68    HG2  GLU   9           HG2      GLU   9  61.224 -16.738  -8.859
   69    HG3  GLU   9           HG1      GLU   9  60.810 -16.879 -10.568
   70    H1U  RCY  10           H1U      RCY  10  61.887 -15.212 -11.821
   71    H1S  RCY  10           H1S      RCY  10  62.692 -15.962  -7.184
   72    HB1  RCY  10           HB1      RCY  10  62.895 -11.907  -5.292
   73    HB2  RCY  10           HB2      RCY  10  63.875 -12.081  -6.748
   74    HA   RCY  10           HA       RCY  10  60.934 -12.799  -6.641
   75    HN1  RCY  10           HN1      RCY  10  62.569 -12.266  -9.080
   76    H    ARG  11           HN       ARG  11  62.587 -10.505  -8.741
   77    HA   ARG  11           HA       ARG  11  60.704  -8.411  -7.799
   78    HE   ARG  11           HE       ARG  11  61.881  -4.487  -7.467
   79    HB2  ARG  11           HB2      ARG  11  63.469  -8.456  -7.094
   80    HB3  ARG  11           HB1      ARG  11  63.273  -7.183  -8.297
   81    HG2  ARG  11           HG2      ARG  11  61.198  -6.486  -6.881
   82    HG3  ARG  11           HG1      ARG  11  61.943  -7.453  -5.608
   83    HD2  ARG  11           HD2      ARG  11  62.969  -5.446  -5.149
   84    HD3  ARG  11           HD1      ARG  11  64.102  -6.047  -6.359
   85   HH11  ARG  11          HH21      ARG  11  65.065  -4.538  -6.145
   86   HH12  ARG  11          HH22      ARG  11  65.545  -3.055  -6.900
   87   HH21  ARG  11          HH11      ARG  11  62.490  -2.550  -8.460
   88   HH22  ARG  11          HH12      ARG  11  64.088  -1.929  -8.210
   89    H    SER  12           HN       SER  12  59.653  -7.894  -9.649
   90    HA   SER  12           HA       SER  12  61.143  -7.977 -12.228
   91    HG   SER  12           HG       SER  12  59.923  -9.843 -11.888
   92    HB2  SER  12           HB2      SER  12  58.168  -7.739 -11.696
   93    HB3  SER  12           HB1      SER  12  58.920  -7.928 -13.277
   94    H    ALA  13           HN       ALA  13  59.007  -5.829 -10.334
   95    HA   ALA  13           HA       ALA  13  60.462  -3.471 -11.045
   96    HB1  ALA  13           HB1      ALA  13  58.005  -4.108 -12.688
   97    HB2  ALA  13           HB2      ALA  13  59.608  -3.648 -13.261
   98    HB3  ALA  13           HB3      ALA  13  58.579  -2.455 -12.469
   99    H    THR  14           HN       THR  14  59.178  -1.463 -10.366
  100    HA   THR  14           HA       THR  14  57.909  -0.363  -8.740
  101    HB   THR  14           HB       THR  14  56.204  -2.342  -9.901
  102    HG1  THR  14           HG1      THR  14  54.673  -0.779  -9.431
  103   HG21  THR  14          HG21      THR  14  54.690  -2.793  -7.999
  104   HG22  THR  14          HG22      THR  14  55.836  -2.011  -6.910
  105   HG23  THR  14          HG23      THR  14  56.282  -3.504  -7.735
  106    H    ARG  15           HN       ARG  15  58.325  -0.167  -6.586
  107    HA   ARG  15           HA       ARG  15  59.608  -2.409  -5.204
  108    HE   ARG  15           HE       ARG  15  61.131   1.460  -4.392
  109    HB2  ARG  15           HB2      ARG  15  59.799  -0.738  -3.327
  110    HB3  ARG  15           HB1      ARG  15  60.512  -0.188  -4.844
  111    HG2  ARG  15           HG2      ARG  15  58.575   1.165  -5.345
  112    HG3  ARG  15           HG1      ARG  15  57.690   0.490  -3.976
  113    HD2  ARG  15           HD2      ARG  15  58.736   2.793  -3.603
  114    HD3  ARG  15           HD1      ARG  15  59.118   1.566  -2.395
  115   HH11  ARG  15          HH21      ARG  15  59.845   3.562  -1.981
  116   HH12  ARG  15          HH22      ARG  15  61.353   4.361  -1.684
  117   HH21  ARG  15          HH11      ARG  15  63.108   2.491  -4.018
  118   HH22  ARG  15          HH12      ARG  15  63.200   3.755  -2.837
  119    H    VAL  16           HN       VAL  16  58.828  -2.602  -2.730
  120    HA   VAL  16           HA       VAL  16  55.871  -2.516  -2.545
  121    HB   VAL  16           HB       VAL  16  55.724  -4.885  -1.918
  122   HG11  VAL  16          HG11      VAL  16  55.975  -5.815  -4.107
  123   HG12  VAL  16          HG12      VAL  16  57.261  -4.679  -4.516
  124   HG13  VAL  16          HG13      VAL  16  55.601  -4.108  -4.349
  125   HG21  VAL  16          HG21      VAL  16  57.832  -6.283  -2.463
  126   HG22  VAL  16          HG22      VAL  16  57.836  -5.366  -0.956
  127   HG23  VAL  16          HG23      VAL  16  58.709  -4.756  -2.361
  128    H    MET  17           HN       MET  17  58.909  -3.481  -0.922
  129    HA   MET  17           HA       MET  17  59.489  -3.375   1.356
  130    HB2  MET  17           HB2      MET  17  58.953  -0.865   0.439
  131    HB3  MET  17           HB1      MET  17  57.797  -0.963   1.767
  132    HG2  MET  17           HG2      MET  17  59.599  -1.591   3.315
  133    HG3  MET  17           HG1      MET  17  60.766  -1.552   1.993
  134    HE1  MET  17           HE1      MET  17  62.368   0.624   1.935
  135    HE2  MET  17           HE2      MET  17  61.469   1.908   1.129
  136    HE3  MET  17           HE3      MET  17  61.280   0.239   0.595
  137    H    GLY  18           HN       GLY  18  58.083  -2.482   3.605
  138    HA2  GLY  18           HA2      GLY  18  55.488  -2.915   4.126
  139    HA3  GLY  18           HA1      GLY  18  55.988  -4.568   3.767
  140    H    GLY  19           HN       GLY  19  55.298  -2.775   6.316
  141    HA2  GLY  19           HA2      GLY  19  56.045  -2.656   8.551
  142    HA3  GLY  19           HA1      GLY  19  56.416  -4.361   8.293
  143    HA   PRO  20           HA       PRO  20  60.396  -1.707   6.934
  144    HB2  PRO  20           HB2      PRO  20  59.778   0.541   8.815
  145    HB3  PRO  20           HB1      PRO  20  60.590   0.581   7.238
  146    HG2  PRO  20           HG2      PRO  20  58.062   1.375   7.534
  147    HG3  PRO  20           HG1      PRO  20  58.619   0.548   6.070
  148    HD2  PRO  20           HD2      PRO  20  56.894  -0.482   8.266
  149    HD3  PRO  20           HD1      PRO  20  56.962  -0.971   6.559
  150    H1U  RCY  21           H1U      RCY  21  61.578  -2.834   3.491
  151    H1S  RCY  21           H1S      RCY  21  61.267  -3.977   7.468
  152    HB1  RCY  21           HB1      RCY  21  61.345  -5.652  10.083
  153    HB2  RCY  21           HB2      RCY  21  62.956  -5.353  10.737
  154    HA   RCY  21           HA       RCY  21  61.227  -3.496  11.105
  155    HN1  RCY  21           HN1      RCY  21  61.076  -3.593   8.230
  156    H    THR  22           HN       THR  22  62.237  -1.554  11.753
  157    HA   THR  22           HA       THR  22  65.170  -1.529  11.371
  158    HB   THR  22           HB       THR  22  63.741   0.009   9.701
  159    HG1  THR  22           HG1      THR  22  66.123  -0.194  10.186
  160   HG21  THR  22          HG21      THR  22  63.537   2.282  10.581
  161   HG22  THR  22          HG22      THR  22  64.161   1.754  12.144
  162   HG23  THR  22          HG23      THR  22  62.596   1.172  11.576
  163    HA   PRO  23           HA       PRO  23  65.121  -0.103  15.550
  164    HB2  PRO  23           HB2      PRO  23  67.134   1.939  15.353
  165    HB3  PRO  23           HB1      PRO  23  67.335   0.250  15.841
  166    HG2  PRO  23           HG2      PRO  23  68.322   1.394  13.523
  167    HG3  PRO  23           HG1      PRO  23  68.137  -0.339  13.825
  168    HD2  PRO  23           HD2      PRO  23  66.410   1.485  12.204
  169    HD3  PRO  23           HD1      PRO  23  66.752  -0.247  11.978
  170    H    ARG  24           HN       ARG  24  64.960   2.727  13.330
  171    HA   ARG  24           HA       ARG  24  63.090   3.964  15.280
  172    HE   ARG  24           HE       ARG  24  62.643   7.904  17.620
  173    HB2  ARG  24           HB2      ARG  24  65.253   4.824  15.962
  174    HB3  ARG  24           HB1      ARG  24  65.638   5.278  14.305
  175    HG2  ARG  24           HG2      ARG  24  64.857   7.218  15.682
  176    HG3  ARG  24           HG1      ARG  24  63.826   6.913  14.283
  177    HD2  ARG  24           HD2      ARG  24  62.139   5.899  15.610
  178    HD3  ARG  24           HD1      ARG  24  63.223   5.715  16.990
  179   HH11  ARG  24          HH21      ARG  24  62.110   7.363  14.258
  180   HH12  ARG  24          HH22      ARG  24  61.409   8.923  13.982
  181   HH21  ARG  24          HH11      ARG  24  61.732   9.945  17.279
  182   HH22  ARG  24          HH12      ARG  24  61.196  10.384  15.692
  183    H    LYS  25           HN       LYS  25  63.901   3.369  12.033
  184    HA   LYS  25           HA       LYS  25  62.934   4.141  10.020
  185    HB2  LYS  25           HB2      LYS  25  60.856   4.500  12.115
  186    HB3  LYS  25           HB1      LYS  25  60.613   5.443  10.648
  187    HG2  LYS  25           HG2      LYS  25  60.245   3.586   9.353
  188    HG3  LYS  25           HG1      LYS  25  61.393   2.600  10.259
  189    HD2  LYS  25           HD2      LYS  25  59.084   1.812  10.622
  190    HD3  LYS  25           HD1      LYS  25  59.781   2.429  12.121
  191    HE2  LYS  25           HE2      LYS  25  57.453   3.245  11.743
  192    HE3  LYS  25           HE1      LYS  25  58.626   4.559  11.827
  193    HZ1  LYS  25           HZ1      LYS  25  58.728   4.467   9.360
  194    HZ2  LYS  25           HZ2      LYS  25  57.219   4.950   9.972
  195    HZ3  LYS  25           HZ3      LYS  25  57.434   3.371   9.384
  196    H    GLY  26           HN       GLY  26  62.243   6.199   8.884
  197    HA2  GLY  26           HA2      GLY  26  62.574   8.767  10.092
  198    HA3  GLY  26           HA1      GLY  26  64.100   8.283   9.348
  199    HA   PRO  27           HA       PRO  27  60.428   9.682   6.306
  200    HB2  PRO  27           HB2      PRO  27  61.851  12.304   6.483
  201    HB3  PRO  27           HB1      PRO  27  60.119  11.971   6.290
  202    HG2  PRO  27           HG2      PRO  27  61.150  12.760   8.623
  203    HG3  PRO  27           HG1      PRO  27  59.796  11.623   8.532
  204    HD2  PRO  27           HD2      PRO  27  62.640  11.103   9.247
  205    HD3  PRO  27           HD1      PRO  27  61.173  10.231   9.742
  206    HA   PRO  28           HA       PRO  28  63.738   8.506   3.417
  207    HB2  PRO  28           HB2      PRO  28  61.599   9.306   1.476
  208    HB3  PRO  28           HB1      PRO  28  62.600   7.840   1.509
  209    HG2  PRO  28           HG2      PRO  28  60.053   7.809   2.296
  210    HG3  PRO  28           HG1      PRO  28  61.285   6.819   3.096
  211    HD2  PRO  28           HD2      PRO  28  59.928   9.286   4.077
  212    HD3  PRO  28           HD1      PRO  28  60.611   7.930   5.001
  213    H    LYS  29           HN       LYS  29  65.343   9.832   2.622
  214    HA   LYS  29           HA       LYS  29  64.654  12.374   1.320
  215    HB2  LYS  29           HB2      LYS  29  64.813  12.638   3.943
  216    HB3  LYS  29           HB1      LYS  29  66.550  12.584   3.644
  217    HG2  LYS  29           HG2      LYS  29  66.317  14.431   2.008
  218    HG3  LYS  29           HG1      LYS  29  64.587  14.501   2.348
  219    HD2  LYS  29           HD2      LYS  29  65.114  14.961   4.744
  220    HD3  LYS  29           HD1      LYS  29  66.828  15.002   4.328
  221    HE2  LYS  29           HE2      LYS  29  66.562  16.932   2.966
  222    HE3  LYS  29           HE1      LYS  29  64.807  16.759   2.931
  223    HZ1  LYS  29           HZ1      LYS  29  64.613  17.458   5.120
  224    HZ2  LYS  29           HZ2      LYS  29  65.816  18.484   4.498
  225    HZ3  LYS  29           HZ3      LYS  29  66.245  17.163   5.476
  226    H1U  RCY  30           H1U      RCY  30  67.093  15.992   1.918
  227    H1S  RCY  30           H1S      RCY  30  70.674  13.301   3.801
  228    HB1  RCY  30           HB1      RCY  30  70.069  10.375   0.614
  229    HB2  RCY  30           HB2      RCY  30  68.921  10.360   1.952
  230    HA   RCY  30           HA       RCY  30  69.613  13.072   1.045
  231    HN1  RCY  30           HN1      RCY  30  67.561  13.147   2.194
  232    H    LYS  31           HN       LYS  31  70.641  11.534  -0.943
  233    HA   LYS  31           HA       LYS  31  68.609  11.757  -3.135
  234    HB2  LYS  31           HB2      LYS  31  71.427  12.663  -2.910
  235    HB3  LYS  31           HB1      LYS  31  71.014  11.883  -4.435
  236    HG2  LYS  31           HG2      LYS  31  70.562  14.230  -4.709
  237    HG3  LYS  31           HG1      LYS  31  69.001  13.423  -4.558
  238    HD2  LYS  31           HD2      LYS  31  68.813  14.068  -2.238
  239    HD3  LYS  31           HD1      LYS  31  70.464  14.687  -2.225
  240    HE2  LYS  31           HE2      LYS  31  69.113  16.619  -2.480
  241    HE3  LYS  31           HE1      LYS  31  69.696  16.271  -4.108
  242    HZ1  LYS  31           HZ1      LYS  31  67.046  16.383  -3.191
  243    HZ2  LYS  31           HZ2      LYS  31  67.366  14.795  -3.702
  244    HZ3  LYS  31           HZ3      LYS  31  67.606  16.098  -4.766
  245    H    GLN  32           HN       GLN  32  68.162   9.868  -4.148
  246    HA   GLN  32           HA       GLN  32  70.227   7.716  -4.159
  247    HB2  GLN  32           HB2      GLN  32  67.311   7.334  -3.404
  248    HB3  GLN  32           HB1      GLN  32  68.500   6.045  -3.590
  249    HG2  GLN  32           HG2      GLN  32  68.674   6.371  -1.310
  250    HG3  GLN  32           HG1      GLN  32  69.859   7.560  -1.854
  251   HE21  GLN  32          HE21      GLN  32  68.008   7.579   0.579
  252   HE22  GLN  32          HE22      GLN  32  67.171   9.051   0.464
  253    H    ARG  33           HN       ARG  33  70.436   8.445  -6.416
  254    HA   ARG  33           HA       ARG  33  68.135   8.179  -8.198
  255    HE   ARG  33           HE       ARG  33  71.483  12.702  -7.706
  256    HB2  ARG  33           HB2      ARG  33  71.099   8.505  -8.770
  257    HB3  ARG  33           HB1      ARG  33  69.836   8.534  -9.998
  258    HG2  ARG  33           HG2      ARG  33  70.020  10.805  -9.566
  259    HG3  ARG  33           HG1      ARG  33  68.785  10.370  -8.384
  260    HD2  ARG  33           HD2      ARG  33  70.395  10.263  -6.610
  261    HD3  ARG  33           HD1      ARG  33  71.742  10.365  -7.743
  262   HH11  ARG  33          HH21      ARG  33  68.594  11.081  -6.753
  263   HH12  ARG  33          HH22      ARG  33  67.744  12.540  -6.368
  264   HH21  ARG  33          HH11      ARG  33  70.389  14.617  -7.210
  265   HH22  ARG  33          HH12      ARG  33  68.760  14.542  -6.627
  266    H    GLN  34           HN       GLN  34  70.736   6.832  -9.775
  267    HA   GLN  34           HA       GLN  34  69.732   4.054  -9.257
  268    HB2  GLN  34           HB2      GLN  34  69.314   5.133 -11.562
  269    HB3  GLN  34           HB1      GLN  34  71.054   4.986 -11.810
  270    HG2  GLN  34           HG2      GLN  34  70.911   2.558 -11.382
  271    HG3  GLN  34           HG1      GLN  34  69.169   2.703 -11.145
  272   HE21  GLN  34          HE21      GLN  34  68.963   1.198 -13.054
  273   HE22  GLN  34          HE22      GLN  34  69.099   1.833 -14.622
  274    H    THR  35           HN       THR  35  71.696   4.942  -7.574
  275    HA   THR  35           HA       THR  35  73.888   4.513  -6.850
  276    HB   THR  35           HB       THR  35  74.612   2.318  -7.181
  277    HG1  THR  35           HG1      THR  35  73.331   1.741  -9.518
  278   HG21  THR  35          HG21      THR  35  72.143   2.501  -6.508
  279   HG22  THR  35          HG22      THR  35  72.678   0.939  -7.128
  280   HG23  THR  35          HG23      THR  35  71.772   2.038  -8.169
  281    H    ARG  36           HN       ARG  36  73.218   5.692  -9.805
  282    HA   ARG  36           HA       ARG  36  74.484   6.484 -11.614
  283    HE   ARG  36           HE       ARG  36  74.232   8.596 -11.538
  284    HB2  ARG  36           HB2      ARG  36  75.028   8.083  -9.822
  285    HB3  ARG  36           HB1      ARG  36  76.336   7.042  -9.274
  286    HG2  ARG  36           HG2      ARG  36  76.939   9.034 -10.838
  287    HG3  ARG  36           HG1      ARG  36  77.641   7.456 -11.198
  288    HD2  ARG  36           HD2      ARG  36  76.638   8.665 -13.195
  289    HD3  ARG  36           HD1      ARG  36  76.023   7.034 -12.921
  290   HH11  ARG  36          HH21      ARG  36  75.588   8.652 -14.707
  291   HH12  ARG  36          HH22      ARG  36  74.188   9.364 -15.438
  292   HH21  ARG  36          HH11      ARG  36  72.396   9.524 -12.473
  293   HH22  ARG  36          HH12      ARG  36  72.380   9.858 -14.173
  294    H    GLN  37           HN       GLN  37  74.734   3.739 -11.521
  295    HA   GLN  37           HA       GLN  37  76.134   1.978 -12.192
  296    HB2  GLN  37           HB2      GLN  37  76.465   3.839 -14.001
  297    HB3  GLN  37           HB1      GLN  37  78.038   4.067 -13.242
  298    HG2  GLN  37           HG2      GLN  37  77.852   1.307 -13.493
  299    HG3  GLN  37           HG1      GLN  37  77.114   1.899 -14.982
  300   HE21  GLN  37          HE21      GLN  37  79.950   2.869 -12.950
  301   HE22  GLN  37          HE22      GLN  37  81.015   3.026 -14.263
  302    H1U  RCY  38           H1U      RCY  38  79.725   3.730  -3.309
  303    H1S  RCY  38           H1S      RCY  38  79.017   1.361  -6.487
  304    HB1  RCY  38           HB1      RCY  38  78.398   0.294  -9.074
  305    HB2  RCY  38           HB2      RCY  38  78.695   1.887  -8.379
  306    HA   RCY  38           HA       RCY  38  80.239   2.463 -10.095
  307    HN1  RCY  38           HN1      RCY  38  78.464   1.126 -11.949
  308    H    LYS  39           HN       LYS  39  82.254   1.614 -10.436
  309    HA   LYS  39           HA       LYS  39  82.823  -0.288 -12.399
  310    HB2  LYS  39           HB2      LYS  39  84.435   1.268 -11.094
  311    HB3  LYS  39           HB1      LYS  39  84.538  -0.050  -9.927
  312    HG2  LYS  39           HG2      LYS  39  85.229  -1.589 -11.739
  313    HG3  LYS  39           HG1      LYS  39  85.160  -0.253 -12.889
  314    HD2  LYS  39           HD2      LYS  39  87.403  -0.162 -12.342
  315    HD3  LYS  39           HD1      LYS  39  86.757   0.898 -11.089
  316    HE2  LYS  39           HE2      LYS  39  88.248  -0.699 -10.035
  317    HE3  LYS  39           HE1      LYS  39  86.593  -1.097  -9.573
  318    HZ1  LYS  39           HZ1      LYS  39  87.408  -3.129 -10.208
  319    HZ2  LYS  39           HZ2      LYS  39  88.386  -2.488 -11.441
  320    HZ3  LYS  39           HZ3      LYS  39  86.705  -2.603 -11.659
  321    H    SER  40           HN       SER  40  82.392  -2.431 -12.509
  322    HA   SER  40           HA       SER  40  81.362  -3.886 -10.226
  323    HG   SER  40           HG       SER  40  83.012  -6.055 -12.563
  324    HB2  SER  40           HB2      SER  40  81.063  -5.693 -11.725
  325    HB3  SER  40           HB1      SER  40  80.852  -4.264 -12.732
  326    H    LYS  41           HN       LYS  41  84.282  -4.498 -12.228
  327    HA   LYS  41           HA       LYS  41  85.491  -6.395 -10.580
  328    HB2  LYS  41           HB2      LYS  41  86.505  -4.352 -12.501
  329    HB3  LYS  41           HB1      LYS  41  87.695  -5.066 -11.414
  330    HG2  LYS  41           HG2      LYS  41  87.552  -6.385 -13.477
  331    HG3  LYS  41           HG1      LYS  41  86.947  -7.330 -12.116
  332    HD2  LYS  41           HD2      LYS  41  84.650  -6.842 -12.723
  333    HD3  LYS  41           HD1      LYS  41  85.179  -5.733 -13.989
  334    HE2  LYS  41           HE2      LYS  41  84.514  -8.067 -14.776
  335    HE3  LYS  41           HE1      LYS  41  86.107  -7.513 -15.290
  336    HZ1  LYS  41           HZ1      LYS  41  85.782  -9.047 -12.793
  337    HZ2  LYS  41           HZ2      LYS  41  87.165  -8.864 -13.762
  338    HZ3  LYS  41           HZ3      LYS  41  85.882  -9.847 -14.286
  339    HA   PRO  42           HA       PRO  42  86.539  -4.220  -6.873
  340    HB2  PRO  42           HB2      PRO  42  88.726  -5.610  -6.027
  341    HB3  PRO  42           HB1      PRO  42  87.088  -6.295  -6.001
  342    HG2  PRO  42           HG2      PRO  42  89.279  -6.729  -7.971
  343    HG3  PRO  42           HG1      PRO  42  88.130  -7.891  -7.285
  344    HD2  PRO  42           HD2      PRO  42  87.841  -6.786  -9.785
  345    HD3  PRO  42           HD1      PRO  42  86.471  -7.348  -8.801
  346    HA   PRO  43           HA       PRO  43  89.702  -1.232  -7.742
  347    HB2  PRO  43           HB2      PRO  43  90.462  -0.475  -5.225
  348    HB3  PRO  43           HB1      PRO  43  88.905  -0.019  -5.944
  349    HG2  PRO  43           HG2      PRO  43  89.517  -2.169  -3.980
  350    HG3  PRO  43           HG1      PRO  43  88.132  -1.067  -4.055
  351    HD2  PRO  43           HD2      PRO  43  88.020  -3.671  -4.913
  352    HD3  PRO  43           HD1      PRO  43  86.998  -2.381  -5.584
  353    H    LYS  44           HN       LYS  44  92.047  -0.813  -7.560
  354    HA   LYS  44           HA       LYS  44  93.678  -3.080  -7.773
  355    HB2  LYS  44           HB2      LYS  44  95.514  -1.302  -6.917
  356    HB3  LYS  44           HB1      LYS  44  94.813  -1.226  -8.532
  357    HG2  LYS  44           HG2      LYS  44  93.210   0.434  -7.847
  358    HG3  LYS  44           HG1      LYS  44  93.641   0.230  -6.149
  359    HD2  LYS  44           HD2      LYS  44  94.861   2.138  -6.696
  360    HD3  LYS  44           HD1      LYS  44  96.055   0.872  -6.989
  361    HE2  LYS  44           HE2      LYS  44  95.181   0.840  -9.407
  362    HE3  LYS  44           HE1      LYS  44  94.378   2.360  -9.015
  363    HZ1  LYS  44           HZ1      LYS  44  96.300   3.465  -9.044
  364    HZ2  LYS  44           HZ2      LYS  44  96.925   2.122  -9.875
  365    HZ3  LYS  44           HZ3      LYS  44  97.134   2.256  -8.195
  366    H    LYS  45           HN       LYS  45  94.333  -0.902  -5.051
  367    HA   LYS  45           HA       LYS  45  94.372  -3.303  -3.256
  368    HB2  LYS  45           HB2      LYS  45  96.638  -2.522  -3.625
  369    HB3  LYS  45           HB1      LYS  45  96.168  -0.860  -3.275
  370    HG2  LYS  45           HG2      LYS  45  96.000  -1.239  -0.995
  371    HG3  LYS  45           HG1      LYS  45  95.615  -2.948  -1.202
  372    HD2  LYS  45           HD2      LYS  45  98.315  -1.977  -2.061
  373    HD3  LYS  45           HD1      LYS  45  98.009  -2.203  -0.339
  374    HE2  LYS  45           HE2      LYS  45  97.561  -4.305  -2.479
  375    HE3  LYS  45           HE1      LYS  45  98.938  -4.254  -1.378
  376    HZ1  LYS  45           HZ1      LYS  45  97.317  -4.334   0.478
  377    HZ2  LYS  45           HZ2      LYS  45  97.321  -5.733  -0.486
  378    HZ3  LYS  45           HZ3      LYS  45  96.079  -4.586  -0.655
  379    H    GLY  46           HN       GLY  46  92.566  -0.703  -3.942
  380    HA2  GLY  46           HA2      GLY  46  90.792   0.200  -2.644
  381    HA3  GLY  46           HA1      GLY  46  91.478  -0.578  -1.217
  382    H    VAL  47           HN       VAL  47  94.042   0.432  -1.170
  383    HA   VAL  47           HA       VAL  47  95.187   2.302  -0.329
  384    HB   VAL  47           HB       VAL  47  93.577   3.802  -2.415
  385   HG11  VAL  47          HG11      VAL  47  96.149   4.250  -0.925
  386   HG12  VAL  47          HG12      VAL  47  94.831   5.381  -1.233
  387   HG13  VAL  47          HG13      VAL  47  95.940   4.944  -2.532
  388   HG21  VAL  47          HG21      VAL  47  94.504   1.827  -3.482
  389   HG22  VAL  47          HG22      VAL  47  96.066   2.092  -2.706
  390   HG23  VAL  47          HG23      VAL  47  95.493   3.215  -3.939
  391    H    GLN  48           HN       GLN  48  94.702   4.744   0.403
  392    HA   GLN  48           HA       GLN  48  93.576   6.048   1.990
  393    HB2  GLN  48           HB2      GLN  48  92.005   6.163  -0.010
  394    HB3  GLN  48           HB1      GLN  48  91.060   4.890   0.762
  395    HG2  GLN  48           HG2      GLN  48  90.823   6.321   2.781
  396    HG3  GLN  48           HG1      GLN  48  91.701   7.606   1.950
  397   HE21  GLN  48          HE21      GLN  48  88.637   6.885   2.761
  398   HE22  GLN  48          HE22      GLN  48  87.800   7.486   1.412
  399    H    GLY  49           HN       GLY  49  90.705   4.285   2.302
  400    HA2  GLY  49           HA2      GLY  49  89.953   2.730   3.902
  401    HA3  GLY  49           HA1      GLY  49  91.634   2.267   4.168
  402    H1U  RCY  50           H1U      RCY  50  85.213   2.702   6.000
  403    H1S  RCY  50           H1S      RCY  50  86.221   6.829   4.904
  404    HB1  RCY  50           HB1      RCY  50  88.610   6.906   7.810
  405    HB2  RCY  50           HB2      RCY  50  87.839   5.546   6.993
  406    HA   RCY  50           HA       RCY  50  90.765   6.321   6.788
  407    HN1  RCY  50           HN1      RCY  50  89.318   4.882   4.891
  408    H    GLY  51           HN       GLY  51  88.467   3.721   7.696
  409    HA2  GLY  51           HA2      GLY  51  89.644   1.870   9.095
  410    HA3  GLY  51           HA1      GLY  51  90.160   3.221  10.106
  411    H    ASP  52           HN       ASP  52  88.740   1.420  11.458
  412    HA   ASP  52           HA       ASP  52  85.951   1.389  11.391
  413    HB2  ASP  52           HB2      ASP  52  87.744   1.544  13.836
  414    HB3  ASP  52           HB1      ASP  52  86.043   1.076  13.865
  415    H    ASP  53           HN       ASP  53  88.092   3.962  12.473
  416    HA   ASP  53           HA       ASP  53  87.629   6.148  13.199
  417    HB2  ASP  53           HB2      ASP  53  85.307   5.640  11.316
  418    HB3  ASP  53           HB1      ASP  53  85.719   7.226  11.970
  419    H    ILE  54           HN       ILE  54  84.328   6.383  12.943
  420    HA   ILE  54           HA       ILE  54  83.978   6.438  15.815
  421    HB   ILE  54           HB       ILE  54  81.575   6.851  15.237
  422   HG12  ILE  54          HG12      ILE  54  82.633   6.415  12.426
  423   HG13  ILE  54          HG11      ILE  54  81.405   5.452  13.249
  424   HG21  ILE  54          HG21      ILE  54  81.960   9.017  14.273
  425   HG22  ILE  54          HG22      ILE  54  83.454   8.477  13.507
  426   HG23  ILE  54          HG23      ILE  54  83.373   8.648  15.260
  427   HD11  ILE  54          HD11      ILE  54  80.034   7.586  13.451
  428   HD12  ILE  54          HD12      ILE  54  80.223   6.964  11.811
  429   HD13  ILE  54          HD13      ILE  54  81.192   8.334  12.351
  430    HA   PRO  55           HA       PRO  55  82.928   2.128  16.277
  431    HB2  PRO  55           HB2      PRO  55  81.773   2.206  18.741
  432    HB3  PRO  55           HB1      PRO  55  83.519   2.414  18.500
  433    HG2  PRO  55           HG2      PRO  55  81.425   4.483  18.952
  434    HG3  PRO  55           HG1      PRO  55  83.064   4.371  19.617
  435    HD2  PRO  55           HD2      PRO  55  82.412   6.002  17.505
  436    HD3  PRO  55           HD1      PRO  55  84.035   5.315  17.741
  437    H    GLY  56           HN       GLY  56  81.217   2.700  14.465
  438    HA2  GLY  56           HA2      GLY  56  79.003   2.569  13.685
  439    HA3  GLY  56           HA1      GLY  56  78.780   1.434  15.016
  440    H    MET  57           HN       MET  57  78.802   4.920  14.278
  441    HA   MET  57           HA       MET  57  76.989   5.342  16.623
  442    HB2  MET  57           HB2      MET  57  79.249   6.605  16.388
  443    HB3  MET  57           HB1      MET  57  78.428   7.537  15.136
  444    HG2  MET  57           HG2      MET  57  76.669   8.169  16.730
  445    HG3  MET  57           HG1      MET  57  77.439   7.199  17.985
  446    HE1  MET  57           HE1      MET  57  78.586  10.284  19.660
  447    HE2  MET  57           HE2      MET  57  78.066   8.603  19.766
  448    HE3  MET  57           HE3      MET  57  76.978   9.815  19.093
  449    H    GLU  58           HN       GLU  58  76.751   4.771  13.431
  450    HA   GLU  58           HA       GLU  58  75.163   5.287  11.789
  451    HB2  GLU  58           HB2      GLU  58  73.613   6.068  14.278
  452    HB3  GLU  58           HB1      GLU  58  72.904   5.900  12.672
  453    HG2  GLU  58           HG2      GLU  58  72.546   3.823  13.857
  454    HG3  GLU  58           HG1      GLU  58  73.770   3.535  12.620
  455    H    GLY  59           HN       GLY  59  73.870   7.159  10.852
  456    HA2  GLY  59           HA2      GLY  59  74.275   9.834  11.849
  457    HA3  GLY  59           HA1      GLY  59  75.448   9.468  10.583
  458    H1U  RCY  60           H1U      RCY  60  75.367   5.097   2.917
  459    H1S  RCY  60           H1S      RCY  60  74.155   9.588   3.731
  460    HB1  RCY  60           HB1      RCY  60  71.625   9.038   7.199
  461    HB2  RCY  60           HB2      RCY  60  73.377   8.863   7.191
  462    HA   RCY  60           HA       RCY  60  73.033  11.607   7.397
  463    HN1  RCY  60           HN1      RCY  60  74.530  10.915   9.064
  464    H    GLY  61           HN       GLY  61  70.842   9.147   8.715
  465    HA2  GLY  61           HA2      GLY  61  69.353  10.566  10.559
  466    HA3  GLY  61           HA1      GLY  61  68.735  11.135   9.008
  467    H    THR  62           HN       THR  62  68.331   9.173   7.414
  468    HA   THR  62           HA       THR  62  66.247   7.579   8.546
  469    HB   THR  62           HB       THR  62  66.391   6.317   6.367
  470    HG1  THR  62           HG1      THR  62  68.714   7.857   6.271
  471   HG21  THR  62          HG21      THR  62  64.944   8.185   6.355
  472   HG22  THR  62          HG22      THR  62  65.994   8.448   4.962
  473   HG23  THR  62          HG23      THR  62  66.282   9.329   6.462
  474    H    ASP  63           HN       ASP  63  66.620   6.043  10.059
  475    HA   ASP  63           HA       ASP  63  69.137   4.654  10.333
  476    HB2  ASP  63           HB2      ASP  63  66.423   3.923  11.479
  477    HB3  ASP  63           HB1      ASP  63  67.985   3.327  12.040
  478    H    ILE  64           HN       ILE  64  68.267   4.315   7.671
  479    HA   ILE  64           HA       ILE  64  68.568   1.537   7.305
  480    HB   ILE  64           HB       ILE  64  66.454   0.968   8.090
  481   HG12  ILE  64          HG12      ILE  64  65.652   1.751   5.287
  482   HG13  ILE  64          HG11      ILE  64  66.809   0.452   5.575
  483   HG21  ILE  64          HG21      ILE  64  65.366   2.895   8.710
  484   HG22  ILE  64          HG22      ILE  64  64.474   2.574   7.223
  485   HG23  ILE  64          HG23      ILE  64  65.797   3.740   7.224
  486   HD11  ILE  64          HD11      ILE  64  64.064   0.563   6.852
  487   HD12  ILE  64          HD12      ILE  64  65.199  -0.786   6.883
  488   HD13  ILE  64          HD13      ILE  64  64.417  -0.327   5.371
  489    H    THR  65           HN       THR  65  66.346   3.772   5.726
  490    HA   THR  65           HA       THR  65  66.752   3.287   3.090
  491    HB   THR  65           HB       THR  65  66.969   6.147   4.026
  492    HG1  THR  65           HG1      THR  65  65.362   5.334   5.275
  493   HG21  THR  65          HG21      THR  65  66.994   5.488   1.570
  494   HG22  THR  65          HG22      THR  65  65.723   6.617   2.037
  495   HG23  THR  65          HG23      THR  65  65.343   4.911   1.796
  496    H    VAL  66           HN       VAL  66  69.025   5.205   5.066
  497    HA   VAL  66           HA       VAL  66  71.051   4.837   2.885
  498    HB   VAL  66           HB       VAL  66  72.068   6.922   3.608
  499   HG11  VAL  66          HG11      VAL  66  70.299   8.475   3.013
  500   HG12  VAL  66          HG12      VAL  66  69.063   7.300   3.464
  501   HG13  VAL  66          HG13      VAL  66  70.091   7.005   2.061
  502   HG21  VAL  66          HG21      VAL  66  70.176   6.556   5.897
  503   HG22  VAL  66          HG22      VAL  66  70.560   8.203   5.398
  504   HG23  VAL  66          HG23      VAL  66  71.849   7.112   5.906
  505    H    ILE  67           HN       ILE  67  70.459   4.856   6.374
  506    HA   ILE  67           HA       ILE  67  72.945   3.224   6.718
  507    HB   ILE  67           HB       ILE  67  71.902   5.529   8.365
  508   HG12  ILE  67          HG12      ILE  67  74.698   4.721   7.508
  509   HG13  ILE  67          HG11      ILE  67  73.677   5.852   6.619
  510   HG21  ILE  67          HG21      ILE  67  73.571   3.178   9.275
  511   HG22  ILE  67          HG22      ILE  67  72.119   3.839  10.028
  512   HG23  ILE  67          HG23      ILE  67  73.633   4.741  10.089
  513   HD11  ILE  67          HD11      ILE  67  75.063   7.214   7.996
  514   HD12  ILE  67          HD12      ILE  67  74.823   6.170   9.397
  515   HD13  ILE  67          HD13      ILE  67  73.498   7.173   8.809
  516    H1U  RCY  68           H1U      RCY  68  70.449  -4.049   1.239
  517    H1S  RCY  68           H1S      RCY  68  71.787  -0.765   4.333
  518    HB1  RCY  68           HB1      RCY  68  68.988  -0.617   7.474
  519    HB2  RCY  68           HB2      RCY  68  70.545  -1.428   7.335
  520    HA   RCY  68           HA       RCY  68  69.810   0.934   8.911
  521    HN1  RCY  68           HN1      RCY  68  72.244   1.206   7.195
  522    HA   PRO  69           HA       PRO  69  71.772  -1.131  12.224
  523    HB2  PRO  69           HB2      PRO  69  70.582  -3.734  11.490
  524    HB3  PRO  69           HB1      PRO  69  70.376  -2.778  12.966
  525    HG2  PRO  69           HG2      PRO  69  68.614  -2.972  10.749
  526    HG3  PRO  69           HG1      PRO  69  68.434  -1.988  12.206
  527    HD2  PRO  69           HD2      PRO  69  68.829  -0.999   9.611
  528    HD3  PRO  69           HD1      PRO  69  69.054  -0.077  11.114
  529    H    TRP  70           HN       TRP  70  71.805  -2.857   9.122
  530    HA   TRP  70           HA       TRP  70  73.982  -4.602   9.694
  531    HD1  TRP  70           HD1      TRP  70  75.677  -5.393   8.929
  532    HE1  TRP  70           HE1      TRP  70  76.853  -7.196   7.513
  533    HE3  TRP  70           HE3      TRP  70  72.720  -5.313   4.767
  534    HZ2  TRP  70           HZ2      TRP  70  76.577  -8.443   4.949
  535    HZ3  TRP  70           HZ3      TRP  70  73.197  -6.814   2.857
  536    HH2  TRP  70           HH2      TRP  70  75.117  -8.378   2.941
  537    HB2  TRP  70           HB2      TRP  70  72.395  -4.608   7.665
  538    HB3  TRP  70           HB1      TRP  70  73.448  -3.374   6.987
  539    H    GLU  71           HN       GLU  71  73.979  -1.318   9.812
  540    HA   GLU  71           HA       GLU  71  76.627  -0.884   8.578
  541    HB2  GLU  71           HB2      GLU  71  74.514   0.853   9.822
  542    HB3  GLU  71           HB1      GLU  71  76.164   1.468   9.723
  543    HG2  GLU  71           HG2      GLU  71  75.221   0.204   7.236
  544    HG3  GLU  71           HG1      GLU  71  74.304   1.639   7.697
  545    H    ALA  72           HN       ALA  72  75.164  -0.654  11.841
  546    HA   ALA  72           HA       ALA  72  77.746  -0.270  13.120
  547    HB1  ALA  72           HB1      ALA  72  75.157  -1.213  14.388
  548    HB2  ALA  72           HB2      ALA  72  75.548   0.482  14.101
  549    HB3  ALA  72           HB3      ALA  72  76.532  -0.474  15.208
  550    H1U  RCY  73           H1U      RCY  73  79.624  -0.851   5.218
  551    H1S  RCY  73           H1S      RCY  73  77.933  -2.297   9.462
  552    HB1  RCY  73           HB1      RCY  73  79.661  -5.679  11.339
  553    HB2  RCY  73           HB2      RCY  73  80.135  -3.983  11.243
  554    HA   RCY  73           HA       RCY  73  77.509  -4.990  12.382
  555    HN1  RCY  73           HN1      RCY  73  78.107  -2.410  11.494
  556    H    ASN  74           HN       ASN  74  79.179  -2.592  14.087
  557    HA   ASN  74           HA       ASN  74  80.202  -2.638  16.195
  558    HB2  ASN  74           HB2      ASN  74  78.341  -4.471  16.491
  559    HB3  ASN  74           HB1      ASN  74  79.692  -5.600  16.390
  560   HD21  ASN  74          HD21      ASN  74  78.400  -5.545  18.821
  561   HD22  ASN  74          HD22      ASN  74  79.330  -4.727  19.982
  562    H    HIS  75           HN       HIS  75  80.953  -5.289  13.982
  563    HA   HIS  75           HA       HIS  75  83.777  -5.252  14.964
  564    HD1  HIS  75           HD1      HIS  75  80.315  -7.740  14.460
  565    HD2  HIS  75           HD2      HIS  75  82.742  -7.378  11.086
  566    HE1  HIS  75           HE1      HIS  75  78.859  -8.307  12.467
  567    HE2  HIS  75           HE2      HIS  75  80.323  -8.090  10.407
  568    HB2  HIS  75           HB2      HIS  75  83.954  -7.425  13.706
  569    HB3  HIS  75           HB1      HIS  75  82.798  -7.471  15.038
  570    H1U  RCY  76           H1U      RCY  76  81.445  -2.713   5.144
  571    H1S  RCY  76           H1S      RCY  76  82.336  -0.159   8.735
  572    HB1  RCY  76           HB1      RCY  76  84.768  -1.079  11.048
  573    HB2  RCY  76           HB2      RCY  76  84.000  -1.239  12.627
  574    HA   RCY  76           HA       RCY  76  83.209  -3.280  10.629
  575    HN1  RCY  76           HN1      RCY  76  83.098  -3.085  13.416
  576    H    GLU  77           HN       GLU  77  84.576  -5.092  10.102
  577    HA   GLU  77           HA       GLU  77  87.372  -5.157  10.857
  578    HB2  GLU  77           HB2      GLU  77  85.703  -6.630   8.818
  579    HB3  GLU  77           HB1      GLU  77  87.451  -6.853   8.898
  580    HG2  GLU  77           HG2      GLU  77  85.663  -7.147  11.321
  581    HG3  GLU  77           HG1      GLU  77  86.062  -8.503  10.265
  582    H    LEU  78           HN       LEU  78  89.168  -4.941   9.277
  583    HA   LEU  78           HA       LEU  78  89.054  -2.462   7.860
  584    HG   LEU  78           HG       LEU  78  90.879  -2.324   6.102
  585    HB2  LEU  78           HB2      LEU  78  91.125  -3.671   8.770
  586    HB3  LEU  78           HB1      LEU  78  91.043  -4.675   7.322
  587   HD11  LEU  78          HD11      LEU  78  90.850  -1.183   8.400
  588   HD12  LEU  78          HD12      LEU  78  91.997  -0.543   7.223
  589   HD13  LEU  78          HD13      LEU  78  92.558  -1.607   8.512
  590   HD21  LEU  78          HD21      LEU  78  93.435  -2.315   6.052
  591   HD22  LEU  78          HD22      LEU  78  92.667  -3.843   5.620
  592   HD23  LEU  78          HD23      LEU  78  93.368  -3.632   7.224
  593    H    HIS  79           HN       HIS  79  90.606  -4.062   5.580
  594    HA   HIS  79           HA       HIS  79  88.259  -5.010   4.038
  595    HD1  HIS  79           HD1      HIS  79  87.039  -2.563   4.833
  596    HD2  HIS  79           HD2      HIS  79  90.621  -0.729   3.737
  597    HE1  HIS  79           HE1      HIS  79  87.134  -0.368   6.094
  598    HE2  HIS  79           HE2      HIS  79  89.310   0.758   5.436
  599    HB2  HIS  79           HB2      HIS  79  90.064  -3.157   2.562
  600    HB3  HIS  79           HB1      HIS  79  88.321  -3.380   2.418
  601    H    GLU  80           HN       GLU  80  90.497  -6.416   5.155
  602    HA   GLU  80           HA       GLU  80  92.324  -6.925   2.886
  603    HB2  GLU  80           HB2      GLU  80  92.792  -6.930   5.546
  604    HB3  GLU  80           HB1      GLU  80  92.386  -8.633   5.338
  605    HG2  GLU  80           HG2      GLU  80  94.447  -7.151   3.678
  606    HG3  GLU  80           HG1      GLU  80  94.831  -8.177   5.062
  607    H    LEU  81           HN       LEU  81  89.336  -8.043   4.034
  608    HA   LEU  81           HA       LEU  81  89.688 -10.742   2.824
  609    HG   LEU  81           HG       LEU  81  89.042  -9.258   5.711
  610    HB2  LEU  81           HB2      LEU  81  87.182  -9.745   4.176
  611    HB3  LEU  81           HB1      LEU  81  87.753 -11.404   3.998
  612   HD11  LEU  81          HD11      LEU  81  86.948 -10.149   6.656
  613   HD12  LEU  81          HD12      LEU  81  88.338 -10.718   7.581
  614   HD13  LEU  81          HD13      LEU  81  87.542 -11.795   6.434
  615   HD21  LEU  81          HD21      LEU  81  90.770 -10.697   4.870
  616   HD22  LEU  81          HD22      LEU  81  89.776 -12.134   5.110
  617   HD23  LEU  81          HD23      LEU  81  90.410 -11.258   6.503
  618    H    ALA  82           HN       ALA  82  89.281  -7.957   1.461
  619    HA   ALA  82           HA       ALA  82  86.735  -7.981   0.182
  620    HB1  ALA  82           HB1      ALA  82  88.256  -6.037   0.098
  621    HB2  ALA  82           HB2      ALA  82  87.807  -6.549  -1.528
  622    HB3  ALA  82           HB3      ALA  82  89.394  -6.966  -0.880
  623    H    GLN  83           HN       GLN  83  87.682  -7.981  -2.620
  624    HA   GLN  83           HA       GLN  83  87.711  -9.537  -4.382
  625    HB2  GLN  83           HB2      GLN  83  89.479 -11.240  -2.625
  626    HB3  GLN  83           HB1      GLN  83  89.544 -11.030  -4.374
  627    HG2  GLN  83           HG2      GLN  83  91.131  -9.459  -4.029
  628    HG3  GLN  83           HG1      GLN  83  89.864  -8.441  -3.343
  629   HE21  GLN  83          HE21      GLN  83  92.620 -10.478  -2.561
  630   HE22  GLN  83          HE22      GLN  83  92.616 -10.168  -0.892
  631    H    TYR  84           HN       TYR  84  85.811  -9.945  -1.984
  632    HA   TYR  84           HA       TYR  84  84.862 -12.581  -2.891
  633    HD1  TYR  84           HD2      TYR  84  82.999 -13.822  -1.243
  634    HD2  TYR  84           HD1      TYR  84  87.145 -14.873  -0.842
  635    HE1  TYR  84           HE2      TYR  84  82.423 -16.213  -1.558
  636    HE2  TYR  84           HE1      TYR  84  86.568 -17.265  -1.156
  637    HH   TYR  84           HH       TYR  84  83.410 -18.434  -0.962
  638    HB2  TYR  84           HB2      TYR  84  86.532 -12.632  -0.751
  639    HB3  TYR  84           HB1      TYR  84  84.995 -12.371   0.071
  640    H    GLY  85           HN       GLY  85  84.306 -10.323  -0.141
  641    HA2  GLY  85           HA2      GLY  85  81.513  -9.980  -1.141
  642    HA3  GLY  85           HA1      GLY  85  81.787 -10.405   0.548
  643    H    ILE  86           HN       ILE  86  83.737  -8.837   1.442
  644    HA   ILE  86           HA       ILE  86  82.574  -6.294   1.790
  645    HB   ILE  86           HB       ILE  86  85.521  -7.010   1.951
  646   HG12  ILE  86          HG12      ILE  86  83.367  -6.956   4.090
  647   HG13  ILE  86          HG11      ILE  86  84.030  -8.420   3.363
  648   HG21  ILE  86          HG21      ILE  86  85.464  -5.086   3.642
  649   HG22  ILE  86          HG22      ILE  86  83.897  -4.663   2.952
  650   HG23  ILE  86          HG23      ILE  86  85.343  -4.631   1.942
  651   HD11  ILE  86          HD11      ILE  86  85.399  -8.269   5.218
  652   HD12  ILE  86          HD12      ILE  86  85.302  -6.509   5.276
  653   HD13  ILE  86          HD13      ILE  86  86.338  -7.297   4.086
  654    H1U  RCY  87           H1U      RCY  87  76.779  -0.891  -2.936
  655    H1S  RCY  87           H1S      RCY  87  79.394  -4.222  -3.690
  656    HB1  RCY  87           HB1      RCY  87  82.031  -4.047  -3.570
  657    HB2  RCY  87           HB2      RCY  87  81.518  -3.306  -2.055
  658    HA   RCY  87           HA       RCY  87  83.740  -5.267  -2.553
  659    HN1  RCY  87           HN1      RCY  87  81.952  -5.626  -0.381
  Start of MODEL   69
    1    HA   MET   1           HA       MET   1  64.048 -21.529  15.739
    2    HB2  MET   1           HB2      MET   1  62.528 -18.932  16.088
    3    HB3  MET   1           HB1      MET   1  62.790 -19.689  14.517
    4    HG2  MET   1           HG2      MET   1  60.631 -20.411  15.346
    5    HG3  MET   1           HG1      MET   1  61.736 -21.784  15.426
    6    HE1  MET   1           HE1      MET   1  61.273 -23.295  17.163
    7    HE2  MET   1           HE2      MET   1  61.694 -22.944  18.837
    8    HE3  MET   1           HE3      MET   1  62.878 -22.668  17.562
    9    H    ASN   2           HN       ASN   2  64.052 -18.168  15.102
   10    HA   ASN   2           HA       ASN   2  66.867 -17.639  15.403
   11    HB2  ASN   2           HB2      ASN   2  67.075 -19.302  13.610
   12    HB3  ASN   2           HB1      ASN   2  65.907 -18.414  12.630
   13   HD21  ASN   2          HD21      ASN   2  69.212 -18.302  13.939
   14   HD22  ASN   2          HD22      ASN   2  69.752 -17.049  12.928
   15    H    LEU   3           HN       LEU   3  63.860 -16.616  15.216
   16    HA   LEU   3           HA       LEU   3  62.814 -14.570  14.725
   17    HG   LEU   3           HG       LEU   3  64.820 -12.970  17.322
   18    HB2  LEU   3           HB2      LEU   3  65.691 -13.769  15.198
   19    HB3  LEU   3           HB1      LEU   3  64.436 -12.575  14.870
   20   HD11  LEU   3          HD11      LEU   3  62.519 -12.453  16.055
   21   HD12  LEU   3          HD12      LEU   3  62.582 -12.686  17.802
   22   HD13  LEU   3          HD13      LEU   3  62.081 -14.012  16.753
   23   HD21  LEU   3          HD21      LEU   3  65.235 -15.488  16.885
   24   HD22  LEU   3          HD22      LEU   3  63.477 -15.638  16.877
   25   HD23  LEU   3          HD23      LEU   3  64.307 -15.056  18.321
   26    H    GLU   4           HN       GLU   4  62.110 -14.777  12.599
   27    HA   GLU   4           HA       GLU   4  63.968 -14.545  10.362
   28    HB2  GLU   4           HB2      GLU   4  61.585 -14.314   9.152
   29    HB3  GLU   4           HB1      GLU   4  62.185 -15.871   9.723
   30    HG2  GLU   4           HG2      GLU   4  60.886 -15.744  11.726
   31    HG3  GLU   4           HG1      GLU   4  60.498 -14.046  11.448
   32    HA   PRO   5           HA       PRO   5  64.270 -10.227   9.569
   33    HB2  PRO   5           HB2      PRO   5  62.722 -10.782   7.058
   34    HB3  PRO   5           HB1      PRO   5  64.211  -9.841   7.275
   35    HG2  PRO   5           HG2      PRO   5  64.229 -12.348   6.325
   36    HG3  PRO   5           HG1      PRO   5  65.540 -11.701   7.322
   37    HD2  PRO   5           HD2      PRO   5  63.527 -13.745   8.008
   38    HD3  PRO   5           HD1      PRO   5  65.080 -13.389   8.793
   39    HA   PRO   6           HA       PRO   6  60.153  -8.930  10.907
   40    HB2  PRO   6           HB2      PRO   6  60.771  -6.395  11.644
   41    HB3  PRO   6           HB1      PRO   6  61.270  -7.803  12.602
   42    HG2  PRO   6           HG2      PRO   6  62.863  -6.164  10.697
   43    HG3  PRO   6           HG1      PRO   6  63.335  -6.865  12.254
   44    HD2  PRO   6           HD2      PRO   6  63.972  -7.980   9.802
   45    HD3  PRO   6           HD1      PRO   6  63.870  -8.901  11.319
   46    H    LYS   7           HN       LYS   7  58.445  -7.971   9.812
   47    HA   LYS   7           HA       LYS   7  59.004  -6.755   7.207
   48    HB2  LYS   7           HB2      LYS   7  57.079  -8.330   7.649
   49    HB3  LYS   7           HB1      LYS   7  56.330  -7.052   8.604
   50    HG2  LYS   7           HG2      LYS   7  56.597  -5.557   6.541
   51    HG3  LYS   7           HG1      LYS   7  56.960  -7.034   5.648
   52    HD2  LYS   7           HD2      LYS   7  54.668  -6.956   5.347
   53    HD3  LYS   7           HD1      LYS   7  54.738  -7.881   6.847
   54    HE2  LYS   7           HE2      LYS   7  53.143  -6.178   7.275
   55    HE3  LYS   7           HE1      LYS   7  54.621  -5.605   8.050
   56    HZ1  LYS   7           HZ1      LYS   7  54.145  -3.764   6.865
   57    HZ2  LYS   7           HZ2      LYS   7  53.249  -4.602   5.688
   58    HZ3  LYS   7           HZ3      LYS   7  54.947  -4.600   5.626
   59    H    ALA   8           HN       ALA   8  56.288  -5.366   8.740
   60    HA   ALA   8           HA       ALA   8  55.857  -3.202   9.539
   61    HB1  ALA   8           HB1      ALA   8  57.428  -2.213  10.932
   62    HB2  ALA   8           HB2      ALA   8  58.783  -2.649   9.891
   63    HB3  ALA   8           HB3      ALA   8  58.032  -3.869  10.918
   64    H    GLU   9           HN       GLU   9  55.650  -1.205   8.511
   65    HA   GLU   9           HA       GLU   9  56.777  -1.034   5.814
   66    HB2  GLU   9           HB2      GLU   9  55.414   1.039   5.653
   67    HB3  GLU   9           HB1      GLU   9  54.460  -0.341   6.197
   68    HG2  GLU   9           HG2      GLU   9  55.134   0.499   8.598
   69    HG3  GLU   9           HG1      GLU   9  55.421   2.030   7.772
   70    H1U  RCY  10           H1U      RCY  10  56.435  -1.036   4.692
   71    H1S  RCY  10           H1S      RCY  10  56.726   2.938   5.413
   72    HB1  RCY  10           HB1      RCY  10  58.900   4.267   8.895
   73    HB2  RCY  10           HB2      RCY  10  57.489   3.492   9.617
   74    HA   RCY  10           HA       RCY  10  59.400   2.260   7.609
   75    HN1  RCY  10           HN1      RCY  10  56.839   1.135   8.671
   76    H    ARG  11           HN       ARG  11  58.046   2.346  10.898
   77    HA   ARG  11           HA       ARG  11  59.910   0.380  11.933
   78    HE   ARG  11           HE       ARG  11  63.692   0.854  14.860
   79    HB2  ARG  11           HB2      ARG  11  61.289   2.542  11.442
   80    HB3  ARG  11           HB1      ARG  11  60.469   3.194  12.861
   81    HG2  ARG  11           HG2      ARG  11  61.272   1.282  14.203
   82    HG3  ARG  11           HG1      ARG  11  62.104   0.640  12.786
   83    HD2  ARG  11           HD2      ARG  11  63.571   2.547  12.687
   84    HD3  ARG  11           HD1      ARG  11  62.633   3.401  13.912
   85   HH11  ARG  11          HH21      ARG  11  64.263   4.209  14.312
   86   HH12  ARG  11          HH22      ARG  11  65.484   4.338  15.533
   87   HH21  ARG  11          HH11      ARG  11  65.283   1.002  16.459
   88   HH22  ARG  11          HH12      ARG  11  66.061   2.522  16.749
   89    H    SER  12           HN       SER  12  57.056   1.044  12.076
   90    HA   SER  12           HA       SER  12  55.355   1.074  13.690
   91    HG   SER  12           HG       SER  12  55.753  -0.769  16.530
   92    HB2  SER  12           HB2      SER  12  57.028  -0.669  14.660
   93    HB3  SER  12           HB1      SER  12  57.470   0.609  15.789
   94    H    ALA  13           HN       ALA  13  57.795   3.310  13.552
   95    HA   ALA  13           HA       ALA  13  56.223   5.283  15.006
   96    HB1  ALA  13           HB1      ALA  13  58.056   5.869  16.608
   97    HB2  ALA  13           HB2      ALA  13  58.916   4.415  16.101
   98    HB3  ALA  13           HB3      ALA  13  57.357   4.280  16.915
   99    H    THR  14           HN       THR  14  57.294   7.471  14.847
  100    HA   THR  14           HA       THR  14  58.743   7.650  12.266
  101    HB   THR  14           HB       THR  14  56.767   9.094  12.611
  102    HG1  THR  14           HG1      THR  14  59.318  10.028  12.179
  103   HG21  THR  14          HG21      THR  14  56.702  10.765  14.325
  104   HG22  THR  14          HG22      THR  14  58.380  10.462  14.773
  105   HG23  THR  14          HG23      THR  14  57.143   9.255  15.121
  106    H    ARG  15           HN       ARG  15  60.062   6.747  14.801
  107    HA   ARG  15           HA       ARG  15  61.975   8.993  15.254
  108    HE   ARG  15           HE       ARG  15  62.925   6.340  19.432
  109    HB2  ARG  15           HB2      ARG  15  62.782   7.545  17.150
  110    HB3  ARG  15           HB1      ARG  15  61.103   8.061  17.305
  111    HG2  ARG  15           HG2      ARG  15  60.331   5.936  17.176
  112    HG3  ARG  15           HG1      ARG  15  61.376   5.560  15.805
  113    HD2  ARG  15           HD2      ARG  15  61.977   4.168  17.739
  114    HD3  ARG  15           HD1      ARG  15  63.290   5.281  17.353
  115   HH11  ARG  15          HH21      ARG  15  60.261   4.367  18.484
  116   HH12  ARG  15          HH22      ARG  15  59.424   4.544  19.990
  117   HH21  ARG  15          HH11      ARG  15  61.847   6.582  21.403
  118   HH22  ARG  15          HH12      ARG  15  60.321   5.798  21.643
  119    H    VAL  16           HN       VAL  16  62.854   8.519  13.032
  120    HA   VAL  16           HA       VAL  16  64.779   6.221  13.128
  121    HB   VAL  16           HB       VAL  16  63.635   7.453  10.612
  122   HG11  VAL  16          HG11      VAL  16  64.540   5.502   9.539
  123   HG12  VAL  16          HG12      VAL  16  64.896   4.742  11.090
  124   HG13  VAL  16          HG13      VAL  16  65.816   6.153  10.568
  125   HG21  VAL  16          HG21      VAL  16  61.735   6.523  11.717
  126   HG22  VAL  16          HG22      VAL  16  62.657   5.132  12.288
  127   HG23  VAL  16          HG23      VAL  16  62.263   5.286  10.576
  128    H    MET  17           HN       MET  17  64.211   9.577  12.149
  129    HA   MET  17           HA       MET  17  67.021   9.922  11.342
  130    HB2  MET  17           HB2      MET  17  64.941  12.087  11.728
  131    HB3  MET  17           HB1      MET  17  66.394  12.152  10.731
  132    HG2  MET  17           HG2      MET  17  65.364  10.138   9.462
  133    HG3  MET  17           HG1      MET  17  63.853  10.602  10.245
  134    HE1  MET  17           HE1      MET  17  64.010  13.826  10.397
  135    HE2  MET  17           HE2      MET  17  62.715  12.662  10.129
  136    HE3  MET  17           HE3      MET  17  62.948  13.988   8.993
  137    H    GLY  18           HN       GLY  18  65.317   9.913  14.248
  138    HA2  GLY  18           HA2      GLY  18  65.813  10.728  16.398
  139    HA3  GLY  18           HA1      GLY  18  67.493  10.534  15.895
  140    H    GLY  19           HN       GLY  19  67.503  12.551  17.435
  141    HA2  GLY  19           HA2      GLY  19  66.840  15.022  15.897
  142    HA3  GLY  19           HA1      GLY  19  67.107  14.961  17.640
  143    HA   PRO  20           HA       PRO  20  71.285  16.329  17.398
  144    HB2  PRO  20           HB2      PRO  20  71.988  13.706  18.678
  145    HB3  PRO  20           HB1      PRO  20  72.505  15.346  19.116
  146    HG2  PRO  20           HG2      PRO  20  70.596  14.053  20.472
  147    HG3  PRO  20           HG1      PRO  20  70.558  15.807  20.233
  148    HD2  PRO  20           HD2      PRO  20  68.832  13.724  19.029
  149    HD3  PRO  20           HD1      PRO  20  68.530  15.464  19.223
  150    H1U  RCY  21           H1U      RCY  21  72.137   8.085   8.069
  151    H1S  RCY  21           H1S      RCY  21  70.705   8.873  12.619
  152    HB1  RCY  21           HB1      RCY  21  70.261  11.706  13.669
  153    HB2  RCY  21           HB2      RCY  21  70.667  11.115  15.280
  154    HA   RCY  21           HA       RCY  21  72.874  12.538  14.877
  155    HN1  RCY  21           HN1      RCY  21  70.383  13.193  16.153
  156    H    THR  22           HN       THR  22  73.796  13.941  13.453
  157    HA   THR  22           HA       THR  22  72.154  14.841  11.148
  158    HB   THR  22           HB       THR  22  72.099  16.739  12.672
  159    HG1  THR  22           HG1      THR  22  73.175  18.237  11.342
  160   HG21  THR  22          HG21      THR  22  75.120  16.485  12.709
  161   HG22  THR  22          HG22      THR  22  74.041  16.095  14.049
  162   HG23  THR  22          HG23      THR  22  74.187  17.762  13.491
  163    HA   PRO  23           HA       PRO  23  75.483  13.436   8.595
  164    HB2  PRO  23           HB2      PRO  23  75.422  16.246   7.533
  165    HB3  PRO  23           HB1      PRO  23  75.478  14.710   6.645
  166    HG2  PRO  23           HG2      PRO  23  73.208  16.110   6.953
  167    HG3  PRO  23           HG1      PRO  23  73.233  14.342   6.872
  168    HD2  PRO  23           HD2      PRO  23  72.645  16.078   9.178
  169    HD3  PRO  23           HD1      PRO  23  72.298  14.350   8.956
  170    H    ARG  24           HN       ARG  24  77.767  13.547   8.574
  171    HA   ARG  24           HA       ARG  24  78.974  15.178  10.682
  172    HE   ARG  24           HE       ARG  24  82.570  12.383  11.245
  173    HB2  ARG  24           HB2      ARG  24  79.862  12.977   8.863
  174    HB3  ARG  24           HB1      ARG  24  81.111  14.035   9.516
  175    HG2  ARG  24           HG2      ARG  24  79.027  12.935  11.373
  176    HG3  ARG  24           HG1      ARG  24  80.356  11.893  10.866
  177    HD2  ARG  24           HD2      ARG  24  80.867  14.671  11.925
  178    HD3  ARG  24           HD1      ARG  24  80.695  13.294  13.013
  179   HH11  ARG  24          HH21      ARG  24  82.154  15.320  13.002
  180   HH12  ARG  24          HH22      ARG  24  83.852  15.634  13.140
  181   HH21  ARG  24          HH11      ARG  24  84.789  12.776  11.414
  182   HH22  ARG  24          HH12      ARG  24  85.344  14.193  12.241
  183    H    LYS  25           HN       LYS  25  78.539  17.312   9.742
  184    HA   LYS  25           HA       LYS  25  79.283  18.240   7.217
  185    HB2  LYS  25           HB2      LYS  25  79.805  20.446   8.443
  186    HB3  LYS  25           HB1      LYS  25  78.181  19.789   8.635
  187    HG2  LYS  25           HG2      LYS  25  80.090  18.749  10.611
  188    HG3  LYS  25           HG1      LYS  25  79.859  20.495  10.715
  189    HD2  LYS  25           HD2      LYS  25  77.384  20.114  10.737
  190    HD3  LYS  25           HD1      LYS  25  77.690  18.378  10.790
  191    HE2  LYS  25           HE2      LYS  25  78.582  20.417  12.849
  192    HE3  LYS  25           HE1      LYS  25  77.318  19.205  13.059
  193    HZ1  LYS  25           HZ1      LYS  25  78.844  17.732  13.636
  194    HZ2  LYS  25           HZ2      LYS  25  80.051  18.920  13.503
  195    HZ3  LYS  25           HZ3      LYS  25  79.664  17.945  12.167
  196    H    GLY  26           HN       GLY  26  81.192  17.425   6.363
  197    HA2  GLY  26           HA2      GLY  26  83.689  18.534   7.478
  198    HA3  GLY  26           HA1      GLY  26  83.601  16.774   7.388
  199    HA   PRO  27           HA       PRO  27  85.411  18.761   3.421
  200    HB2  PRO  27           HB2      PRO  27  86.959  16.319   3.284
  201    HB3  PRO  27           HB1      PRO  27  87.541  17.974   3.527
  202    HG2  PRO  27           HG2      PRO  27  87.089  15.855   5.484
  203    HG3  PRO  27           HG1      PRO  27  88.072  17.320   5.609
  204    HD2  PRO  27           HD2      PRO  27  85.734  16.989   6.984
  205    HD3  PRO  27           HD1      PRO  27  86.321  18.584   6.458
  206    HA   PRO  28           HA       PRO  28  83.101  16.698   0.290
  207    HB2  PRO  28           HB2      PRO  28  85.643  15.344  -0.574
  208    HB3  PRO  28           HB1      PRO  28  84.404  16.143  -1.564
  209    HG2  PRO  28           HG2      PRO  28  86.718  17.339  -0.924
  210    HG3  PRO  28           HG1      PRO  28  85.204  18.237  -1.115
  211    HD2  PRO  28           HD2      PRO  28  86.737  17.704   1.342
  212    HD3  PRO  28           HD1      PRO  28  85.454  18.900   1.056
  213    H    LYS  29           HN       LYS  29  81.788  14.932   0.564
  214    HA   LYS  29           HA       LYS  29  82.891  12.274   1.052
  215    HB2  LYS  29           HB2      LYS  29  81.600  11.993   3.217
  216    HB3  LYS  29           HB1      LYS  29  83.019  13.033   3.330
  217    HG2  LYS  29           HG2      LYS  29  81.731  14.998   3.411
  218    HG3  LYS  29           HG1      LYS  29  80.315  14.208   2.716
  219    HD2  LYS  29           HD2      LYS  29  80.169  12.801   4.800
  220    HD3  LYS  29           HD1      LYS  29  81.450  13.796   5.494
  221    HE2  LYS  29           HE2      LYS  29  79.281  14.656   6.216
  222    HE3  LYS  29           HE1      LYS  29  80.035  15.816   5.122
  223    HZ1  LYS  29           HZ1      LYS  29  77.632  15.302   4.686
  224    HZ2  LYS  29           HZ2      LYS  29  78.123  13.750   4.200
  225    HZ3  LYS  29           HZ3      LYS  29  78.669  15.119   3.355
  226    H1U  RCY  30           H1U      RCY  30  80.439   9.492  -1.983
  227    H1S  RCY  30           H1S      RCY  30  80.246  11.607   1.435
  228    HB1  RCY  30           HB1      RCY  30  76.823  12.253   0.759
  229    HB2  RCY  30           HB2      RCY  30  77.096  13.912   1.287
  230    HA   RCY  30           HA       RCY  30  78.666  12.250  -0.642
  231    HN1  RCY  30           HN1      RCY  30  80.148  14.434   0.702
  232    H    LYS  31           HN       LYS  31  79.003  15.646   0.184
  233    HA   LYS  31           HA       LYS  31  77.941  17.551  -0.786
  234    HB2  LYS  31           HB2      LYS  31  78.969  17.978  -2.938
  235    HB3  LYS  31           HB1      LYS  31  80.136  17.163  -1.900
  236    HG2  LYS  31           HG2      LYS  31  79.342  14.974  -2.964
  237    HG3  LYS  31           HG1      LYS  31  78.515  15.972  -4.161
  238    HD2  LYS  31           HD2      LYS  31  81.482  16.103  -3.541
  239    HD3  LYS  31           HD1      LYS  31  80.774  15.281  -4.932
  240    HE2  LYS  31           HE2      LYS  31  81.355  17.385  -5.807
  241    HE3  LYS  31           HE1      LYS  31  79.644  17.574  -5.423
  242    HZ1  LYS  31           HZ1      LYS  31  81.648  19.174  -4.540
  243    HZ2  LYS  31           HZ2      LYS  31  81.370  18.157  -3.208
  244    HZ3  LYS  31           HZ3      LYS  31  80.097  19.074  -3.861
  245    H    GLN  32           HN       GLN  32  76.064  15.326  -0.744
  246    HA   GLN  32           HA       GLN  32  74.212  14.446  -1.972
  247    HB2  GLN  32           HB2      GLN  32  73.726  16.766  -0.851
  248    HB3  GLN  32           HB1      GLN  32  73.663  17.353  -2.512
  249    HG2  GLN  32           HG2      GLN  32  71.424  16.745  -2.005
  250    HG3  GLN  32           HG1      GLN  32  72.048  15.399  -2.961
  251   HE21  GLN  32          HE21      GLN  32  71.584  16.422   0.460
  252   HE22  GLN  32          HE22      GLN  32  71.396  14.846   1.062
  253    H    ARG  33           HN       ARG  33  74.918  13.441  -3.894
  254    HA   ARG  33           HA       ARG  33  74.110  14.579  -6.358
  255    HE   ARG  33           HE       ARG  33  76.211  17.232  -9.567
  256    HB2  ARG  33           HB2      ARG  33  76.664  15.541  -5.472
  257    HB3  ARG  33           HB1      ARG  33  76.932  14.500  -6.866
  258    HG2  ARG  33           HG2      ARG  33  75.403  15.779  -8.216
  259    HG3  ARG  33           HG1      ARG  33  74.850  16.699  -6.817
  260    HD2  ARG  33           HD2      ARG  33  76.593  18.132  -6.945
  261    HD3  ARG  33           HD1      ARG  33  77.753  16.821  -7.161
  262   HH11  ARG  33          HH21      ARG  33  78.767  18.463  -7.608
  263   HH12  ARG  33          HH22      ARG  33  79.596  19.217  -8.929
  264   HH21  ARG  33          HH11      ARG  33  77.278  18.209 -11.304
  265   HH22  ARG  33          HH12      ARG  33  78.753  19.073 -11.022
  266    H    GLN  34           HN       GLN  34  73.793  12.850  -7.679
  267    HA   GLN  34           HA       GLN  34  74.751  10.227  -6.921
  268    HB2  GLN  34           HB2      GLN  34  72.589  10.803  -8.194
  269    HB3  GLN  34           HB1      GLN  34  73.610  10.966  -9.622
  270    HG2  GLN  34           HG2      GLN  34  74.357   8.676  -9.437
  271    HG3  GLN  34           HG1      GLN  34  73.560   8.492  -7.873
  272   HE21  GLN  34          HE21      GLN  34  73.161   7.603 -11.013
  273   HE22  GLN  34          HE22      GLN  34  71.467   7.573 -11.104
  274    H    THR  35           HN       THR  35  76.781   9.504  -7.313
  275    HA   THR  35           HA       THR  35  78.739  10.863  -8.812
  276    HB   THR  35           HB       THR  35  80.044   8.796  -8.699
  277    HG1  THR  35           HG1      THR  35  78.910   7.063  -8.994
  278   HG21  THR  35          HG21      THR  35  79.554  10.200  -6.622
  279   HG22  THR  35          HG22      THR  35  80.072   8.541  -6.327
  280   HG23  THR  35          HG23      THR  35  78.367   8.970  -6.190
  281    H    ARG  36           HN       ARG  36  76.535   8.259  -9.850
  282    HA   ARG  36           HA       ARG  36  76.085   7.431 -12.001
  283    HE   ARG  36           HE       ARG  36  72.043   9.857 -12.646
  284    HB2  ARG  36           HB2      ARG  36  76.560  10.377 -12.390
  285    HB3  ARG  36           HB1      ARG  36  76.315   9.348 -13.800
  286    HG2  ARG  36           HG2      ARG  36  74.220   8.472 -12.630
  287    HG3  ARG  36           HG1      ARG  36  74.420   9.800 -11.486
  288    HD2  ARG  36           HD2      ARG  36  74.170  11.444 -13.206
  289    HD3  ARG  36           HD1      ARG  36  74.316  10.231 -14.479
  290   HH11  ARG  36          HH21      ARG  36  73.308  11.126 -15.592
  291   HH12  ARG  36          HH22      ARG  36  71.764  11.211 -16.374
  292   HH21  ARG  36          HH11      ARG  36  70.020   9.960 -13.650
  293   HH22  ARG  36          HH12      ARG  36  69.903  10.551 -15.274
  294    H    GLN  37           HN       GLN  37  79.057   7.934 -10.947
  295    HA   GLN  37           HA       GLN  37  80.343   7.254 -13.566
  296    HB2  GLN  37           HB2      GLN  37  81.434   8.752 -11.169
  297    HB3  GLN  37           HB1      GLN  37  82.462   8.121 -12.457
  298    HG2  GLN  37           HG2      GLN  37  81.441   9.514 -14.096
  299    HG3  GLN  37           HG1      GLN  37  80.100   9.919 -13.023
  300   HE21  GLN  37          HE21      GLN  37  81.154  12.176 -13.861
  301   HE22  GLN  37          HE22      GLN  37  82.270  12.858 -12.779
  302    H1U  RCY  38           H1U      RCY  38  83.159   1.365  -3.849
  303    H1S  RCY  38           H1S      RCY  38  82.826   3.413  -7.533
  304    HB1  RCY  38           HB1      RCY  38  81.887   3.411  -9.160
  305    HB2  RCY  38           HB2      RCY  38  80.679   4.592  -9.665
  306    HA   RCY  38           HA       RCY  38  83.601   4.892 -10.381
  307    HN1  RCY  38           HN1      RCY  38  82.630   6.844 -11.266
  308    H    LYS  39           HN       LYS  39  81.916   4.858 -13.150
  309    HA   LYS  39           HA       LYS  39  81.650   1.929 -13.414
  310    HB2  LYS  39           HB2      LYS  39  80.840   2.508 -15.726
  311    HB3  LYS  39           HB1      LYS  39  79.889   3.224 -14.426
  312    HG2  LYS  39           HG2      LYS  39  80.621   5.362 -14.878
  313    HG3  LYS  39           HG1      LYS  39  82.197   4.814 -15.451
  314    HD2  LYS  39           HD2      LYS  39  81.134   3.951 -17.516
  315    HD3  LYS  39           HD1      LYS  39  79.573   4.545 -16.949
  316    HE2  LYS  39           HE2      LYS  39  80.467   6.847 -16.896
  317    HE3  LYS  39           HE1      LYS  39  82.024   6.253 -17.473
  318    HZ1  LYS  39           HZ1      LYS  39  80.443   7.169 -19.198
  319    HZ2  LYS  39           HZ2      LYS  39  79.511   5.770 -18.955
  320    HZ3  LYS  39           HZ3      LYS  39  81.108   5.643 -19.520
  321    H    SER  40           HN       SER  40  84.138   1.890 -13.029
  322    HA   SER  40           HA       SER  40  85.770   2.653 -15.338
  323    HG   SER  40           HG       SER  40  86.736   3.665 -13.522
  324    HB2  SER  40           HB2      SER  40  86.425   0.924 -12.930
  325    HB3  SER  40           HB1      SER  40  87.594   1.514 -14.109
  326    H    LYS  41           HN       LYS  41  84.653  -0.404 -13.871
  327    HA   LYS  41           HA       LYS  41  84.713  -1.644 -16.568
  328    HB2  LYS  41           HB2      LYS  41  85.743  -3.253 -14.244
  329    HB3  LYS  41           HB1      LYS  41  86.059  -3.459 -15.965
  330    HG2  LYS  41           HG2      LYS  41  87.041  -1.060 -14.400
  331    HG3  LYS  41           HG1      LYS  41  88.003  -2.524 -14.606
  332    HD2  LYS  41           HD2      LYS  41  86.858  -1.554 -17.123
  333    HD3  LYS  41           HD1      LYS  41  87.944  -0.386 -16.367
  334    HE2  LYS  41           HE2      LYS  41  89.080  -2.032 -17.922
  335    HE3  LYS  41           HE1      LYS  41  89.738  -1.987 -16.287
  336    HZ1  LYS  41           HZ1      LYS  41  87.593  -3.884 -16.985
  337    HZ2  LYS  41           HZ2      LYS  41  88.740  -3.978 -15.735
  338    HZ3  LYS  41           HZ3      LYS  41  89.210  -4.250 -17.345
  339    HA   PRO  42           HA       PRO  42  80.817  -3.158 -15.103
  340    HB2  PRO  42           HB2      PRO  42  80.510  -5.372 -16.699
  341    HB3  PRO  42           HB1      PRO  42  80.296  -3.709 -17.280
  342    HG2  PRO  42           HG2      PRO  42  82.631  -5.527 -17.586
  343    HG3  PRO  42           HG1      PRO  42  81.926  -4.388 -18.745
  344    HD2  PRO  42           HD2      PRO  42  84.194  -3.833 -17.315
  345    HD3  PRO  42           HD1      PRO  42  83.065  -2.573 -17.862
  346    HA   PRO  43           HA       PRO  43  81.777  -6.327 -12.125
  347    HB2  PRO  43           HB2      PRO  43  79.279  -7.112 -11.391
  348    HB3  PRO  43           HB1      PRO  43  79.944  -5.525 -10.956
  349    HG2  PRO  43           HG2      PRO  43  78.041  -6.234 -13.133
  350    HG3  PRO  43           HG1      PRO  43  78.038  -4.839 -12.042
  351    HD2  PRO  43           HD2      PRO  43  78.961  -4.727 -14.631
  352    HD3  PRO  43           HD1      PRO  43  79.540  -3.654 -13.338
  353    H    LYS  44           HN       LYS  44  82.530  -8.354 -12.570
  354    HA   LYS  44           HA       LYS  44  81.255  -9.976 -14.665
  355    HB2  LYS  44           HB2      LYS  44  83.418 -11.176 -13.016
  356    HB3  LYS  44           HB1      LYS  44  83.240 -11.119 -14.768
  357    HG2  LYS  44           HG2      LYS  44  85.027  -9.662 -14.485
  358    HG3  LYS  44           HG1      LYS  44  83.677  -8.529 -14.405
  359    HD2  LYS  44           HD2      LYS  44  84.803  -7.917 -12.481
  360    HD3  LYS  44           HD1      LYS  44  83.756  -9.174 -11.821
  361    HE2  LYS  44           HE2      LYS  44  85.711 -10.787 -12.464
  362    HE3  LYS  44           HE1      LYS  44  86.686  -9.317 -12.487
  363    HZ1  LYS  44           HZ1      LYS  44  86.710 -10.378 -10.312
  364    HZ2  LYS  44           HZ2      LYS  44  85.020 -10.245 -10.210
  365    HZ3  LYS  44           HZ3      LYS  44  85.985  -8.847 -10.233
  366    H    LYS  45           HN       LYS  45  82.111 -10.489 -11.222
  367    HA   LYS  45           HA       LYS  45  79.547 -11.798 -10.729
  368    HB2  LYS  45           HB2      LYS  45  80.699 -13.682 -11.739
  369    HB3  LYS  45           HB1      LYS  45  82.116 -13.409 -10.725
  370    HG2  LYS  45           HG2      LYS  45  80.975 -14.077  -8.756
  371    HG3  LYS  45           HG1      LYS  45  79.395 -13.938  -9.527
  372    HD2  LYS  45           HD2      LYS  45  81.315 -15.822 -10.792
  373    HD3  LYS  45           HD1      LYS  45  80.664 -16.303  -9.225
  374    HE2  LYS  45           HE2      LYS  45  79.340 -16.987 -11.351
  375    HE3  LYS  45           HE1      LYS  45  78.440 -16.285 -10.006
  376    HZ1  LYS  45           HZ1      LYS  45  78.543 -14.138 -11.085
  377    HZ2  LYS  45           HZ2      LYS  45  77.838 -15.279 -12.127
  378    HZ3  LYS  45           HZ3      LYS  45  79.447 -14.787 -12.365
  379    H    GLY  46           HN       GLY  46  82.705 -10.728  -9.682
  380    HA2  GLY  46           HA2      GLY  46  83.434  -9.948  -7.592
  381    HA3  GLY  46           HA1      GLY  46  81.729  -9.758  -7.178
  382    H    VAL  47           HN       VAL  47  82.780 -12.887  -8.188
  383    HA   VAL  47           HA       VAL  47  82.355 -14.895  -6.944
  384    HB   VAL  47           HB       VAL  47  84.745 -13.595  -5.614
  385   HG11  VAL  47          HG11      VAL  47  83.579 -16.363  -5.563
  386   HG12  VAL  47          HG12      VAL  47  84.275 -15.424  -4.243
  387   HG13  VAL  47          HG13      VAL  47  85.327 -16.158  -5.454
  388   HG21  VAL  47          HG21      VAL  47  86.048 -14.751  -7.303
  389   HG22  VAL  47          HG22      VAL  47  84.809 -13.803  -8.125
  390   HG23  VAL  47          HG23      VAL  47  84.606 -15.544  -7.935
  391    H    GLN  48           HN       GLN  48  80.328 -13.964  -5.983
  392    HA   GLN  48           HA       GLN  48  78.960 -13.469  -4.128
  393    HB2  GLN  48           HB2      GLN  48  79.642 -15.842  -3.747
  394    HB3  GLN  48           HB1      GLN  48  80.987 -15.265  -2.765
  395    HG2  GLN  48           HG2      GLN  48  79.390 -14.134  -1.250
  396    HG3  GLN  48           HG1      GLN  48  78.049 -14.742  -2.221
  397   HE21  GLN  48          HE21      GLN  48  77.284 -15.980  -0.309
  398   HE22  GLN  48          HE22      GLN  48  78.066 -17.418   0.142
  399    H    GLY  49           HN       GLY  49  81.793 -13.880  -2.070
  400    HA2  GLY  49           HA2      GLY  49  81.335 -11.229  -0.922
  401    HA3  GLY  49           HA1      GLY  49  82.546 -12.392  -0.389
  402    H1U  RCY  50           H1U      RCY  50  83.123  -5.774  -0.761
  403    H1S  RCY  50           H1S      RCY  50  85.952  -6.893  -3.614
  404    HB1  RCY  50           HB1      RCY  50  83.780  -8.849  -3.357
  405    HB2  RCY  50           HB2      RCY  50  83.127  -9.385  -4.904
  406    HA   RCY  50           HA       RCY  50  84.688 -11.277  -4.931
  407    HN1  RCY  50           HN1      RCY  50  82.981 -12.241  -3.634
  408    H    GLY  51           HN       GLY  51  85.463  -8.815  -2.685
  409    HA2  GLY  51           HA2      GLY  51  87.173  -9.908  -0.823
  410    HA3  GLY  51           HA1      GLY  51  88.137  -9.926  -2.301
  411    H    ASP  52           HN       ASP  52  89.592  -8.272  -1.890
  412    HA   ASP  52           HA       ASP  52  88.697  -5.555  -2.179
  413    HB2  ASP  52           HB2      ASP  52  87.993  -5.829   0.154
  414    HB3  ASP  52           HB1      ASP  52  89.606  -6.397   0.590
  415    H    ASP  53           HN       ASP  53  90.354  -4.864  -3.435
  416    HA   ASP  53           HA       ASP  53  93.056  -4.750  -2.421
  417    HB2  ASP  53           HB2      ASP  53  92.700  -7.207  -3.214
  418    HB3  ASP  53           HB1      ASP  53  92.772  -6.528  -4.841
  419    H    ILE  54           HN       ILE  54  90.852  -4.547  -5.174
  420    HA   ILE  54           HA       ILE  54  92.535  -3.068  -6.921
  421    HB   ILE  54           HB       ILE  54  90.277  -2.147  -7.790
  422   HG12  ILE  54          HG12      ILE  54  89.288  -4.199  -5.784
  423   HG13  ILE  54          HG11      ILE  54  89.085  -2.454  -5.625
  424   HG21  ILE  54          HG21      ILE  54  89.701  -4.337  -8.774
  425   HG22  ILE  54          HG22      ILE  54  90.708  -5.142  -7.571
  426   HG23  ILE  54          HG23      ILE  54  91.447  -4.086  -8.774
  427   HD11  ILE  54          HD11      ILE  54  87.520  -4.336  -7.178
  428   HD12  ILE  54          HD12      ILE  54  88.180  -3.071  -8.216
  429   HD13  ILE  54          HD13      ILE  54  87.187  -2.640  -6.824
  430    HA   PRO  55           HA       PRO  55  92.646   0.688  -4.442
  431    HB2  PRO  55           HB2      PRO  55  94.234   2.167  -6.083
  432    HB3  PRO  55           HB1      PRO  55  94.869   0.849  -5.079
  433    HG2  PRO  55           HG2      PRO  55  94.232   0.867  -7.985
  434    HG3  PRO  55           HG1      PRO  55  95.576   0.096  -7.127
  435    HD2  PRO  55           HD2      PRO  55  93.319  -1.254  -7.978
  436    HD3  PRO  55           HD1      PRO  55  94.347  -1.789  -6.631
  437    H    GLY  56           HN       GLY  56  90.535   1.531  -4.582
  438    HA2  GLY  56           HA2      GLY  56  89.679   3.793  -5.546
  439    HA3  GLY  56           HA1      GLY  56  89.793   2.959  -7.098
  440    H    MET  57           HN       MET  57  89.005   0.387  -5.670
  441    HA   MET  57           HA       MET  57  87.001  -0.805  -5.378
  442    HB2  MET  57           HB2      MET  57  85.910   1.776  -4.236
  443    HB3  MET  57           HB1      MET  57  85.436   0.127  -3.830
  444    HG2  MET  57           HG2      MET  57  87.686  -0.289  -2.895
  445    HG3  MET  57           HG1      MET  57  88.149   1.368  -3.285
  446    HE1  MET  57           HE1      MET  57  86.372   3.634  -1.006
  447    HE2  MET  57           HE2      MET  57  86.893   3.341  -2.663
  448    HE3  MET  57           HE3      MET  57  88.052   3.199  -1.344
  449    H    GLU  58           HN       GLU  58  87.431   1.126  -7.762
  450    HA   GLU  58           HA       GLU  58  84.759   1.965  -8.510
  451    HB2  GLU  58           HB2      GLU  58  85.763   2.518 -10.673
  452    HB3  GLU  58           HB1      GLU  58  86.809   3.089  -9.375
  453    HG2  GLU  58           HG2      GLU  58  87.181   0.413 -10.745
  454    HG3  GLU  58           HG1      GLU  58  88.016   1.883 -11.251
  455    H    GLY  59           HN       GLY  59  83.614   1.060 -10.372
  456    HA2  GLY  59           HA2      GLY  59  83.774  -0.992 -11.987
  457    HA3  GLY  59           HA1      GLY  59  83.916  -1.905 -10.484
  458    H1U  RCY  60           H1U      RCY  60  80.573   1.249  -2.962
  459    H1S  RCY  60           H1S      RCY  60  81.495   1.191  -6.944
  460    HB1  RCY  60           HB1      RCY  60  78.375   0.496  -9.541
  461    HB2  RCY  60           HB2      RCY  60  79.641   1.713  -9.702
  462    HA   RCY  60           HA       RCY  60  79.448  -0.952 -11.126
  463    HN1  RCY  60           HN1      RCY  60  81.801   0.811 -11.503
  464    H    GLY  61           HN       GLY  61  78.032   1.845 -10.915
  465    HA2  GLY  61           HA2      GLY  61  78.189   3.602 -12.895
  466    HA3  GLY  61           HA1      GLY  61  77.798   2.174 -13.857
  467    H    THR  62           HN       THR  62  76.447   4.781 -12.317
  468    HA   THR  62           HA       THR  62  74.311   5.230 -11.404
  469    HB   THR  62           HB       THR  62  73.914   5.338 -13.811
  470    HG1  THR  62           HG1      THR  62  71.744   5.029 -13.706
  471   HG21  THR  62          HG21      THR  62  74.717   3.191 -14.531
  472   HG22  THR  62          HG22      THR  62  73.004   3.263 -14.946
  473   HG23  THR  62          HG23      THR  62  73.532   2.348 -13.534
  474    H    ASP  63           HN       ASP  63  75.594   2.639 -10.477
  475    HA   ASP  63           HA       ASP  63  73.489   0.691 -10.174
  476    HB2  ASP  63           HB2      ASP  63  76.100   1.212  -8.755
  477    HB3  ASP  63           HB1      ASP  63  74.982  -0.011  -8.152
  478    H    ILE  64           HN       ILE  64  71.764   2.277  -9.625
  479    HA   ILE  64           HA       ILE  64  71.206   2.313  -6.812
  480    HB   ILE  64           HB       ILE  64  72.952   4.136  -6.973
  481   HG12  ILE  64          HG12      ILE  64  70.188   5.164  -6.272
  482   HG13  ILE  64          HG11      ILE  64  71.099   4.059  -5.243
  483   HG21  ILE  64          HG21      ILE  64  72.244   4.900  -9.251
  484   HG22  ILE  64          HG22      ILE  64  72.342   6.217  -8.082
  485   HG23  ILE  64          HG23      ILE  64  70.771   5.555  -8.534
  486   HD11  ILE  64          HD11      ILE  64  72.776   5.650  -4.806
  487   HD12  ILE  64          HD12      ILE  64  71.298   6.612  -4.782
  488   HD13  ILE  64          HD13      ILE  64  72.339   6.630  -6.205
  489    H    THR  65           HN       THR  65  70.524   2.775 -10.025
  490    HA   THR  65           HA       THR  65  67.633   3.114  -9.460
  491    HB   THR  65           HB       THR  65  69.252   4.852 -11.354
  492    HG1  THR  65           HG1      THR  65  68.340   6.495 -10.089
  493   HG21  THR  65          HG21      THR  65  67.306   4.312 -12.586
  494   HG22  THR  65          HG22      THR  65  66.914   5.844 -11.806
  495   HG23  THR  65          HG23      THR  65  66.288   4.333 -11.146
  496    H    VAL  66           HN       VAL  66  70.288   2.339 -11.609
  497    HA   VAL  66           HA       VAL  66  68.486   0.808 -13.407
  498    HB   VAL  66           HB       VAL  66  71.478   1.284 -13.599
  499   HG11  VAL  66          HG11      VAL  66  71.264   0.461 -15.854
  500   HG12  VAL  66          HG12      VAL  66  69.506   0.407 -15.724
  501   HG13  VAL  66          HG13      VAL  66  70.494  -0.720 -14.794
  502   HG21  VAL  66          HG21      VAL  66  70.413   3.420 -13.803
  503   HG22  VAL  66          HG22      VAL  66  69.104   2.748 -14.776
  504   HG23  VAL  66          HG23      VAL  66  70.728   2.877 -15.452
  505    H    ILE  67           HN       ILE  67  71.284   0.411 -11.229
  506    HA   ILE  67           HA       ILE  67  70.511  -2.459 -10.954
  507    HB   ILE  67           HB       ILE  67  73.323  -1.393 -11.341
  508   HG12  ILE  67          HG12      ILE  67  71.675  -2.027 -13.297
  509   HG13  ILE  67          HG11      ILE  67  73.344  -2.599 -13.343
  510   HG21  ILE  67          HG21      ILE  67  73.567  -2.988  -9.621
  511   HG22  ILE  67          HG22      ILE  67  73.843  -3.926 -11.089
  512   HG23  ILE  67          HG23      ILE  67  72.285  -4.013 -10.267
  513   HD11  ILE  67          HD11      ILE  67  71.381  -4.302 -13.744
  514   HD12  ILE  67          HD12      ILE  67  71.248  -4.268 -11.985
  515   HD13  ILE  67          HD13      ILE  67  72.756  -4.777 -12.746
  516    H1U  RCY  68           H1U      RCY  68  72.700   4.474  -3.646
  517    H1S  RCY  68           H1S      RCY  68  70.958   0.307  -5.379
  518    HB1  RCY  68           HB1      RCY  68  69.024  -1.494  -5.545
  519    HB2  RCY  68           HB2      RCY  68  68.375  -1.485  -7.180
  520    HA   RCY  68           HA       RCY  68  71.233  -0.714  -6.874
  521    HN1  RCY  68           HN1      RCY  68  69.577  -2.019  -8.946
  522    HA   PRO  69           HA       PRO  69  73.093  -4.759  -6.032
  523    HB2  PRO  69           HB2      PRO  69  73.560  -3.341  -3.434
  524    HB3  PRO  69           HB1      PRO  69  74.681  -4.316  -4.403
  525    HG2  PRO  69           HG2      PRO  69  74.774  -1.654  -4.427
  526    HG3  PRO  69           HG1      PRO  69  75.088  -2.605  -5.888
  527    HD2  PRO  69           HD2      PRO  69  72.720  -0.935  -5.211
  528    HD3  PRO  69           HD1      PRO  69  73.367  -1.383  -6.805
  529    H    TRP  70           HN       TRP  70  70.270  -3.510  -4.769
  530    HA   TRP  70           HA       TRP  70  69.930  -5.279  -2.498
  531    HD1  TRP  70           HD1      TRP  70  69.127  -4.583  -0.534
  532    HE1  TRP  70           HE1      TRP  70  67.224  -5.320   1.039
  533    HE3  TRP  70           HE3      TRP  70  65.206  -4.520  -3.805
  534    HZ2  TRP  70           HZ2      TRP  70  64.405  -5.818   0.926
  535    HZ3  TRP  70           HZ3      TRP  70  62.929  -5.128  -3.049
  536    HH2  TRP  70           HH2      TRP  70  62.521  -5.776  -0.692
  537    HB2  TRP  70           HB2      TRP  70  68.645  -3.075  -3.088
  538    HB3  TRP  70           HB1      TRP  70  67.641  -4.125  -4.085
  539    H    GLU  71           HN       GLU  71  70.086  -5.855  -5.801
  540    HA   GLU  71           HA       GLU  71  68.877  -8.529  -5.407
  541    HB2  GLU  71           HB2      GLU  71  67.951  -6.597  -7.556
  542    HB3  GLU  71           HB1      GLU  71  67.539  -8.312  -7.508
  543    HG2  GLU  71           HG2      GLU  71  66.609  -7.905  -5.176
  544    HG3  GLU  71           HG1      GLU  71  66.794  -6.180  -5.493
  545    H    ALA  72           HN       ALA  72  71.215  -6.494  -6.706
  546    HA   ALA  72           HA       ALA  72  71.918  -8.106  -9.031
  547    HB1  ALA  72           HB1      ALA  72  72.462  -5.573  -8.457
  548    HB2  ALA  72           HB2      ALA  72  73.585  -6.536  -9.417
  549    HB3  ALA  72           HB3      ALA  72  73.889  -6.282  -7.698
  550    H1U  RCY  73           H1U      RCY  73  74.445  -7.922   0.976
  551    H1S  RCY  73           H1S      RCY  73  76.197 -10.178  -2.057
  552    HB1  RCY  73           HB1      RCY  73  75.073  -8.264  -3.932
  553    HB2  RCY  73           HB2      RCY  73  76.195  -7.663  -5.153
  554    HA   RCY  73           HA       RCY  73  75.624  -9.694  -6.546
  555    HN1  RCY  73           HN1      RCY  73  74.038  -7.362  -6.249
  556    H    ASN  74           HN       ASN  74  73.578  -9.240  -3.665
  557    HA   ASN  74           HA       ASN  74  72.444 -11.967  -4.097
  558    HB2  ASN  74           HB2      ASN  74  74.457 -11.994  -2.523
  559    HB3  ASN  74           HB1      ASN  74  73.480 -11.033  -1.412
  560   HD21  ASN  74          HD21      ASN  74  71.290 -12.916  -3.053
  561   HD22  ASN  74          HD22      ASN  74  71.208 -14.241  -1.996
  562    H    HIS  75           HN       HIS  75  70.287 -11.577  -4.194
  563    HA   HIS  75           HA       HIS  75  68.980  -9.270  -3.188
  564    HD1  HIS  75           HD1      HIS  75  67.134 -13.077  -2.129
  565    HD2  HIS  75           HD2      HIS  75  69.098 -12.867  -5.802
  566    HE1  HIS  75           HE1      HIS  75  67.730 -15.457  -2.758
  567    HE2  HIS  75           HE2      HIS  75  68.926 -15.343  -4.993
  568    HB2  HIS  75           HB2      HIS  75  66.889 -10.763  -3.355
  569    HB3  HIS  75           HB1      HIS  75  67.824 -10.537  -4.833
  570    H1U  RCY  76           H1U      RCY  76  74.673  -5.630   5.575
  571    H1S  RCY  76           H1S      RCY  76  71.049  -7.453   3.839
  572    HB1  RCY  76           HB1      RCY  76  71.303 -10.102   1.012
  573    HB2  RCY  76           HB2      RCY  76  70.417 -10.162   2.535
  574    HA   RCY  76           HA       RCY  76  68.952 -11.153   0.951
  575    HN1  RCY  76           HN1      RCY  76  69.938  -9.134  -0.974
  576    H    GLU  77           HN       GLU  77  66.670 -10.497   0.466
  577    HA   GLU  77           HA       GLU  77  65.628  -7.916   1.023
  578    HB2  GLU  77           HB2      GLU  77  64.525 -10.674   0.827
  579    HB3  GLU  77           HB1      GLU  77  63.531  -9.499   1.687
  580    HG2  GLU  77           HG2      GLU  77  63.574  -7.992  -0.224
  581    HG3  GLU  77           HG1      GLU  77  64.693  -9.055  -1.079
  582    H    LEU  78           HN       LEU  78  66.939  -7.370   2.966
  583    HA   LEU  78           HA       LEU  78  65.381  -7.781   5.388
  584    HG   LEU  78           HG       LEU  78  68.043  -9.556   3.795
  585    HB2  LEU  78           HB2      LEU  78  67.535  -8.604   6.634
  586    HB3  LEU  78           HB1      LEU  78  66.553  -9.777   5.761
  587   HD11  LEU  78          HD11      LEU  78  69.372  -7.545   5.604
  588   HD12  LEU  78          HD12      LEU  78  68.908  -7.369   3.912
  589   HD13  LEU  78          HD13      LEU  78  70.294  -8.370   4.347
  590   HD21  LEU  78          HD21      LEU  78  68.487 -11.035   5.987
  591   HD22  LEU  78          HD22      LEU  78  69.934 -10.029   6.058
  592   HD23  LEU  78          HD23      LEU  78  69.618 -11.021   4.633
  593    H    HIS  79           HN       HIS  79  67.300  -6.914   7.258
  594    HA   HIS  79           HA       HIS  79  68.792  -4.661   6.185
  595    HD1  HIS  79           HD1      HIS  79  68.785  -2.882   5.061
  596    HD2  HIS  79           HD2      HIS  79  66.904  -1.146   8.355
  597    HE1  HIS  79           HE1      HIS  79  69.571  -0.476   5.148
  598    HE2  HIS  79           HE2      HIS  79  68.434   0.592   7.149
  599    HB2  HIS  79           HB2      HIS  79  66.251  -4.010   6.221
  600    HB3  HIS  79           HB1      HIS  79  66.498  -3.855   7.959
  601    H    GLU  80           HN       GLU  80  68.552  -7.010   8.333
  602    HA   GLU  80           HA       GLU  80  70.187  -5.536  10.335
  603    HB2  GLU  80           HB2      GLU  80  67.750  -7.228  10.953
  604    HB3  GLU  80           HB1      GLU  80  68.965  -6.816  12.162
  605    HG2  GLU  80           HG2      GLU  80  67.439  -4.782  10.511
  606    HG3  GLU  80           HG1      GLU  80  67.022  -5.239  12.163
  607    H    LEU  81           HN       LEU  81  69.596  -8.284   8.427
  608    HA   LEU  81           HA       LEU  81  71.474  -9.964  10.020
  609    HG   LEU  81           HG       LEU  81  69.281 -12.665   9.377
  610    HB2  LEU  81           HB2      LEU  81  69.235 -10.506   8.221
  611    HB3  LEU  81           HB1      LEU  81  70.673 -11.404   7.740
  612   HD11  LEU  81          HD11      LEU  81  71.135 -13.535  10.402
  613   HD12  LEU  81          HD12      LEU  81  71.688 -11.958  10.966
  614   HD13  LEU  81          HD13      LEU  81  71.983 -12.451   9.299
  615   HD21  LEU  81          HD21      LEU  81  70.125 -10.805  11.553
  616   HD22  LEU  81          HD22      LEU  81  68.683 -11.814  11.435
  617   HD23  LEU  81          HD23      LEU  81  68.773 -10.297  10.541
  618    H    ALA  82           HN       ALA  82  72.036  -7.526   8.256
  619    HA   ALA  82           HA       ALA  82  73.323  -8.179   5.863
  620    HB1  ALA  82           HB1      ALA  82  73.040  -5.877   7.055
  621    HB2  ALA  82           HB2      ALA  82  74.470  -6.131   6.056
  622    HB3  ALA  82           HB3      ALA  82  74.587  -6.258   7.811
  623    H    GLN  83           HN       GLN  83  74.336 -10.245   6.046
  624    HA   GLN  83           HA       GLN  83  76.082 -11.728   6.525
  625    HB2  GLN  83           HB2      GLN  83  77.229  -9.583   5.509
  626    HB3  GLN  83           HB1      GLN  83  77.828  -9.352   7.148
  627    HG2  GLN  83           HG2      GLN  83  78.884 -11.529   7.142
  628    HG3  GLN  83           HG1      GLN  83  78.142 -11.933   5.593
  629   HE21  GLN  83          HE21      GLN  83  80.261  -9.366   7.005
  630   HE22  GLN  83          HE22      GLN  83  81.223  -9.197   5.617
  631    H    TYR  84           HN       TYR  84  77.235  -9.197   8.739
  632    HA   TYR  84           HA       TYR  84  77.007 -11.154  10.953
  633    HD1  TYR  84           HD2      TYR  84  79.109 -11.719  12.381
  634    HD2  TYR  84           HD1      TYR  84  80.079  -9.075   9.138
  635    HE1  TYR  84           HE2      TYR  84  81.053 -13.144  11.801
  636    HE2  TYR  84           HE1      TYR  84  82.024 -10.500   8.558
  637    HH   TYR  84           HH       TYR  84  82.422 -13.593   9.640
  638    HB2  TYR  84           HB2      TYR  84  78.386  -8.474  10.670
  639    HB3  TYR  84           HB1      TYR  84  78.244  -9.302  12.220
  640    H    GLY  85           HN       GLY  85  76.286  -7.658  10.536
  641    HA2  GLY  85           HA2      GLY  85  73.655  -7.447  11.007
  642    HA3  GLY  85           HA1      GLY  85  74.203  -7.902  12.619
  643    H    ILE  86           HN       ILE  86  76.093  -5.873  10.427
  644    HA   ILE  86           HA       ILE  86  75.878  -3.683  12.439
  645    HB   ILE  86           HB       ILE  86  78.160  -4.203  12.045
  646   HG12  ILE  86          HG12      ILE  86  77.858  -2.065   9.964
  647   HG13  ILE  86          HG11      ILE  86  77.306  -1.728  11.605
  648   HG21  ILE  86          HG21      ILE  86  78.730  -4.003   9.360
  649   HG22  ILE  86          HG22      ILE  86  77.153  -4.792   9.341
  650   HG23  ILE  86          HG23      ILE  86  78.493  -5.521  10.226
  651   HD11  ILE  86          HD11      ILE  86  80.015  -2.952  11.211
  652   HD12  ILE  86          HD12      ILE  86  79.443  -1.901  12.506
  653   HD13  ILE  86          HD13      ILE  86  79.808  -1.225  10.919
  654    H1U  RCY  87           H1U      RCY  87  79.105  -3.155   3.275
  655    H1S  RCY  87           H1S      RCY  87  76.023   0.029   4.184
  656    HB1  RCY  87           HB1      RCY  87  76.162  -2.370   6.452
  657    HB2  RCY  87           HB2      RCY  87  77.078  -1.399   7.606
  658    HA   RCY  87           HA       RCY  87  74.770  -1.095   8.800
  659    HN1  RCY  87           HN1      RCY  87  76.673  -3.294   9.018
  Start of MODEL   70
    1    HA   MET   1           HA       MET   1  69.621 -22.359  13.014
    2    HB2  MET   1           HB2      MET   1  72.124 -23.175  14.509
    3    HB3  MET   1           HB1      MET   1  71.365 -21.595  14.707
    4    HG2  MET   1           HG2      MET   1  69.327 -22.582  15.512
    5    HG3  MET   1           HG1      MET   1  69.867 -24.201  15.068
    6    HE1  MET   1           HE1      MET   1  70.847 -21.687  18.705
    7    HE2  MET   1           HE2      MET   1  69.262 -22.023  18.012
    8    HE3  MET   1           HE3      MET   1  70.436 -21.083  17.095
    9    H    ASN   2           HN       ASN   2  73.150 -22.832  12.594
   10    HA   ASN   2           HA       ASN   2  74.692 -21.582  11.345
   11    HB2  ASN   2           HB2      ASN   2  73.186 -22.640   9.553
   12    HB3  ASN   2           HB1      ASN   2  72.396 -21.066   9.448
   13   HD21  ASN   2          HD21      ASN   2  75.196 -19.867  10.192
   14   HD22  ASN   2          HD22      ASN   2  76.013 -19.859   8.704
   15    H    LEU   3           HN       LEU   3  73.045 -19.394   9.582
   16    HA   LEU   3           HA       LEU   3  73.922 -17.131  10.987
   17    HG   LEU   3           HG       LEU   3  72.273 -18.744   8.408
   18    HB2  LEU   3           HB2      LEU   3  71.769 -16.068   9.750
   19    HB3  LEU   3           HB1      LEU   3  73.245 -16.488   8.887
   20   HD11  LEU   3          HD11      LEU   3  70.680 -19.152  10.070
   21   HD12  LEU   3          HD12      LEU   3  69.662 -18.719   8.696
   22   HD13  LEU   3          HD13      LEU   3  69.999 -17.529   9.953
   23   HD21  LEU   3          HD21      LEU   3  72.082 -16.934   6.751
   24   HD22  LEU   3          HD22      LEU   3  70.602 -16.368   7.525
   25   HD23  LEU   3          HD23      LEU   3  70.634 -17.940   6.726
   26    H    GLU   4           HN       GLU   4  73.185 -16.036  12.759
   27    HA   GLU   4           HA       GLU   4  71.219 -17.232  14.464
   28    HB2  GLU   4           HB2      GLU   4  71.477 -15.193  15.835
   29    HB3  GLU   4           HB1      GLU   4  73.042 -15.834  15.337
   30    HG2  GLU   4           HG2      GLU   4  73.423 -13.679  14.676
   31    HG3  GLU   4           HG1      GLU   4  72.511 -14.171  13.248
   32    HA   PRO   5           HA       PRO   5  67.572 -15.876  12.165
   33    HB2  PRO   5           HB2      PRO   5  66.433 -16.131  14.930
   34    HB3  PRO   5           HB1      PRO   5  65.781 -16.718  13.387
   35    HG2  PRO   5           HG2      PRO   5  67.002 -18.354  15.105
   36    HG3  PRO   5           HG1      PRO   5  67.162 -18.556  13.353
   37    HD2  PRO   5           HD2      PRO   5  69.173 -17.593  15.317
   38    HD3  PRO   5           HD1      PRO   5  69.419 -18.350  13.728
   39    HA   PRO   6           HA       PRO   6  67.502 -11.550  13.223
   40    HB2  PRO   6           HB2      PRO   6  65.189 -10.782  11.996
   41    HB3  PRO   6           HB1      PRO   6  66.662 -11.195  11.097
   42    HG2  PRO   6           HG2      PRO   6  64.234 -12.844  11.592
   43    HG3  PRO   6           HG1      PRO   6  65.214 -12.688  10.125
   44    HD2  PRO   6           HD2      PRO   6  65.433 -14.809  11.855
   45    HD3  PRO   6           HD1      PRO   6  66.777 -14.235  10.843
   46    H    LYS   7           HN       LYS   7  66.314  -9.969  14.519
   47    HA   LYS   7           HA       LYS   7  64.116 -11.150  16.179
   48    HB2  LYS   7           HB2      LYS   7  66.434 -10.930  17.303
   49    HB3  LYS   7           HB1      LYS   7  66.157  -9.191  17.242
   50    HG2  LYS   7           HG2      LYS   7  65.201  -9.610  19.295
   51    HG3  LYS   7           HG1      LYS   7  63.795  -9.940  18.282
   52    HD2  LYS   7           HD2      LYS   7  64.010 -11.804  19.780
   53    HD3  LYS   7           HD1      LYS   7  64.561 -12.361  18.200
   54    HE2  LYS   7           HE2      LYS   7  66.003 -12.760  20.429
   55    HE3  LYS   7           HE1      LYS   7  66.761 -12.495  18.859
   56    HZ1  LYS   7           HZ1      LYS   7  67.661 -11.076  20.650
   57    HZ2  LYS   7           HZ2      LYS   7  66.139 -10.336  20.797
   58    HZ3  LYS   7           HZ3      LYS   7  67.022 -10.189  19.353
   59    H    ALA   8           HN       ALA   8  65.227  -8.582  14.221
   60    HA   ALA   8           HA       ALA   8  63.830  -6.352  15.262
   61    HB1  ALA   8           HB1      ALA   8  64.076  -6.965  12.310
   62    HB2  ALA   8           HB2      ALA   8  65.445  -6.416  13.278
   63    HB3  ALA   8           HB3      ALA   8  64.028  -5.383  13.088
   64    H    GLU   9           HN       GLU   9  61.704  -5.596  14.960
   65    HA   GLU   9           HA       GLU   9  59.782  -6.952  13.278
   66    HB2  GLU   9           HB2      GLU   9  60.145  -8.543  15.282
   67    HB3  GLU   9           HB1      GLU   9  59.311  -7.320  16.240
   68    HG2  GLU   9           HG2      GLU   9  57.625  -8.861  15.521
   69    HG3  GLU   9           HG1      GLU   9  57.438  -7.424  14.514
   70    H1U  RCY  10           H1U      RCY  10  65.237  -1.699  12.106
   71    H1S  RCY  10           H1S      RCY  10  62.917  -1.079  15.374
   72    HB1  RCY  10           HB1      RCY  10  59.524  -0.865  14.155
   73    HB2  RCY  10           HB2      RCY  10  60.745  -1.967  13.519
   74    HA   RCY  10           HA       RCY  10  58.441  -2.969  15.195
   75    HN1  RCY  10           HN1      RCY  10  60.492  -4.280  13.509
   76    H    ARG  11           HN       ARG  11  57.135  -1.183  14.076
   77    HA   ARG  11           HA       ARG  11  55.446  -0.694  12.521
   78    HE   ARG  11           HE       ARG  11  55.039   3.116  10.400
   79    HB2  ARG  11           HB2      ARG  11  57.953  -1.131  11.024
   80    HB3  ARG  11           HB1      ARG  11  56.501  -1.318  10.044
   81    HG2  ARG  11           HG2      ARG  11  56.830   1.051  11.880
   82    HG3  ARG  11           HG1      ARG  11  57.520   1.060  10.257
   83    HD2  ARG  11           HD2      ARG  11  55.159   0.332   9.473
   84    HD3  ARG  11           HD1      ARG  11  54.620   0.872  11.063
   85   HH11  ARG  11          HH21      ARG  11  56.303   0.790   8.191
   86   HH12  ARG  11          HH22      ARG  11  56.665   1.956   6.963
   87   HH21  ARG  11          HH11      ARG  11  55.504   4.652   8.809
   88   HH22  ARG  11          HH12      ARG  11  56.213   4.143   7.313
   89    H    SER  12           HN       SER  12  56.818  -3.230  10.488
   90    HA   SER  12           HA       SER  12  54.991  -5.297  11.370
   91    HG   SER  12           HG       SER  12  54.723  -3.945   7.879
   92    HB2  SER  12           HB2      SER  12  53.702  -5.319   9.164
   93    HB3  SER  12           HB1      SER  12  53.282  -4.025  10.283
   94    H    ALA  13           HN       ALA  13  55.776  -4.663   7.986
   95    HA   ALA  13           HA       ALA  13  57.029  -5.985   6.492
   96    HB1  ALA  13           HB1      ALA  13  59.027  -6.099   8.759
   97    HB2  ALA  13           HB2      ALA  13  58.753  -4.630   7.822
   98    HB3  ALA  13           HB3      ALA  13  59.351  -6.086   7.025
   99    H    THR  14           HN       THR  14  55.418  -7.776   6.845
  100    HA   THR  14           HA       THR  14  55.959  -9.883   8.731
  101    HB   THR  14           HB       THR  14  53.740  -9.692   7.788
  102    HG1  THR  14           HG1      THR  14  54.207 -11.790   8.178
  103   HG21  THR  14          HG21      THR  14  55.097 -10.135   5.114
  104   HG22  THR  14          HG22      THR  14  54.351  -8.635   5.663
  105   HG23  THR  14          HG23      THR  14  53.353 -10.058   5.365
  106    H    ARG  15           HN       ARG  15  57.334  -9.025   5.682
  107    HA   ARG  15           HA       ARG  15  59.144 -11.353   5.870
  108    HE   ARG  15           HE       ARG  15  58.373 -12.519   1.083
  109    HB2  ARG  15           HB2      ARG  15  58.828 -11.882   3.443
  110    HB3  ARG  15           HB1      ARG  15  57.400 -12.225   4.417
  111    HG2  ARG  15           HG2      ARG  15  56.168 -10.781   3.201
  112    HG3  ARG  15           HG1      ARG  15  57.319  -9.483   3.520
  113    HD2  ARG  15           HD2      ARG  15  57.107  -9.915   1.094
  114    HD3  ARG  15           HD1      ARG  15  58.737 -10.268   1.668
  115   HH11  ARG  15          HH21      ARG  15  55.412 -10.797   1.474
  116   HH12  ARG  15          HH22      ARG  15  54.421 -12.117   0.948
  117   HH21  ARG  15          HH11      ARG  15  57.096 -14.252   0.393
  118   HH22  ARG  15          HH12      ARG  15  55.374 -14.073   0.336
  119    H    VAL  16           HN       VAL  16  60.631  -9.600   6.407
  120    HA   VAL  16           HA       VAL  16  61.171  -7.310   4.903
  121    HB   VAL  16           HB       VAL  16  63.505  -7.500   5.719
  122   HG11  VAL  16          HG11      VAL  16  62.934  -7.728   8.157
  123   HG12  VAL  16          HG12      VAL  16  61.335  -8.298   7.681
  124   HG13  VAL  16          HG13      VAL  16  61.844  -6.658   7.276
  125   HG21  VAL  16          HG21      VAL  16  63.982  -9.821   5.427
  126   HG22  VAL  16          HG22      VAL  16  62.579 -10.304   6.380
  127   HG23  VAL  16          HG23      VAL  16  63.970  -9.563   7.171
  128    H    MET  17           HN       MET  17  61.587 -10.608   3.991
  129    HA   MET  17           HA       MET  17  63.618 -10.190   1.968
  130    HB2  MET  17           HB2      MET  17  62.829 -12.414   3.082
  131    HB3  MET  17           HB1      MET  17  61.555 -12.388   1.862
  132    HG2  MET  17           HG2      MET  17  63.347 -13.653   0.908
  133    HG3  MET  17           HG1      MET  17  63.403 -12.071   0.129
  134    HE1  MET  17           HE1      MET  17  66.126 -13.854   3.306
  135    HE2  MET  17           HE2      MET  17  65.680 -14.718   1.837
  136    HE3  MET  17           HE3      MET  17  64.427 -14.206   2.966
  137    H    GLY  18           HN       GLY  18  61.334  -8.314   1.919
  138    HA2  GLY  18           HA2      GLY  18  60.982  -7.878  -0.790
  139    HA3  GLY  18           HA1      GLY  18  59.683  -8.998  -0.376
  140    H    GLY  19           HN       GLY  19  58.585  -8.275   1.852
  141    HA2  GLY  19           HA2      GLY  19  57.404  -6.616   3.040
  142    HA3  GLY  19           HA1      GLY  19  58.465  -5.408   2.313
  143    HA   PRO  20           HA       PRO  20  54.112  -4.846   0.650
  144    HB2  PRO  20           HB2      PRO  20  55.328  -2.120   0.426
  145    HB3  PRO  20           HB1      PRO  20  53.708  -2.590   0.978
  146    HG2  PRO  20           HG2      PRO  20  55.601  -1.849   2.694
  147    HG3  PRO  20           HG1      PRO  20  54.438  -3.126   3.089
  148    HD2  PRO  20           HD2      PRO  20  57.329  -3.368   2.383
  149    HD3  PRO  20           HD1      PRO  20  56.332  -4.399   3.434
  150    H1U  RCY  21           H1U      RCY  21  62.609  -2.237   2.296
  151    H1S  RCY  21           H1S      RCY  21  59.716  -1.206  -0.910
  152    HB1  RCY  21           HB1      RCY  21  57.442  -1.833  -2.400
  153    HB2  RCY  21           HB2      RCY  21  57.866  -2.420  -4.007
  154    HA   RCY  21           HA       RCY  21  56.216  -3.944  -3.346
  155    HN1  RCY  21           HN1      RCY  21  57.274  -3.767  -0.557
  156    H    THR  22           HN       THR  22  57.334  -5.247  -4.869
  157    HA   THR  22           HA       THR  22  58.783  -7.500  -3.674
  158    HB   THR  22           HB       THR  22  57.212  -8.109  -5.362
  159    HG1  THR  22           HG1      THR  22  59.260  -8.234  -7.119
  160   HG21  THR  22          HG21      THR  22  58.525  -5.916  -6.978
  161   HG22  THR  22          HG22      THR  22  56.843  -6.014  -6.455
  162   HG23  THR  22          HG23      THR  22  57.448  -7.114  -7.694
  163    HA   PRO  23           HA       PRO  23  62.936  -6.084  -4.329
  164    HB2  PRO  23           HB2      PRO  23  63.416  -8.715  -5.667
  165    HB3  PRO  23           HB1      PRO  23  64.305  -7.948  -4.338
  166    HG2  PRO  23           HG2      PRO  23  62.618  -9.975  -3.920
  167    HG3  PRO  23           HG1      PRO  23  62.816  -8.662  -2.749
  168    HD2  PRO  23           HD2      PRO  23  60.538  -9.210  -4.589
  169    HD3  PRO  23           HD1      PRO  23  60.546  -8.382  -3.016
  170    H    ARG  24           HN       ARG  24  64.689  -6.391  -6.331
  171    HA   ARG  24           HA       ARG  24  63.232  -5.326  -8.696
  172    HE   ARG  24           HE       ARG  24  66.110  -1.054  -9.916
  173    HB2  ARG  24           HB2      ARG  24  65.300  -4.201  -7.545
  174    HB3  ARG  24           HB1      ARG  24  66.233  -5.411  -8.425
  175    HG2  ARG  24           HG2      ARG  24  65.083  -4.664 -10.534
  176    HG3  ARG  24           HG1      ARG  24  64.349  -3.353  -9.609
  177    HD2  ARG  24           HD2      ARG  24  66.928  -3.012  -8.886
  178    HD3  ARG  24           HD1      ARG  24  67.167  -3.702 -10.492
  179   HH11  ARG  24          HH21      ARG  24  66.101  -3.753 -12.061
  180   HH12  ARG  24          HH22      ARG  24  65.653  -2.818 -13.449
  181   HH21  ARG  24          HH11      ARG  24  65.525   0.183 -11.716
  182   HH22  ARG  24          HH12      ARG  24  65.327  -0.590 -13.253
  183    H    LYS  25           HN       LYS  25  64.021  -6.076 -10.871
  184    HA   LYS  25           HA       LYS  25  63.968  -8.949 -11.023
  185    HB2  LYS  25           HB2      LYS  25  64.735  -6.921 -13.147
  186    HB3  LYS  25           HB1      LYS  25  64.328  -8.611 -13.442
  187    HG2  LYS  25           HG2      LYS  25  62.390  -6.876 -11.941
  188    HG3  LYS  25           HG1      LYS  25  62.470  -6.762 -13.700
  189    HD2  LYS  25           HD2      LYS  25  62.049  -9.160 -13.909
  190    HD3  LYS  25           HD1      LYS  25  62.064  -9.340 -12.154
  191    HE2  LYS  25           HE2      LYS  25  60.196  -7.458 -12.283
  192    HE3  LYS  25           HE1      LYS  25  59.987  -8.095 -13.914
  193    HZ1  LYS  25           HZ1      LYS  25  60.192 -10.043 -11.758
  194    HZ2  LYS  25           HZ2      LYS  25  59.223 -10.062 -13.154
  195    HZ3  LYS  25           HZ3      LYS  25  58.767  -9.123 -11.813
  196    H    GLY  26           HN       GLY  26  66.586  -6.606 -11.761
  197    HA2  GLY  26           HA2      GLY  26  68.562  -8.526 -10.746
  198    HA3  GLY  26           HA1      GLY  26  68.660  -8.228 -12.482
  199    HA   PRO  27           HA       PRO  27  71.032  -5.072  -9.620
  200    HB2  PRO  27           HB2      PRO  27  73.125  -6.023 -11.543
  201    HB3  PRO  27           HB1      PRO  27  73.286  -5.583  -9.832
  202    HG2  PRO  27           HG2      PRO  27  73.235  -8.130 -10.636
  203    HG3  PRO  27           HG1      PRO  27  72.528  -7.614  -9.096
  204    HD2  PRO  27           HD2      PRO  27  71.162  -8.482 -11.584
  205    HD3  PRO  27           HD1      PRO  27  70.577  -8.510  -9.907
  206    HA   PRO  28           HA       PRO  28  70.516  -1.652 -12.389
  207    HB2  PRO  28           HB2      PRO  28  73.449  -1.128 -12.042
  208    HB3  PRO  28           HB1      PRO  28  72.079  -0.008 -11.896
  209    HG2  PRO  28           HG2      PRO  28  73.310  -1.017  -9.750
  210    HG3  PRO  28           HG1      PRO  28  71.568  -0.697  -9.770
  211    HD2  PRO  28           HD2      PRO  28  72.991  -3.300  -9.809
  212    HD3  PRO  28           HD1      PRO  28  71.337  -2.926  -9.278
  213    H    LYS  29           HN       LYS  29  71.263  -0.807 -14.536
  214    HA   LYS  29           HA       LYS  29  72.288  -3.023 -16.200
  215    HB2  LYS  29           HB2      LYS  29  70.283  -1.696 -16.896
  216    HB3  LYS  29           HB1      LYS  29  71.319  -0.275 -17.036
  217    HG2  LYS  29           HG2      LYS  29  72.599  -1.262 -18.796
  218    HG3  LYS  29           HG1      LYS  29  71.893  -2.853 -18.510
  219    HD2  LYS  29           HD2      LYS  29  70.914  -1.678 -20.498
  220    HD3  LYS  29           HD1      LYS  29  69.717  -2.082 -19.267
  221    HE2  LYS  29           HE2      LYS  29  69.563   0.146 -18.512
  222    HE3  LYS  29           HE1      LYS  29  71.092   0.600 -19.263
  223    HZ1  LYS  29           HZ1      LYS  29  70.076   1.054 -21.169
  224    HZ2  LYS  29           HZ2      LYS  29  68.602   0.941 -20.331
  225    HZ3  LYS  29           HZ3      LYS  29  69.215  -0.408 -21.163
  226    H1U  RCY  30           H1U      RCY  30  74.635   4.143 -11.235
  227    H1S  RCY  30           H1S      RCY  30  77.013   2.230 -14.589
  228    HB1  RCY  30           HB1      RCY  30  77.213  -0.390 -14.833
  229    HB2  RCY  30           HB2      RCY  30  75.471  -0.288 -14.582
  230    HA   RCY  30           HA       RCY  30  76.208  -1.355 -17.221
  231    HN1  RCY  30           HN1      RCY  30  74.526  -3.024 -15.659
  232    H    LYS  31           HN       LYS  31  76.031  -3.074 -14.115
  233    HA   LYS  31           HA       LYS  31  77.404  -4.760 -13.229
  234    HB2  LYS  31           HB2      LYS  31  78.455  -5.162 -16.036
  235    HB3  LYS  31           HB1      LYS  31  78.309  -6.353 -14.749
  236    HG2  LYS  31           HG2      LYS  31  76.065  -6.682 -15.115
  237    HG3  LYS  31           HG1      LYS  31  75.792  -5.004 -15.584
  238    HD2  LYS  31           HD2      LYS  31  76.462  -5.366 -17.786
  239    HD3  LYS  31           HD1      LYS  31  77.436  -6.775 -17.364
  240    HE2  LYS  31           HE2      LYS  31  74.425  -6.756 -17.093
  241    HE3  LYS  31           HE1      LYS  31  75.235  -7.257 -18.578
  242    HZ1  LYS  31           HZ1      LYS  31  74.668  -9.024 -16.827
  243    HZ2  LYS  31           HZ2      LYS  31  76.010  -8.417 -15.981
  244    HZ3  LYS  31           HZ3      LYS  31  76.207  -9.061 -17.541
  245    H    GLN  32           HN       GLN  32  78.575  -2.005 -14.716
  246    HA   GLN  32           HA       GLN  32  81.418  -2.620 -14.072
  247    HB2  GLN  32           HB2      GLN  32  80.060  -0.514 -15.750
  248    HB3  GLN  32           HB1      GLN  32  81.730  -0.313 -15.220
  249    HG2  GLN  32           HG2      GLN  32  82.272  -2.537 -16.225
  250    HG3  GLN  32           HG1      GLN  32  80.623  -2.619 -16.849
  251   HE21  GLN  32          HE21      GLN  32  83.722  -0.917 -17.175
  252   HE22  GLN  32          HE22      GLN  32  83.346  -0.156 -18.645
  253    H    ARG  33           HN       ARG  33  81.848  -2.178 -11.961
  254    HA   ARG  33           HA       ARG  33  80.554   0.170 -10.674
  255    HE   ARG  33           HE       ARG  33  78.462  -4.450  -8.349
  256    HB2  ARG  33           HB2      ARG  33  82.443  -1.780  -9.344
  257    HB3  ARG  33           HB1      ARG  33  81.196  -0.778  -8.598
  258    HG2  ARG  33           HG2      ARG  33  79.519  -2.110 -10.029
  259    HG3  ARG  33           HG1      ARG  33  80.839  -3.250 -10.295
  260    HD2  ARG  33           HD2      ARG  33  81.107  -3.329  -7.759
  261    HD3  ARG  33           HD1      ARG  33  79.571  -2.467  -7.662
  262   HH11  ARG  33          HH21      ARG  33  81.883  -4.614  -8.748
  263   HH12  ARG  33          HH22      ARG  33  81.895  -6.310  -9.099
  264   HH21  ARG  33          HH11      ARG  33  78.458  -6.664  -8.806
  265   HH22  ARG  33          HH12      ARG  33  79.955  -7.470  -9.132
  266    H    GLN  34           HN       GLN  34  83.258  -0.525 -12.456
  267    HA   GLN  34           HA       GLN  34  85.320   0.533 -12.765
  268    HB2  GLN  34           HB2      GLN  34  84.063   2.870 -11.314
  269    HB3  GLN  34           HB1      GLN  34  85.316   2.909 -12.551
  270    HG2  GLN  34           HG2      GLN  34  83.530   3.365 -13.919
  271    HG3  GLN  34           HG1      GLN  34  83.385   1.607 -13.924
  272   HE21  GLN  34          HE21      GLN  34  80.992   2.525 -14.384
  273   HE22  GLN  34          HE22      GLN  34  80.015   2.668 -13.004
  274    H    THR  35           HN       THR  35  87.166   1.630 -11.546
  275    HA   THR  35           HA       THR  35  87.141   1.579  -8.648
  276    HB   THR  35           HB       THR  35  88.869  -0.547  -9.919
  277    HG1  THR  35           HG1      THR  35  86.264  -0.832  -8.834
  278   HG21  THR  35          HG21      THR  35  89.204   0.430  -7.550
  279   HG22  THR  35          HG22      THR  35  89.138  -1.326  -7.706
  280   HG23  THR  35          HG23      THR  35  87.727  -0.437  -7.131
  281    H    ARG  36           HN       ARG  36  87.881   3.527 -10.515
  282    HA   ARG  36           HA       ARG  36  90.610   4.074  -9.670
  283    HE   ARG  36           HE       ARG  36  91.680   3.688 -14.545
  284    HB2  ARG  36           HB2      ARG  36  91.106   2.565 -11.531
  285    HB3  ARG  36           HB1      ARG  36  90.053   3.493 -12.597
  286    HG2  ARG  36           HG2      ARG  36  92.117   5.096 -11.221
  287    HG3  ARG  36           HG1      ARG  36  92.751   3.911 -12.363
  288    HD2  ARG  36           HD2      ARG  36  90.453   5.688 -13.148
  289    HD3  ARG  36           HD1      ARG  36  92.110   6.283 -13.248
  290   HH11  ARG  36          HH21      ARG  36  91.694   7.128 -14.775
  291   HH12  ARG  36          HH22      ARG  36  91.936   7.145 -16.490
  292   HH21  ARG  36          HH11      ARG  36  91.996   3.690 -16.783
  293   HH22  ARG  36          HH12      ARG  36  92.107   5.199 -17.627
  294    H    GLN  37           HN       GLN  37  87.607   4.932 -11.026
  295    HA   GLN  37           HA       GLN  37  88.466   7.658 -11.785
  296    HB2  GLN  37           HB2      GLN  37  85.996   7.930 -12.295
  297    HB3  GLN  37           HB1      GLN  37  86.808   6.667 -13.222
  298    HG2  GLN  37           HG2      GLN  37  85.964   4.953 -11.710
  299    HG3  GLN  37           HG1      GLN  37  85.244   6.183 -10.670
  300   HE21  GLN  37          HE21      GLN  37  83.028   5.570 -11.009
  301   HE22  GLN  37          HE22      GLN  37  82.263   5.705 -12.518
  302    H1U  RCY  38           H1U      RCY  38  84.530   2.726  -6.123
  303    H1S  RCY  38           H1S      RCY  38  83.420   7.177  -6.786
  304    HB1  RCY  38           HB1      RCY  38  84.769   8.993  -7.120
  305    HB2  RCY  38           HB2      RCY  38  85.865   7.686  -7.569
  306    HA   RCY  38           HA       RCY  38  85.383  10.269  -9.082
  307    HN1  RCY  38           HN1      RCY  38  86.113   9.030 -10.935
  308    H    LYS  39           HN       LYS  39  86.885  11.806  -8.559
  309    HA   LYS  39           HA       LYS  39  89.104  10.980  -6.726
  310    HB2  LYS  39           HB2      LYS  39  90.515  12.719  -7.798
  311    HB3  LYS  39           HB1      LYS  39  90.044  11.461  -8.937
  312    HG2  LYS  39           HG2      LYS  39  89.253  13.107 -10.268
  313    HG3  LYS  39           HG1      LYS  39  87.968  13.334  -9.081
  314    HD2  LYS  39           HD2      LYS  39  88.915  15.479  -9.240
  315    HD3  LYS  39           HD1      LYS  39  89.712  14.801  -7.819
  316    HE2  LYS  39           HE2      LYS  39  91.479  15.726  -9.101
  317    HE3  LYS  39           HE1      LYS  39  91.540  13.998  -9.448
  318    HZ1  LYS  39           HZ1      LYS  39  91.513  15.821 -11.346
  319    HZ2  LYS  39           HZ2      LYS  39  89.835  15.635 -11.153
  320    HZ3  LYS  39           HZ3      LYS  39  90.800  14.294 -11.548
  321    H    SER  40           HN       SER  40  88.535  11.820  -4.787
  322    HA   SER  40           HA       SER  40  88.519  14.536  -4.161
  323    HG   SER  40           HG       SER  40  84.833  13.645  -5.517
  324    HB2  SER  40           HB2      SER  40  85.872  14.641  -3.772
  325    HB3  SER  40           HB1      SER  40  86.595  15.147  -5.294
  326    H    LYS  41           HN       LYS  41  89.059  14.330  -2.046
  327    HA   LYS  41           HA       LYS  41  88.484  11.989  -0.502
  328    HB2  LYS  41           HB2      LYS  41  89.329  14.752   0.412
  329    HB3  LYS  41           HB1      LYS  41  89.379  13.296   1.405
  330    HG2  LYS  41           HG2      LYS  41  90.867  12.257  -0.363
  331    HG3  LYS  41           HG1      LYS  41  90.957  13.848  -1.120
  332    HD2  LYS  41           HD2      LYS  41  92.819  13.960   0.249
  333    HD3  LYS  41           HD1      LYS  41  91.598  14.600   1.350
  334    HE2  LYS  41           HE2      LYS  41  92.889  12.902   2.520
  335    HE3  LYS  41           HE1      LYS  41  91.260  12.285   2.241
  336    HZ1  LYS  41           HZ1      LYS  41  93.358  10.862   1.655
  337    HZ2  LYS  41           HZ2      LYS  41  93.316  11.769   0.218
  338    HZ3  LYS  41           HZ3      LYS  41  91.978  10.823   0.668
  339    HA   PRO  42           HA       PRO  42  84.328  13.241   0.675
  340    HB2  PRO  42           HB2      PRO  42  83.732  11.123   2.277
  341    HB3  PRO  42           HB1      PRO  42  83.795  10.989   0.509
  342    HG2  PRO  42           HG2      PRO  42  85.815  10.173   2.533
  343    HG3  PRO  42           HG1      PRO  42  85.321   9.361   1.039
  344    HD2  PRO  42           HD2      PRO  42  87.615  10.885   1.275
  345    HD3  PRO  42           HD1      PRO  42  86.771  10.593  -0.262
  346    HA   PRO  43           HA       PRO  43  84.582  15.363   4.538
  347    HB2  PRO  43           HB2      PRO  43  82.204  14.478   5.780
  348    HB3  PRO  43           HB1      PRO  43  82.368  15.882   4.712
  349    HG2  PRO  43           HG2      PRO  43  81.385  13.158   4.108
  350    HG3  PRO  43           HG1      PRO  43  80.901  14.718   3.423
  351    HD2  PRO  43           HD2      PRO  43  82.456  12.981   2.042
  352    HD3  PRO  43           HD1      PRO  43  82.656  14.742   1.885
  353    H    LYS  44           HN       LYS  44  84.924  15.025   6.869
  354    HA   LYS  44           HA       LYS  44  85.739  13.798   8.693
  355    HB2  LYS  44           HB2      LYS  44  83.403  12.584   8.006
  356    HB3  LYS  44           HB1      LYS  44  84.521  11.246   7.757
  357    HG2  LYS  44           HG2      LYS  44  84.367  12.907  10.292
  358    HG3  LYS  44           HG1      LYS  44  83.621  11.321  10.087
  359    HD2  LYS  44           HD2      LYS  44  85.878  10.381   9.556
  360    HD3  LYS  44           HD1      LYS  44  86.581  11.957   9.920
  361    HE2  LYS  44           HE2      LYS  44  85.164  10.065  11.800
  362    HE3  LYS  44           HE1      LYS  44  86.791  10.731  11.941
  363    HZ1  LYS  44           HZ1      LYS  44  85.719  12.960  12.117
  364    HZ2  LYS  44           HZ2      LYS  44  85.404  11.921  13.424
  365    HZ3  LYS  44           HZ3      LYS  44  84.219  12.177  12.234
  366    H    LYS  45           HN       LYS  45  87.234  13.945   6.185
  367    HA   LYS  45           HA       LYS  45  88.882  12.755   4.940
  368    HB2  LYS  45           HB2      LYS  45  90.614  11.871   6.749
  369    HB3  LYS  45           HB1      LYS  45  90.349  13.599   6.527
  370    HG2  LYS  45           HG2      LYS  45  88.714  13.597   8.373
  371    HG3  LYS  45           HG1      LYS  45  88.960  11.864   8.593
  372    HD2  LYS  45           HD2      LYS  45  91.370  12.295   9.053
  373    HD3  LYS  45           HD1      LYS  45  91.059  14.027   8.927
  374    HE2  LYS  45           HE2      LYS  45  91.034  13.278  11.286
  375    HE3  LYS  45           HE1      LYS  45  89.457  13.889  10.789
  376    HZ1  LYS  45           HZ1      LYS  45  89.531  11.690  12.039
  377    HZ2  LYS  45           HZ2      LYS  45  90.127  11.019  10.597
  378    HZ3  LYS  45           HZ3      LYS  45  88.594  11.750  10.626
  379    H    GLY  46           HN       GLY  46  87.547  11.014   4.089
  380    HA2  GLY  46           HA2      GLY  46  87.625   8.466   5.622
  381    HA3  GLY  46           HA1      GLY  46  86.620   8.775   4.206
  382    H    VAL  47           HN       VAL  47  89.750   9.966   3.746
  383    HA   VAL  47           HA       VAL  47  91.500   9.250   2.367
  384    HB   VAL  47           HB       VAL  47  90.845   7.036   4.145
  385   HG11  VAL  47          HG11      VAL  47  91.960   6.343   1.410
  386   HG12  VAL  47          HG12      VAL  47  90.427   5.787   2.080
  387   HG13  VAL  47          HG13      VAL  47  91.947   5.256   2.799
  388   HG21  VAL  47          HG21      VAL  47  92.828   8.466   4.362
  389   HG22  VAL  47          HG22      VAL  47  93.399   7.943   2.777
  390   HG23  VAL  47          HG23      VAL  47  93.323   6.792   4.111
  391    H    GLN  48           HN       GLN  48  91.897   8.215   0.282
  392    HA   GLN  48           HA       GLN  48  91.261   7.450  -1.839
  393    HB2  GLN  48           HB2      GLN  48  90.121   5.644  -0.293
  394    HB3  GLN  48           HB1      GLN  48  88.633   6.475  -0.747
  395    HG2  GLN  48           HG2      GLN  48  89.378   6.238  -3.168
  396    HG3  GLN  48           HG1      GLN  48  90.644   5.157  -2.584
  397   HE21  GLN  48          HE21      GLN  48  89.869   3.122  -3.279
  398   HE22  GLN  48          HE22      GLN  48  88.352   2.492  -2.850
  399    H    GLY  49           HN       GLY  49  89.795   8.080  -3.582
  400    HA2  GLY  49           HA2      GLY  49  88.515  10.671  -3.018
  401    HA3  GLY  49           HA1      GLY  49  88.774   9.970  -4.616
  402    H1U  RCY  50           H1U      RCY  50  87.067   4.235  -1.475
  403    H1S  RCY  50           H1S      RCY  50  85.100   7.684  -2.409
  404    HB1  RCY  50           HB1      RCY  50  82.971  10.731  -2.727
  405    HB2  RCY  50           HB2      RCY  50  84.535  11.055  -1.981
  406    HA   RCY  50           HA       RCY  50  84.564   8.663  -3.678
  407    HN1  RCY  50           HN1      RCY  50  86.291  11.112  -3.669
  408    H    GLY  51           HN       GLY  51  85.554  11.377  -5.405
  409    HA2  GLY  51           HA2      GLY  51  84.840  12.043  -7.564
  410    HA3  GLY  51           HA1      GLY  51  83.481  10.928  -7.424
  411    H    ASP  52           HN       ASP  52  84.268  14.156  -7.530
  412    HA   ASP  52           HA       ASP  52  81.936  14.988  -5.863
  413    HB2  ASP  52           HB2      ASP  52  83.956  16.204  -5.333
  414    HB3  ASP  52           HB1      ASP  52  84.257  16.546  -7.037
  415    H    ASP  53           HN       ASP  53  83.078  14.727  -9.140
  416    HA   ASP  53           HA       ASP  53  81.114  16.572 -10.260
  417    HB2  ASP  53           HB2      ASP  53  81.822  15.523 -12.441
  418    HB3  ASP  53           HB1      ASP  53  83.156  16.192 -11.501
  419    H    ILE  54           HN       ILE  54  79.134  15.742  -9.337
  420    HA   ILE  54           HA       ILE  54  78.018  13.503 -10.908
  421    HB   ILE  54           HB       ILE  54  77.017  12.602  -8.673
  422   HG12  ILE  54          HG12      ILE  54  79.038  13.003  -6.927
  423   HG13  ILE  54          HG11      ILE  54  79.083  14.549  -7.775
  424   HG21  ILE  54          HG21      ILE  54  78.951  11.128  -8.365
  425   HG22  ILE  54          HG22      ILE  54  79.980  12.265  -9.237
  426   HG23  ILE  54          HG23      ILE  54  78.688  11.415 -10.086
  427   HD11  ILE  54          HD11      ILE  54  76.446  14.413  -7.422
  428   HD12  ILE  54          HD12      ILE  54  77.504  15.044  -6.160
  429   HD13  ILE  54          HD13      ILE  54  76.920  13.382  -6.072
  430    HA   PRO  55           HA       PRO  55  74.489  16.172 -10.821
  431    HB2  PRO  55           HB2      PRO  55  72.459  14.359 -11.166
  432    HB3  PRO  55           HB1      PRO  55  73.557  14.850 -12.470
  433    HG2  PRO  55           HG2      PRO  55  73.610  12.396 -10.786
  434    HG3  PRO  55           HG1      PRO  55  73.928  12.585 -12.519
  435    HD2  PRO  55           HD2      PRO  55  75.930  12.339 -10.673
  436    HD3  PRO  55           HD1      PRO  55  76.122  13.259 -12.182
  437    H    GLY  56           HN       GLY  56  74.467  13.365  -8.671
  438    HA2  GLY  56           HA2      GLY  56  72.220  14.031  -7.076
  439    HA3  GLY  56           HA1      GLY  56  73.612  13.112  -6.501
  440    H    MET  57           HN       MET  57  75.471  14.348  -5.687
  441    HA   MET  57           HA       MET  57  76.438  16.105  -4.463
  442    HB2  MET  57           HB2      MET  57  75.430  17.355  -6.610
  443    HB3  MET  57           HB1      MET  57  74.359  18.049  -5.396
  444    HG2  MET  57           HG2      MET  57  77.361  18.004  -5.038
  445    HG3  MET  57           HG1      MET  57  76.538  19.329  -5.862
  446    HE1  MET  57           HE1      MET  57  77.162  18.684  -1.512
  447    HE2  MET  57           HE2      MET  57  78.279  18.924  -2.853
  448    HE3  MET  57           HE3      MET  57  77.337  17.439  -2.755
  449    H    GLU  58           HN       GLU  58  73.151  15.218  -4.230
  450    HA   GLU  58           HA       GLU  58  73.088  16.226  -1.418
  451    HB2  GLU  58           HB2      GLU  58  71.688  17.632  -3.047
  452    HB3  GLU  58           HB1      GLU  58  70.653  16.213  -3.212
  453    HG2  GLU  58           HG2      GLU  58  69.681  17.560  -1.481
  454    HG3  GLU  58           HG1      GLU  58  70.463  16.200  -0.675
  455    H    GLY  59           HN       GLY  59  71.905  14.865   0.022
  456    HA2  GLY  59           HA2      GLY  59  71.831  12.062  -0.791
  457    HA3  GLY  59           HA1      GLY  59  71.425  12.686   0.809
  458    H1U  RCY  60           H1U      RCY  60  71.353   9.891   0.672
  459    H1S  RCY  60           H1S      RCY  60  70.318  10.779  -3.964
  460    HB1  RCY  60           HB1      RCY  60  66.531  12.236  -2.870
  461    HB2  RCY  60           HB2      RCY  60  67.798  11.391  -1.981
  462    HA   RCY  60           HA       RCY  60  67.589  14.395  -2.357
  463    HN1  RCY  60           HN1      RCY  60  69.864  14.279  -1.788
  464    H    GLY  61           HN       GLY  61  68.102  14.927   0.352
  465    HA2  GLY  61           HA2      GLY  61  66.592  15.359   2.155
  466    HA3  GLY  61           HA1      GLY  61  65.513  14.120   1.517
  467    H    THR  62           HN       THR  62  68.974  13.960   2.430
  468    HA   THR  62           HA       THR  62  68.317  12.235   4.724
  469    HB   THR  62           HB       THR  62  69.809  10.388   3.856
  470    HG1  THR  62           HG1      THR  62  70.779  10.747   2.051
  471   HG21  THR  62          HG21      THR  62  68.064   9.336   2.608
  472   HG22  THR  62          HG22      THR  62  67.422  10.888   2.070
  473   HG23  THR  62          HG23      THR  62  67.262  10.406   3.759
  474    H    ASP  63           HN       ASP  63  69.416  14.210   5.624
  475    HA   ASP  63           HA       ASP  63  72.185  14.750   5.036
  476    HB2  ASP  63           HB2      ASP  63  70.723  16.410   6.129
  477    HB3  ASP  63           HB1      ASP  63  70.577  15.358   7.537
  478    H    ILE  64           HN       ILE  64  70.658  12.222   6.728
  479    HA   ILE  64           HA       ILE  64  72.750  11.695   8.670
  480    HB   ILE  64           HB       ILE  64  70.558   9.935   7.560
  481   HG12  ILE  64          HG12      ILE  64  70.152  12.096   9.035
  482   HG13  ILE  64          HG11      ILE  64  69.273  10.606   9.383
  483   HG21  ILE  64          HG21      ILE  64  72.175   8.425   8.383
  484   HG22  ILE  64          HG22      ILE  64  71.094   8.663   9.757
  485   HG23  ILE  64          HG23      ILE  64  72.643   9.505   9.697
  486   HD11  ILE  64          HD11      ILE  64  70.672  10.067  11.209
  487   HD12  ILE  64          HD12      ILE  64  70.424  11.806  11.367
  488   HD13  ILE  64          HD13      ILE  64  71.930  11.188  10.688
  489    H    THR  65           HN       THR  65  72.707  11.460   5.363
  490    HA   THR  65           HA       THR  65  73.665   9.537   4.044
  491    HB   THR  65           HB       THR  65  75.917  11.356   4.893
  492    HG1  THR  65           HG1      THR  65  74.935  12.972   3.969
  493   HG21  THR  65          HG21      THR  65  75.152  10.288   2.167
  494   HG22  THR  65          HG22      THR  65  76.269   9.455   3.248
  495   HG23  THR  65          HG23      THR  65  76.668  11.060   2.634
  496    H    VAL  66           HN       VAL  66  76.031  10.428   6.576
  497    HA   VAL  66           HA       VAL  66  77.711   8.336   6.673
  498    HB   VAL  66           HB       VAL  66  76.330   8.966   9.271
  499   HG11  VAL  66          HG11      VAL  66  79.276   8.950   8.617
  500   HG12  VAL  66          HG12      VAL  66  78.405   7.454   8.954
  501   HG13  VAL  66          HG13      VAL  66  78.499   8.716  10.183
  502   HG21  VAL  66          HG21      VAL  66  77.963  10.838   7.545
  503   HG22  VAL  66          HG22      VAL  66  77.819  11.056   9.289
  504   HG23  VAL  66          HG23      VAL  66  76.382  11.132   8.269
  505    H    ILE  67           HN       ILE  67  74.853   7.983   8.804
  506    HA   ILE  67           HA       ILE  67  74.511   5.225   7.708
  507    HB   ILE  67           HB       ILE  67  74.559   5.903  10.661
  508   HG12  ILE  67          HG12      ILE  67  76.483   4.236   9.010
  509   HG13  ILE  67          HG11      ILE  67  76.803   5.889   9.537
  510   HG21  ILE  67          HG21      ILE  67  74.418   3.412  10.892
  511   HG22  ILE  67          HG22      ILE  67  74.164   3.303   9.151
  512   HG23  ILE  67          HG23      ILE  67  72.977   4.121  10.165
  513   HD11  ILE  67          HD11      ILE  67  76.479   5.149  11.903
  514   HD12  ILE  67          HD12      ILE  67  77.835   4.344  11.113
  515   HD13  ILE  67          HD13      ILE  67  76.306   3.492  11.326
  516    H1U  RCY  68           H1U      RCY  68  74.345   2.400   2.888
  517    H1S  RCY  68           H1S      RCY  68  73.452   5.921   5.308
  518    HB1  RCY  68           HB1      RCY  68  69.787   8.054   6.353
  519    HB2  RCY  68           HB2      RCY  68  69.618   6.466   5.605
  520    HA   RCY  68           HA       RCY  68  70.424   7.100   8.300
  521    HN1  RCY  68           HN1      RCY  68  72.626   6.043   6.641
  522    HA   PRO  69           HA       PRO  69  68.160   3.439   9.140
  523    HB2  PRO  69           HB2      PRO  69  65.822   3.972   7.557
  524    HB3  PRO  69           HB1      PRO  69  66.034   4.221   9.298
  525    HG2  PRO  69           HG2      PRO  69  66.182   6.154   7.097
  526    HG3  PRO  69           HG1      PRO  69  65.840   6.413   8.814
  527    HD2  PRO  69           HD2      PRO  69  68.193   7.168   7.664
  528    HD3  PRO  69           HD1      PRO  69  68.085   6.653   9.364
  529    H    TRP  70           HN       TRP  70  68.384   4.420   5.760
  530    HA   TRP  70           HA       TRP  70  67.581   1.938   4.579
  531    HD1  TRP  70           HD1      TRP  70  66.842   1.833   1.897
  532    HE1  TRP  70           HE1      TRP  70  64.732   3.121   1.170
  533    HE3  TRP  70           HE3      TRP  70  67.833   6.393   3.972
  534    HZ2  TRP  70           HZ2      TRP  70  63.610   5.743   1.433
  535    HZ3  TRP  70           HZ3      TRP  70  66.232   8.263   3.719
  536    HH2  TRP  70           HH2      TRP  70  64.124   7.948   2.455
  537    HB2  TRP  70           HB2      TRP  70  69.204   4.299   3.693
  538    HB3  TRP  70           HB1      TRP  70  69.281   2.828   2.725
  539    H    GLU  71           HN       GLU  71  70.522   2.976   6.138
  540    HA   GLU  71           HA       GLU  71  72.124   0.763   5.082
  541    HB2  GLU  71           HB2      GLU  71  72.646   2.708   7.352
  542    HB3  GLU  71           HB1      GLU  71  73.824   1.565   6.705
  543    HG2  GLU  71           HG2      GLU  71  73.319   2.661   4.410
  544    HG3  GLU  71           HG1      GLU  71  72.606   3.970   5.354
  545    H    ALA  72           HN       ALA  72  69.616   0.821   7.184
  546    HA   ALA  72           HA       ALA  72  70.697  -0.844   9.318
  547    HB1  ALA  72           HB1      ALA  72  68.386  -1.037  10.058
  548    HB2  ALA  72           HB2      ALA  72  67.804  -0.429   8.509
  549    HB3  ALA  72           HB3      ALA  72  68.692   0.638   9.597
  550    H1U  RCY  73           H1U      RCY  73  74.578   0.108   0.856
  551    H1S  RCY  73           H1S      RCY  73  72.821  -1.835   4.696
  552    HB1  RCY  73           HB1      RCY  73  70.988  -2.757   4.448
  553    HB2  RCY  73           HB2      RCY  73  70.703  -4.482   4.229
  554    HA   RCY  73           HA       RCY  73  69.365  -4.018   6.086
  555    HN1  RCY  73           HN1      RCY  73  71.192  -1.815   6.608
  556    H    ASN  74           HN       ASN  74  72.435  -3.626   7.782
  557    HA   ASN  74           HA       ASN  74  73.552  -5.076   9.244
  558    HB2  ASN  74           HB2      ASN  74  71.041  -5.325   9.992
  559    HB3  ASN  74           HB1      ASN  74  71.162  -6.908   9.226
  560   HD21  ASN  74          HD21      ASN  74  70.799  -7.417  11.734
  561   HD22  ASN  74          HD22      ASN  74  72.221  -7.643  12.634
  562    H    HIS  75           HN       HIS  75  71.496  -7.385   7.436
  563    HA   HIS  75           HA       HIS  75  73.778  -9.115   6.931
  564    HD1  HIS  75           HD1      HIS  75  73.760 -11.016   7.702
  565    HD2  HIS  75           HD2      HIS  75  69.607 -10.722   7.953
  566    HE1  HIS  75           HE1      HIS  75  73.058 -12.455   9.665
  567    HE2  HIS  75           HE2      HIS  75  70.532 -12.285   9.828
  568    HB2  HIS  75           HB2      HIS  75  70.884  -9.107   6.088
  569    HB3  HIS  75           HB1      HIS  75  72.024 -10.221   5.333
  570    H1U  RCY  76           H1U      RCY  76  68.642  -5.150   2.785
  571    H1S  RCY  76           H1S      RCY  76  72.613  -6.652   2.122
  572    HB1  RCY  76           HB1      RCY  76  76.412  -7.312   2.716
  573    HB2  RCY  76           HB2      RCY  76  75.587  -6.965   4.233
  574    HA   RCY  76           HA       RCY  76  73.718  -8.136   2.370
  575    HN1  RCY  76           HN1      RCY  76  74.289  -9.783   4.604
  576    H    GLU  77           HN       GLU  77  73.827 -10.051   1.200
  577    HA   GLU  77           HA       GLU  77  75.750 -12.094   1.428
  578    HB2  GLU  77           HB2      GLU  77  74.497 -11.179  -1.176
  579    HB3  GLU  77           HB1      GLU  77  75.070 -12.799  -0.778
  580    HG2  GLU  77           HG2      GLU  77  72.760 -11.351   0.552
  581    HG3  GLU  77           HG1      GLU  77  72.627 -12.705  -0.571
  582    H    LEU  78           HN       LEU  78  77.772 -10.934   1.807
  583    HA   LEU  78           HA       LEU  78  79.385 -10.679  -0.553
  584    HG   LEU  78           HG       LEU  78  78.625  -9.219  -2.081
  585    HB2  LEU  78           HB2      LEU  78  77.920  -8.323   0.226
  586    HB3  LEU  78           HB1      LEU  78  79.633  -8.033   0.511
  587   HD11  LEU  78          HD11      LEU  78  78.778  -6.925  -3.018
  588   HD12  LEU  78          HD12      LEU  78  79.077  -6.298  -1.397
  589   HD13  LEU  78          HD13      LEU  78  77.526  -7.044  -1.782
  590   HD21  LEU  78          HD21      LEU  78  80.783  -8.543  -2.916
  591   HD22  LEU  78          HD22      LEU  78  81.061  -9.385  -1.392
  592   HD23  LEU  78          HD23      LEU  78  81.123  -7.623  -1.450
  593    H    HIS  79           HN       HIS  79  81.417 -11.177   0.118
  594    HA   HIS  79           HA       HIS  79  82.343 -10.255   2.783
  595    HD1  HIS  79           HD1      HIS  79  84.719 -11.031   3.127
  596    HD2  HIS  79           HD2      HIS  79  82.731 -14.115   5.110
  597    HE1  HIS  79           HE1      HIS  79  86.156 -11.642   5.121
  598    HE2  HIS  79           HE2      HIS  79  84.957 -13.518   6.337
  599    HB2  HIS  79           HB2      HIS  79  81.328 -12.518   3.108
  600    HB3  HIS  79           HB1      HIS  79  82.464 -13.162   1.923
  601    H    GLU  80           HN       GLU  80  83.817  -8.932   1.580
  602    HA   GLU  80           HA       GLU  80  86.153 -10.446   0.551
  603    HB2  GLU  80           HB2      GLU  80  86.244  -8.741  -1.379
  604    HB3  GLU  80           HB1      GLU  80  85.045 -10.026  -1.505
  605    HG2  GLU  80           HG2      GLU  80  83.301  -8.535  -0.668
  606    HG3  GLU  80           HG1      GLU  80  84.484  -7.252  -0.416
  607    H    LEU  81           HN       LEU  81  86.339  -7.258  -0.409
  608    HA   LEU  81           HA       LEU  81  88.343  -6.617   1.545
  609    HG   LEU  81           HG       LEU  81  85.603  -5.179  -0.182
  610    HB2  LEU  81           HB2      LEU  81  88.068  -4.259   0.593
  611    HB3  LEU  81           HB1      LEU  81  88.514  -5.514  -0.560
  612   HD11  LEU  81          HD11      LEU  81  86.066  -2.848  -0.079
  613   HD12  LEU  81          HD12      LEU  81  85.670  -3.158  -1.769
  614   HD13  LEU  81          HD13      LEU  81  87.353  -2.972  -1.278
  615   HD21  LEU  81          HD21      LEU  81  85.576  -5.601  -2.527
  616   HD22  LEU  81          HD22      LEU  81  86.882  -6.606  -1.898
  617   HD23  LEU  81          HD23      LEU  81  87.253  -5.088  -2.715
  618    H    ALA  82           HN       ALA  82  84.881  -6.120   1.418
  619    HA   ALA  82           HA       ALA  82  84.637  -4.045   3.351
  620    HB1  ALA  82           HB1      ALA  82  82.351  -4.771   3.608
  621    HB2  ALA  82           HB2      ALA  82  82.738  -6.381   3.002
  622    HB3  ALA  82           HB3      ALA  82  82.780  -4.995   1.913
  623    H    GLN  83           HN       GLN  83  84.707  -7.585   3.747
  624    HA   GLN  83           HA       GLN  83  85.211  -8.905   5.603
  625    HB2  GLN  83           HB2      GLN  83  87.319  -7.679   5.603
  626    HB3  GLN  83           HB1      GLN  83  86.580  -6.349   6.492
  627    HG2  GLN  83           HG2      GLN  83  87.889  -7.906   7.957
  628    HG3  GLN  83           HG1      GLN  83  86.191  -7.782   8.417
  629   HE21  GLN  83          HE21      GLN  83  85.228  -9.778   8.785
  630   HE22  GLN  83          HE22      GLN  83  85.690 -11.237   8.051
  631    H    TYR  84           HN       TYR  84  83.581  -5.858   6.126
  632    HA   TYR  84           HA       TYR  84  82.177  -7.117   8.440
  633    HD1  TYR  84           HD1      TYR  84  82.908  -6.974  10.859
  634    HD2  TYR  84           HD2      TYR  84  81.033  -3.314   9.620
  635    HE1  TYR  84           HE1      TYR  84  81.526  -6.985  12.918
  636    HE2  TYR  84           HE2      TYR  84  79.651  -3.325  11.679
  637    HH   TYR  84           HH       TYR  84  79.244  -5.989  13.604
  638    HB2  TYR  84           HB2      TYR  84  83.930  -5.341   9.108
  639    HB3  TYR  84           HB1      TYR  84  82.834  -4.168   8.380
  640    H    GLY  85           HN       GLY  85  81.886  -3.929   6.856
  641    HA2  GLY  85           HA2      GLY  85  79.594  -4.652   5.278
  642    HA3  GLY  85           HA1      GLY  85  79.074  -3.905   6.789
  643    H    ILE  86           HN       ILE  86  81.558  -2.214   6.854
  644    HA   ILE  86           HA       ILE  86  80.547  -0.117   5.011
  645    HB   ILE  86           HB       ILE  86  80.858   0.425   7.418
  646   HG12  ILE  86          HG12      ILE  86  81.507   1.959   5.258
  647   HG13  ILE  86          HG11      ILE  86  81.530   2.553   6.919
  648   HG21  ILE  86          HG21      ILE  86  83.727  -0.288   6.769
  649   HG22  ILE  86          HG22      ILE  86  82.697  -0.995   8.013
  650   HG23  ILE  86          HG23      ILE  86  83.274   0.662   8.184
  651   HD11  ILE  86          HD11      ILE  86  83.949   1.183   5.767
  652   HD12  ILE  86          HD12      ILE  86  83.859   2.331   7.103
  653   HD13  ILE  86          HD13      ILE  86  83.656   2.891   5.443
  654    H1U  RCY  87           H1U      RCY  87  77.677   3.786   0.268
  655    H1S  RCY  87           H1S      RCY  87  81.371   1.452   2.173
  656    HB1  RCY  87           HB1      RCY  87  83.075   1.037   1.025
  657    HB2  RCY  87           HB2      RCY  87  84.698   1.671   1.295
  658    HA   RCY  87           HA       RCY  87  84.059  -0.583   2.427
  659    HN1  RCY  87           HN1      RCY  87  82.227   1.205   3.834
  Start of MODEL   71
    1    HA   MET   1           HA       MET   1  56.338  -9.450  25.160
    2    HB2  MET   1           HB2      MET   1  54.651 -10.785  23.034
    3    HB3  MET   1           HB1      MET   1  56.236 -11.404  23.501
    4    HG2  MET   1           HG2      MET   1  54.516 -12.549  24.800
    5    HG3  MET   1           HG1      MET   1  55.455 -11.508  25.870
    6    HE1  MET   1           HE1      MET   1  53.017 -12.491  27.044
    7    HE2  MET   1           HE2      MET   1  52.194 -12.808  25.519
    8    HE3  MET   1           HE3      MET   1  51.457 -11.732  26.703
    9    H    ASN   2           HN       ASN   2  57.252  -7.311  24.257
   10    HA   ASN   2           HA       ASN   2  57.860  -7.251  21.404
   11    HB2  ASN   2           HB2      ASN   2  57.673  -5.279  23.176
   12    HB3  ASN   2           HB1      ASN   2  59.388  -5.617  23.406
   13   HD21  ASN   2          HD21      ASN   2  57.880  -3.307  21.984
   14   HD22  ASN   2          HD22      ASN   2  58.630  -3.217  20.464
   15    H    LEU   3           HN       LEU   3  60.471  -6.672  21.124
   16    HA   LEU   3           HA       LEU   3  62.287  -8.300  22.639
   17    HG   LEU   3           HG       LEU   3  62.155 -10.543  22.839
   18    HB2  LEU   3           HB2      LEU   3  60.689  -9.798  20.920
   19    HB3  LEU   3           HB1      LEU   3  62.153  -9.551  19.974
   20   HD11  LEU   3          HD11      LEU   3  61.046 -12.189  21.404
   21   HD12  LEU   3          HD12      LEU   3  62.658 -12.764  21.833
   22   HD13  LEU   3          HD13      LEU   3  62.361 -12.083  20.233
   23   HD21  LEU   3          HD21      LEU   3  64.481 -11.122  22.343
   24   HD22  LEU   3          HD22      LEU   3  64.219  -9.410  22.010
   25   HD23  LEU   3          HD23      LEU   3  64.289 -10.566  20.681
   26    H    GLU   4           HN       GLU   4  63.927  -8.944  20.237
   27    HA   GLU   4           HA       GLU   4  65.506  -6.645  20.040
   28    HB2  GLU   4           HB2      GLU   4  65.136  -9.105  18.422
   29    HB3  GLU   4           HB1      GLU   4  65.876  -7.757  17.562
   30    HG2  GLU   4           HG2      GLU   4  67.547  -7.533  19.385
   31    HG3  GLU   4           HG1      GLU   4  66.828  -8.926  20.194
   32    HA   PRO   5           HA       PRO   5  63.741  -3.393  17.672
   33    HB2  PRO   5           HB2      PRO   5  65.517  -4.306  15.423
   34    HB3  PRO   5           HB1      PRO   5  65.209  -2.659  16.008
   35    HG2  PRO   5           HG2      PRO   5  67.413  -4.051  16.681
   36    HG3  PRO   5           HG1      PRO   5  66.659  -2.867  17.760
   37    HD2  PRO   5           HD2      PRO   5  66.803  -5.781  18.053
   38    HD3  PRO   5           HD1      PRO   5  66.322  -4.560  19.251
   39    HA   PRO   6           HA       PRO   6  60.544  -5.318  15.282
   40    HB2  PRO   6           HB2      PRO   6  59.706  -3.208  13.732
   41    HB3  PRO   6           HB1      PRO   6  59.323  -3.375  15.456
   42    HG2  PRO   6           HG2      PRO   6  61.411  -1.712  14.141
   43    HG3  PRO   6           HG1      PRO   6  60.365  -1.332  15.520
   44    HD2  PRO   6           HD2      PRO   6  62.978  -2.070  15.819
   45    HD3  PRO   6           HD1      PRO   6  61.733  -2.429  17.037
   46    H    LYS   7           HN       LYS   7  60.607  -6.621  13.508
   47    HA   LYS   7           HA       LYS   7  62.313  -5.779  11.191
   48    HB2  LYS   7           HB2      LYS   7  61.641  -8.629  11.958
   49    HB3  LYS   7           HB1      LYS   7  62.878  -8.074  10.830
   50    HG2  LYS   7           HG2      LYS   7  63.888  -6.829  12.865
   51    HG3  LYS   7           HG1      LYS   7  62.864  -7.883  13.840
   52    HD2  LYS   7           HD2      LYS   7  63.882  -9.825  12.479
   53    HD3  LYS   7           HD1      LYS   7  65.106  -8.659  11.975
   54    HE2  LYS   7           HE2      LYS   7  66.074  -9.612  13.888
   55    HE3  LYS   7           HE1      LYS   7  65.322  -8.151  14.528
   56    HZ1  LYS   7           HZ1      LYS   7  64.651 -10.922  14.981
   57    HZ2  LYS   7           HZ2      LYS   7  63.312  -9.925  14.663
   58    HZ3  LYS   7           HZ3      LYS   7  64.359  -9.561  15.951
   59    H    ALA   8           HN       ALA   8  60.901  -8.546  10.274
   60    HA   ALA   8           HA       ALA   8  58.188  -8.160   9.841
   61    HB1  ALA   8           HB1      ALA   8  58.243  -6.129   8.742
   62    HB2  ALA   8           HB2      ALA   8  58.501  -7.184   7.353
   63    HB3  ALA   8           HB3      ALA   8  59.875  -6.392   8.126
   64    H    GLU   9           HN       GLU   9  61.116  -9.585   9.172
   65    HA   GLU   9           HA       GLU   9  61.658 -11.608   8.114
   66    HB2  GLU   9           HB2      GLU   9  59.258 -12.144   9.031
   67    HB3  GLU   9           HB1      GLU   9  58.768 -11.974   7.345
   68    HG2  GLU   9           HG2      GLU   9  59.274 -14.291   7.651
   69    HG3  GLU   9           HG1      GLU   9  60.642 -13.607   6.771
   70    H1U  RCY  10           H1U      RCY  10  61.316  -8.116  -1.111
   71    H1S  RCY  10           H1S      RCY  10  61.725 -11.485   2.359
   72    HB1  RCY  10           HB1      RCY  10  58.484 -10.384   2.624
   73    HB2  RCY  10           HB2      RCY  10  58.014 -11.163   4.135
   74    HA   RCY  10           HA       RCY  10  60.787 -10.047   3.896
   75    HN1  RCY  10           HN1      RCY  10  58.952 -10.170   6.256
   76    H    ARG  11           HN       ARG  11  59.079  -8.716   2.161
   77    HA   ARG  11           HA       ARG  11  58.386  -6.205   3.642
   78    HE   ARG  11           HE       ARG  11  60.611  -3.260   3.259
   79    HB2  ARG  11           HB2      ARG  11  59.542  -6.267   0.846
   80    HB3  ARG  11           HB1      ARG  11  59.356  -4.875   1.909
   81    HG2  ARG  11           HG2      ARG  11  61.062  -7.220   2.733
   82    HG3  ARG  11           HG1      ARG  11  61.717  -5.945   1.704
   83    HD2  ARG  11           HD2      ARG  11  60.321  -5.362   4.323
   84    HD3  ARG  11           HD1      ARG  11  62.062  -5.625   4.212
   85   HH11  ARG  11          HH21      ARG  11  63.426  -5.245   3.113
   86   HH12  ARG  11          HH22      ARG  11  64.448  -3.981   2.514
   87   HH21  ARG  11          HH11      ARG  11  61.929  -1.598   2.478
   88   HH22  ARG  11          HH12      ARG  11  63.601  -1.917   2.155
   89    H    SER  12           HN       SER  12  56.524  -5.146   2.916
   90    HA   SER  12           HA       SER  12  54.417  -6.630   1.838
   91    HG   SER  12           HG       SER  12  53.623  -5.453   3.419
   92    HB2  SER  12           HB2      SER  12  54.945  -3.653   1.737
   93    HB3  SER  12           HB1      SER  12  53.431  -4.373   1.197
   94    H    ALA  13           HN       ALA  13  54.394  -7.655  -0.102
   95    HA   ALA  13           HA       ALA  13  54.746  -8.068  -2.388
   96    HB1  ALA  13           HB1      ALA  13  54.534  -5.059  -2.649
   97    HB2  ALA  13           HB2      ALA  13  53.133  -6.103  -2.408
   98    HB3  ALA  13           HB3      ALA  13  54.121  -6.275  -3.859
   99    H    THR  14           HN       THR  14  57.032  -8.618  -1.804
  100    HA   THR  14           HA       THR  14  59.065  -6.560  -2.326
  101    HB   THR  14           HB       THR  14  59.611  -9.516  -2.061
  102    HG1  THR  14           HG1      THR  14  58.204  -8.908  -0.377
  103   HG21  THR  14          HG21      THR  14  61.654  -8.649  -0.949
  104   HG22  THR  14          HG22      THR  14  61.087  -7.003  -1.226
  105   HG23  THR  14          HG23      THR  14  61.490  -8.038  -2.595
  106    H    ARG  15           HN       ARG  15  57.277  -7.115  -4.523
  107    HA   ARG  15           HA       ARG  15  58.496  -8.902  -6.422
  108    HE   ARG  15           HE       ARG  15  54.858 -10.503  -9.323
  109    HB2  ARG  15           HB2      ARG  15  56.109  -7.765  -6.388
  110    HB3  ARG  15           HB1      ARG  15  56.926  -6.489  -7.285
  111    HG2  ARG  15           HG2      ARG  15  56.169  -7.909  -8.996
  112    HG3  ARG  15           HG1      ARG  15  57.835  -8.440  -8.764
  113    HD2  ARG  15           HD2      ARG  15  57.186 -10.367  -7.576
  114    HD3  ARG  15           HD1      ARG  15  55.586  -9.718  -7.218
  115   HH11  ARG  15          HH21      ARG  15  58.295 -10.381  -9.088
  116   HH12  ARG  15          HH22      ARG  15  58.560 -11.184 -10.599
  117   HH21  ARG  15          HH11      ARG  15  55.184 -11.553 -11.298
  118   HH22  ARG  15          HH12      ARG  15  56.799 -11.848 -11.851
  119    H    VAL  16           HN       VAL  16  58.449  -6.754  -8.589
  120    HA   VAL  16           HA       VAL  16  60.796  -5.106  -7.906
  121    HB   VAL  16           HB       VAL  16  62.008  -6.000  -9.978
  122   HG11  VAL  16          HG11      VAL  16  61.625  -7.999  -7.733
  123   HG12  VAL  16          HG12      VAL  16  62.582  -6.527  -7.568
  124   HG13  VAL  16          HG13      VAL  16  63.065  -7.767  -8.725
  125   HG21  VAL  16          HG21      VAL  16  60.053  -8.280  -9.532
  126   HG22  VAL  16          HG22      VAL  16  61.406  -8.289 -10.663
  127   HG23  VAL  16          HG23      VAL  16  60.048  -7.194 -10.921
  128    H    MET  17           HN       MET  17  60.741  -3.209  -9.059
  129    HA   MET  17           HA       MET  17  58.456  -2.516 -10.603
  130    HB2  MET  17           HB2      MET  17  60.070  -0.611 -11.420
  131    HB3  MET  17           HB1      MET  17  59.600  -0.672  -9.721
  132    HG2  MET  17           HG2      MET  17  61.668  -1.640  -9.069
  133    HG3  MET  17           HG1      MET  17  62.083  -2.067 -10.729
  134    HE1  MET  17           HE1      MET  17  63.538  -0.873 -12.106
  135    HE2  MET  17           HE2      MET  17  64.446  -1.026 -10.604
  136    HE3  MET  17           HE3      MET  17  64.504   0.483 -11.511
  137    H    GLY  18           HN       GLY  18  61.362  -1.781 -12.311
  138    HA2  GLY  18           HA2      GLY  18  62.304  -3.115 -14.165
  139    HA3  GLY  18           HA1      GLY  18  60.710  -3.840 -14.378
  140    H    GLY  19           HN       GLY  19  59.829  -0.834 -13.773
  141    HA2  GLY  19           HA2      GLY  19  59.530  -0.177 -16.614
  142    HA3  GLY  19           HA1      GLY  19  58.862   0.742 -15.262
  143    HA   PRO  20           HA       PRO  20  62.887   2.549 -17.428
  144    HB2  PRO  20           HB2      PRO  20  60.858   4.749 -17.631
  145    HB3  PRO  20           HB1      PRO  20  62.168   4.321 -18.748
  146    HG2  PRO  20           HG2      PRO  20  59.619   3.657 -19.226
  147    HG3  PRO  20           HG1      PRO  20  60.972   2.626 -19.716
  148    HD2  PRO  20           HD2      PRO  20  58.974   2.185 -17.578
  149    HD3  PRO  20           HD1      PRO  20  60.002   1.006 -18.420
  150    H1U  RCY  21           H1U      RCY  21  66.394   2.854  -6.946
  151    H1S  RCY  21           H1S      RCY  21  64.804   2.711 -11.084
  152    HB1  RCY  21           HB1      RCY  21  65.870   4.642 -13.980
  153    HB2  RCY  21           HB2      RCY  21  64.689   3.342 -13.826
  154    HA   RCY  21           HA       RCY  21  62.985   5.413 -13.924
  155    HN1  RCY  21           HN1      RCY  21  64.094   4.350 -16.479
  156    H    THR  22           HN       THR  22  63.455   7.560 -13.635
  157    HA   THR  22           HA       THR  22  65.279   8.830 -15.638
  158    HB   THR  22           HB       THR  22  63.203   9.839 -15.965
  159    HG1  THR  22           HG1      THR  22  64.016  11.442 -13.810
  160   HG21  THR  22          HG21      THR  22  61.905   8.761 -14.283
  161   HG22  THR  22          HG22      THR  22  61.752  10.488 -13.961
  162   HG23  THR  22          HG23      THR  22  62.840   9.502 -12.984
  163    HA   PRO  23           HA       PRO  23  67.870   9.057 -11.847
  164    HB2  PRO  23           HB2      PRO  23  69.458  10.616 -13.859
  165    HB3  PRO  23           HB1      PRO  23  70.004   9.387 -12.700
  166    HG2  PRO  23           HG2      PRO  23  69.702   8.816 -15.279
  167    HG3  PRO  23           HG1      PRO  23  69.289   7.638 -14.022
  168    HD2  PRO  23           HD2      PRO  23  67.473   9.246 -15.759
  169    HD3  PRO  23           HD1      PRO  23  67.210   7.650 -15.021
  170    H    ARG  24           HN       ARG  24  69.055  11.101 -10.877
  171    HA   ARG  24           HA       ARG  24  67.152  13.393 -11.095
  172    HE   ARG  24           HE       ARG  24  65.948  10.941  -8.978
  173    HB2  ARG  24           HB2      ARG  24  68.007  11.984  -8.869
  174    HB3  ARG  24           HB1      ARG  24  69.048  13.402  -8.842
  175    HG2  ARG  24           HG2      ARG  24  67.126  14.072  -7.628
  176    HG3  ARG  24           HG1      ARG  24  66.888  14.766  -9.232
  177    HD2  ARG  24           HD2      ARG  24  64.875  13.546  -8.230
  178    HD3  ARG  24           HD1      ARG  24  65.350  13.051  -9.855
  179   HH11  ARG  24          HH21      ARG  24  65.601  13.332  -6.519
  180   HH12  ARG  24          HH22      ARG  24  65.757  12.204  -5.214
  181   HH21  ARG  24          HH11      ARG  24  66.153   9.454  -7.288
  182   HH22  ARG  24          HH12      ARG  24  66.069  10.008  -5.650
  183    H    LYS  25           HN       LYS  25  70.573  13.057 -10.134
  184    HA   LYS  25           HA       LYS  25  71.434  15.616 -10.789
  185    HB2  LYS  25           HB2      LYS  25  72.686  13.341  -9.945
  186    HB3  LYS  25           HB1      LYS  25  73.309  13.452 -11.588
  187    HG2  LYS  25           HG2      LYS  25  74.852  14.748 -10.394
  188    HG3  LYS  25           HG1      LYS  25  73.724  15.969 -10.984
  189    HD2  LYS  25           HD2      LYS  25  72.596  16.078  -8.873
  190    HD3  LYS  25           HD1      LYS  25  73.431  14.642  -8.281
  191    HE2  LYS  25           HE2      LYS  25  74.972  17.092  -9.125
  192    HE3  LYS  25           HE1      LYS  25  74.304  16.956  -7.498
  193    HZ1  LYS  25           HZ1      LYS  25  75.634  14.566  -8.276
  194    HZ2  LYS  25           HZ2      LYS  25  75.903  15.556  -6.921
  195    HZ3  LYS  25           HZ3      LYS  25  76.675  15.900  -8.395
  196    H    GLY  26           HN       GLY  26  72.142  12.890 -12.994
  197    HA2  GLY  26           HA2      GLY  26  71.020  13.212 -15.321
  198    HA3  GLY  26           HA1      GLY  26  71.801  14.794 -15.269
  199    HA   PRO  27           HA       PRO  27  75.742  13.571 -16.765
  200    HB2  PRO  27           HB2      PRO  27  76.810  13.593 -13.961
  201    HB3  PRO  27           HB1      PRO  27  77.487  14.328 -15.428
  202    HG2  PRO  27           HG2      PRO  27  76.193  15.779 -13.602
  203    HG3  PRO  27           HG1      PRO  27  76.078  16.137 -15.333
  204    HD2  PRO  27           HD2      PRO  27  74.029  14.984 -13.524
  205    HD3  PRO  27           HD1      PRO  27  73.818  15.854 -15.059
  206    HA   PRO  28           HA       PRO  28  75.283   9.080 -16.308
  207    HB2  PRO  28           HB2      PRO  28  77.978   9.241 -17.620
  208    HB3  PRO  28           HB1      PRO  28  76.595   8.198 -18.012
  209    HG2  PRO  28           HG2      PRO  28  77.166  10.361 -19.460
  210    HG3  PRO  28           HG1      PRO  28  75.494   9.865 -19.152
  211    HD2  PRO  28           HD2      PRO  28  76.999  12.171 -18.032
  212    HD3  PRO  28           HD1      PRO  28  75.247  11.963 -18.245
  213    H    LYS  29           HN       LYS  29  75.972   7.689 -14.697
  214    HA   LYS  29           HA       LYS  29  77.125   6.988 -12.778
  215    HB2  LYS  29           HB2      LYS  29  79.571   8.149 -14.131
  216    HB3  LYS  29           HB1      LYS  29  79.497   6.791 -13.007
  217    HG2  LYS  29           HG2      LYS  29  78.002   5.636 -14.742
  218    HG3  LYS  29           HG1      LYS  29  78.515   6.897 -15.864
  219    HD2  LYS  29           HD2      LYS  29  80.918   6.274 -15.234
  220    HD3  LYS  29           HD1      LYS  29  80.235   4.838 -14.471
  221    HE2  LYS  29           HE2      LYS  29  79.180   4.203 -16.614
  222    HE3  LYS  29           HE1      LYS  29  79.881   5.630 -17.377
  223    HZ1  LYS  29           HZ1      LYS  29  81.052   3.171 -17.160
  224    HZ2  LYS  29           HZ2      LYS  29  81.835   4.099 -15.972
  225    HZ3  LYS  29           HZ3      LYS  29  81.829   4.616 -17.590
  226    H1U  RCY  30           H1U      RCY  30  74.140  11.131  -5.476
  227    H1S  RCY  30           H1S      RCY  30  76.603   8.582  -8.102
  228    HB1  RCY  30           HB1      RCY  30  75.793   9.981 -10.010
  229    HB2  RCY  30           HB2      RCY  30  76.385  11.538  -9.432
  230    HA   RCY  30           HA       RCY  30  76.250  11.820 -11.773
  231    HN1  RCY  30           HN1      RCY  30  76.056   9.758 -12.903
  232    H    LYS  31           HN       LYS  31  78.078  12.775  -9.913
  233    HA   LYS  31           HA       LYS  31  80.331  13.410 -11.631
  234    HB2  LYS  31           HB2      LYS  31  79.899  14.009  -8.687
  235    HB3  LYS  31           HB1      LYS  31  81.126  14.746  -9.715
  236    HG2  LYS  31           HG2      LYS  31  78.247  14.871 -10.559
  237    HG3  LYS  31           HG1      LYS  31  78.831  15.987  -9.324
  238    HD2  LYS  31           HD2      LYS  31  80.416  15.644 -11.849
  239    HD3  LYS  31           HD1      LYS  31  78.973  16.658 -11.870
  240    HE2  LYS  31           HE2      LYS  31  81.085  16.998  -9.743
  241    HE3  LYS  31           HE1      LYS  31  81.228  17.799 -11.308
  242    HZ1  LYS  31           HZ1      LYS  31  80.047  19.016  -9.400
  243    HZ2  LYS  31           HZ2      LYS  31  78.735  17.995  -9.750
  244    HZ3  LYS  31           HZ3      LYS  31  79.337  19.047 -10.940
  245    H    GLN  32           HN       GLN  32  82.016  12.040 -11.906
  246    HA   GLN  32           HA       GLN  32  82.561   9.943  -9.922
  247    HB2  GLN  32           HB2      GLN  32  82.720   9.644 -12.457
  248    HB3  GLN  32           HB1      GLN  32  84.199  10.602 -12.379
  249    HG2  GLN  32           HG2      GLN  32  85.024   8.420 -12.185
  250    HG3  GLN  32           HG1      GLN  32  84.881   8.911 -10.496
  251   HE21  GLN  32          HE21      GLN  32  84.444   6.221 -12.160
  252   HE22  GLN  32          HE22      GLN  32  83.013   5.615 -11.475
  253    H    ARG  33           HN       ARG  33  83.841  10.352  -8.194
  254    HA   ARG  33           HA       ARG  33  86.393  11.704  -8.500
  255    HE   ARG  33           HE       ARG  33  81.314  13.782  -6.170
  256    HB2  ARG  33           HB2      ARG  33  85.803  13.505  -6.788
  257    HB3  ARG  33           HB1      ARG  33  85.115  13.723  -8.396
  258    HG2  ARG  33           HG2      ARG  33  82.995  12.729  -7.643
  259    HG3  ARG  33           HG1      ARG  33  83.677  12.467  -6.038
  260    HD2  ARG  33           HD2      ARG  33  83.805  14.790  -5.588
  261    HD3  ARG  33           HD1      ARG  33  83.602  15.213  -7.288
  262   HH11  ARG  33          HH21      ARG  33  82.908  16.800  -6.658
  263   HH12  ARG  33          HH22      ARG  33  81.456  17.737  -6.544
  264   HH21  ARG  33          HH11      ARG  33  79.408  14.988  -6.017
  265   HH22  ARG  33          HH12      ARG  33  79.474  16.711  -6.181
  266    H    GLN  34           HN       GLN  34  85.569  12.462  -5.443
  267    HA   GLN  34           HA       GLN  34  86.114  11.478  -3.383
  268    HB2  GLN  34           HB2      GLN  34  84.668   9.263  -4.842
  269    HB3  GLN  34           HB1      GLN  34  85.271   9.040  -3.200
  270    HG2  GLN  34           HG2      GLN  34  83.530  11.391  -3.961
  271    HG3  GLN  34           HG1      GLN  34  82.849   9.856  -3.420
  272   HE21  GLN  34          HE21      GLN  34  84.691   9.121  -1.411
  273   HE22  GLN  34          HE22      GLN  34  84.645  10.267  -0.161
  274    H    THR  35           HN       THR  35  88.309  11.324  -3.133
  275    HA   THR  35           HA       THR  35  90.498  10.481  -3.346
  276    HB   THR  35           HB       THR  35  90.525   7.906  -3.227
  277    HG1  THR  35           HG1      THR  35  88.414   7.726  -4.179
  278   HG21  THR  35          HG21      THR  35  89.604   7.942  -0.887
  279   HG22  THR  35          HG22      THR  35  89.012   9.573  -1.200
  280   HG23  THR  35          HG23      THR  35  90.744   9.245  -1.223
  281    H    ARG  36           HN       ARG  36  89.883   7.568  -4.913
  282    HA   ARG  36           HA       ARG  36  90.297   8.756  -7.623
  283    HE   ARG  36           HE       ARG  36  93.607   6.385  -4.532
  284    HB2  ARG  36           HB2      ARG  36  91.902   6.506  -6.365
  285    HB3  ARG  36           HB1      ARG  36  91.967   6.939  -8.072
  286    HG2  ARG  36           HG2      ARG  36  93.705   8.258  -7.355
  287    HG3  ARG  36           HG1      ARG  36  92.390   9.377  -6.992
  288    HD2  ARG  36           HD2      ARG  36  93.746   9.244  -5.013
  289    HD3  ARG  36           HD1      ARG  36  92.277   8.325  -4.684
  290   HH11  ARG  36          HH21      ARG  36  95.217   8.928  -6.214
  291   HH12  ARG  36          HH22      ARG  36  96.719   8.075  -6.336
  292   HH21  ARG  36          HH11      ARG  36  95.560   5.257  -4.682
  293   HH22  ARG  36          HH12      ARG  36  96.914   5.997  -5.469
  294    H    GLN  37           HN       GLN  37  87.846   8.072  -7.250
  295    HA   GLN  37           HA       GLN  37  86.180   6.691  -8.184
  296    HB2  GLN  37           HB2      GLN  37  88.339   6.055  -9.702
  297    HB3  GLN  37           HB1      GLN  37  88.076   4.506  -8.902
  298    HG2  GLN  37           HG2      GLN  37  85.953   6.073 -10.400
  299    HG3  GLN  37           HG1      GLN  37  86.809   4.667 -11.032
  300   HE21  GLN  37          HE21      GLN  37  84.215   5.696  -8.931
  301   HE22  GLN  37          HE22      GLN  37  83.726   4.146  -8.444
  302    H1U  RCY  38           H1U      RCY  38  82.239   1.007   0.793
  303    H1S  RCY  38           H1S      RCY  38  83.602   3.797  -2.239
  304    HB1  RCY  38           HB1      RCY  38  85.249   3.944  -4.690
  305    HB2  RCY  38           HB2      RCY  38  85.673   5.542  -4.077
  306    HA   RCY  38           HA       RCY  38  88.072   4.542  -3.825
  307    HN1  RCY  38           HN1      RCY  38  88.256   5.972  -5.677
  308    H    LYS  39           HN       LYS  39  89.382   2.792  -4.318
  309    HA   LYS  39           HA       LYS  39  88.010   0.411  -5.460
  310    HB2  LYS  39           HB2      LYS  39  90.234  -0.035  -6.719
  311    HB3  LYS  39           HB1      LYS  39  89.128   1.157  -7.402
  312    HG2  LYS  39           HG2      LYS  39  90.419   2.979  -6.607
  313    HG3  LYS  39           HG1      LYS  39  91.321   1.957  -5.488
  314    HD2  LYS  39           HD2      LYS  39  92.423   0.823  -7.343
  315    HD3  LYS  39           HD1      LYS  39  91.453   1.725  -8.508
  316    HE2  LYS  39           HE2      LYS  39  93.867   2.567  -7.965
  317    HE3  LYS  39           HE1      LYS  39  92.558   3.744  -8.062
  318    HZ1  LYS  39           HZ1      LYS  39  93.400   2.458  -5.528
  319    HZ2  LYS  39           HZ2      LYS  39  92.368   3.793  -5.722
  320    HZ3  LYS  39           HZ3      LYS  39  94.025   3.940  -6.066
  321    H    SER  40           HN       SER  40  90.780   1.758  -3.700
  322    HA   SER  40           HA       SER  40  92.058  -0.603  -2.883
  323    HG   SER  40           HG       SER  40  90.580   1.295  -0.615
  324    HB2  SER  40           HB2      SER  40  93.006   0.661  -1.124
  325    HB3  SER  40           HB1      SER  40  92.643   1.867  -2.355
  326    H    LYS  41           HN       LYS  41  91.617  -2.169  -1.319
  327    HA   LYS  41           HA       LYS  41  88.864  -2.504  -0.526
  328    HB2  LYS  41           HB2      LYS  41  91.272  -3.957   0.592
  329    HB3  LYS  41           HB1      LYS  41  89.603  -4.525   0.558
  330    HG2  LYS  41           HG2      LYS  41  89.730  -4.341  -1.985
  331    HG3  LYS  41           HG1      LYS  41  91.470  -4.128  -1.788
  332    HD2  LYS  41           HD2      LYS  41  91.375  -6.430  -2.028
  333    HD3  LYS  41           HD1      LYS  41  91.218  -6.299  -0.276
  334    HE2  LYS  41           HE2      LYS  41  89.450  -7.738  -0.866
  335    HE3  LYS  41           HE1      LYS  41  88.663  -6.164  -0.738
  336    HZ1  LYS  41           HZ1      LYS  41  88.165  -7.526  -2.793
  337    HZ2  LYS  41           HZ2      LYS  41  89.749  -7.175  -3.297
  338    HZ3  LYS  41           HZ3      LYS  41  88.635  -5.916  -3.049
  339    HA   PRO  42           HA       PRO  42  89.208  -0.085   3.228
  340    HB2  PRO  42           HB2      PRO  42  86.768  -0.636   4.293
  341    HB3  PRO  42           HB1      PRO  42  86.974   0.419   2.881
  342    HG2  PRO  42           HG2      PRO  42  86.120  -2.428   2.998
  343    HG3  PRO  42           HG1      PRO  42  85.536  -1.114   1.964
  344    HD2  PRO  42           HD2      PRO  42  87.330  -3.050   1.133
  345    HD3  PRO  42           HD1      PRO  42  87.195  -1.437   0.399
  346    HA   PRO  43           HA       PRO  43  90.525  -2.787   6.481
  347    HB2  PRO  43           HB2      PRO  43  89.598  -1.423   8.714
  348    HB3  PRO  43           HB1      PRO  43  91.067  -0.999   7.816
  349    HG2  PRO  43           HG2      PRO  43  88.355   0.209   7.680
  350    HG3  PRO  43           HG1      PRO  43  89.946   0.984   7.593
  351    HD2  PRO  43           HD2      PRO  43  88.434   0.549   5.377
  352    HD3  PRO  43           HD1      PRO  43  90.211   0.500   5.333
  353    H    LYS  44           HN       LYS  44  89.751  -4.389   7.976
  354    HA   LYS  44           HA       LYS  44  86.933  -5.103   7.585
  355    HB2  LYS  44           HB2      LYS  44  88.787  -6.796   7.585
  356    HB3  LYS  44           HB1      LYS  44  89.040  -6.463   9.295
  357    HG2  LYS  44           HG2      LYS  44  87.086  -7.508   9.933
  358    HG3  LYS  44           HG1      LYS  44  86.256  -7.104   8.430
  359    HD2  LYS  44           HD2      LYS  44  88.582  -8.964   8.252
  360    HD3  LYS  44           HD1      LYS  44  87.089  -9.595   8.948
  361    HE2  LYS  44           HE2      LYS  44  87.282  -9.886   6.442
  362    HE3  LYS  44           HE1      LYS  44  85.837  -9.026   6.970
  363    HZ1  LYS  44           HZ1      LYS  44  86.979  -6.933   6.527
  364    HZ2  LYS  44           HZ2      LYS  44  86.880  -7.891   5.127
  365    HZ3  LYS  44           HZ3      LYS  44  88.344  -7.779   5.982
  366    H    LYS  45           HN       LYS  45  88.190  -5.907  10.680
  367    HA   LYS  45           HA       LYS  45  86.165  -4.137  11.941
  368    HB2  LYS  45           HB2      LYS  45  87.730  -6.546  12.875
  369    HB3  LYS  45           HB1      LYS  45  86.872  -5.514  14.018
  370    HG2  LYS  45           HG2      LYS  45  84.783  -5.851  12.675
  371    HG3  LYS  45           HG1      LYS  45  85.664  -7.000  11.667
  372    HD2  LYS  45           HD2      LYS  45  86.192  -8.316  13.741
  373    HD3  LYS  45           HD1      LYS  45  85.133  -7.230  14.642
  374    HE2  LYS  45           HE2      LYS  45  83.742  -9.063  14.077
  375    HE3  LYS  45           HE1      LYS  45  83.337  -7.826  12.887
  376    HZ1  LYS  45           HZ1      LYS  45  84.953 -10.265  12.545
  377    HZ2  LYS  45           HZ2      LYS  45  85.179  -8.939  11.508
  378    HZ3  LYS  45           HZ3      LYS  45  83.662  -9.698  11.602
  379    H    GLY  46           HN       GLY  46  87.702  -2.271  11.376
  380    HA2  GLY  46           HA2      GLY  46  89.016  -1.345  13.712
  381    HA3  GLY  46           HA1      GLY  46  90.249  -2.017  12.645
  382    H    VAL  47           HN       VAL  47  87.275  -0.227  11.821
  383    HA   VAL  47           HA       VAL  47  88.408   1.284   9.740
  384    HB   VAL  47           HB       VAL  47  86.533   2.877  10.105
  385   HG11  VAL  47          HG11      VAL  47  84.757   1.282   9.717
  386   HG12  VAL  47          HG12      VAL  47  85.666   0.002  10.521
  387   HG13  VAL  47          HG13      VAL  47  86.223   0.641   8.974
  388   HG21  VAL  47          HG21      VAL  47  86.401   3.060  12.470
  389   HG22  VAL  47          HG22      VAL  47  86.321   1.310  12.681
  390   HG23  VAL  47          HG23      VAL  47  84.940   2.182  12.014
  391    H    GLN  48           HN       GLN  48  89.902   2.889   9.731
  392    HA   GLN  48           HA       GLN  48  91.065   3.864  12.193
  393    HB2  GLN  48           HB2      GLN  48  91.359   4.926   9.365
  394    HB3  GLN  48           HB1      GLN  48  92.415   5.307  10.726
  395    HG2  GLN  48           HG2      GLN  48  91.949   2.508   9.659
  396    HG3  GLN  48           HG1      GLN  48  93.338   3.512   9.243
  397   HE21  GLN  48          HE21      GLN  48  92.506   1.035  11.266
  398   HE22  GLN  48          HE22      GLN  48  93.558   1.349  12.560
  399    H    GLY  49           HN       GLY  49  88.144   4.554  10.907
  400    HA2  GLY  49           HA2      GLY  49  86.634   6.239  11.642
  401    HA3  GLY  49           HA1      GLY  49  87.994   7.115  12.345
  402    H1U  RCY  50           H1U      RCY  50  84.519   3.916   2.635
  403    H1S  RCY  50           H1S      RCY  50  86.256   6.743   5.230
  404    HB1  RCY  50           HB1      RCY  50  87.469   6.156   6.615
  405    HB2  RCY  50           HB2      RCY  50  89.210   6.409   6.716
  406    HA   RCY  50           HA       RCY  50  88.877   8.483   7.961
  407    HN1  RCY  50           HN1      RCY  50  88.174   5.983   9.047
  408    H    GLY  51           HN       GLY  51  85.898   7.547   9.216
  409    HA2  GLY  51           HA2      GLY  51  84.551   9.926   8.984
  410    HA3  GLY  51           HA1      GLY  51  84.209   9.142   7.440
  411    H    ASP  52           HN       ASP  52  84.448   7.943  10.805
  412    HA   ASP  52           HA       ASP  52  81.710   6.772  10.459
  413    HB2  ASP  52           HB2      ASP  52  84.179   5.604  11.762
  414    HB3  ASP  52           HB1      ASP  52  82.559   4.975  12.066
  415    H    ASP  53           HN       ASP  53  80.417   6.716  12.387
  416    HA   ASP  53           HA       ASP  53  81.168   7.508  14.971
  417    HB2  ASP  53           HB2      ASP  53  80.919   9.754  13.064
  418    HB3  ASP  53           HB1      ASP  53  79.993   9.962  14.549
  419    H    ILE  54           HN       ILE  54  78.565   9.095  13.140
  420    HA   ILE  54           HA       ILE  54  76.607   7.114  14.110
  421    HB   ILE  54           HB       ILE  54  76.696   8.618  16.010
  422   HG12  ILE  54          HG12      ILE  54  74.330   9.342  14.251
  423   HG13  ILE  54          HG11      ILE  54  74.446   7.884  15.237
  424   HG21  ILE  54          HG21      ILE  54  76.564  10.994  15.826
  425   HG22  ILE  54          HG22      ILE  54  76.097  10.909  14.128
  426   HG23  ILE  54          HG23      ILE  54  77.741  10.493  14.612
  427   HD11  ILE  54          HD11      ILE  54  73.193   9.497  16.512
  428   HD12  ILE  54          HD12      ILE  54  74.391  10.754  16.203
  429   HD13  ILE  54          HD13      ILE  54  74.794   9.389  17.245
  430    HA   PRO  55           HA       PRO  55  75.116   8.446  10.091
  431    HB2  PRO  55           HB2      PRO  55  72.851   6.901  10.004
  432    HB3  PRO  55           HB1      PRO  55  74.475   6.260   9.693
  433    HG2  PRO  55           HG2      PRO  55  72.813   6.073  12.149
  434    HG3  PRO  55           HG1      PRO  55  73.896   4.875  11.422
  435    HD2  PRO  55           HD2      PRO  55  74.581   6.411  13.602
  436    HD3  PRO  55           HD1      PRO  55  75.768   5.742  12.460
  437    H    GLY  56           HN       GLY  56  72.583   8.972   9.343
  438    HA2  GLY  56           HA2      GLY  56  71.887  11.297  10.910
  439    HA3  GLY  56           HA1      GLY  56  70.943  10.649   9.567
  440    H    MET  57           HN       MET  57  71.864   8.872  12.514
  441    HA   MET  57           HA       MET  57  70.437   7.616  13.923
  442    HB2  MET  57           HB2      MET  57  69.332  10.428  13.969
  443    HB3  MET  57           HB1      MET  57  68.690   9.158  15.012
  444    HG2  MET  57           HG2      MET  57  71.629   9.876  14.890
  445    HG3  MET  57           HG1      MET  57  70.511  10.569  16.066
  446    HE1  MET  57           HE1      MET  57  70.307   9.617  18.356
  447    HE2  MET  57           HE2      MET  57  69.690   7.976  18.537
  448    HE3  MET  57           HE3      MET  57  68.883   9.099  17.445
  449    H    GLU  58           HN       GLU  58  69.609   7.941  10.946
  450    HA   GLU  58           HA       GLU  58  67.252   6.332  11.074
  451    HB2  GLU  58           HB2      GLU  58  66.758   9.109  11.428
  452    HB3  GLU  58           HB1      GLU  58  66.239   8.723   9.790
  453    HG2  GLU  58           HG2      GLU  58  65.404   7.228  12.295
  454    HG3  GLU  58           HG1      GLU  58  64.402   8.376  11.407
  455    H    GLY  59           HN       GLY  59  68.080   5.111   9.399
  456    HA2  GLY  59           HA2      GLY  59  67.678   5.310   6.797
  457    HA3  GLY  59           HA1      GLY  59  68.970   6.506   6.926
  458    H1U  RCY  60           H1U      RCY  60  75.386   4.861   1.378
  459    H1S  RCY  60           H1S      RCY  60  73.284   2.977   5.340
  460    HB1  RCY  60           HB1      RCY  60  73.361   4.141   9.295
  461    HB2  RCY  60           HB2      RCY  60  73.087   5.319   8.013
  462    HA   RCY  60           HA       RCY  60  71.794   3.154   6.979
  463    HN1  RCY  60           HN1      RCY  60  70.853   5.511   8.457
  464    H    GLY  61           HN       GLY  61  70.879   3.980  10.304
  465    HA2  GLY  61           HA2      GLY  61  70.561   2.595  12.185
  466    HA3  GLY  61           HA1      GLY  61  69.693   1.591  11.023
  467    H    THR  62           HN       THR  62  72.892   2.165  12.449
  468    HA   THR  62           HA       THR  62  74.120  -0.143  11.218
  469    HB   THR  62           HB       THR  62  75.813   0.169  13.115
  470    HG1  THR  62           HG1      THR  62  74.115   1.238  14.420
  471   HG21  THR  62          HG21      THR  62  76.195   1.170  10.941
  472   HG22  THR  62          HG22      THR  62  76.605   2.359  12.178
  473   HG23  THR  62          HG23      THR  62  75.077   2.485  11.306
  474    H    ASP  63           HN       ASP  63  71.503  -0.588  12.574
  475    HA   ASP  63           HA       ASP  63  71.710  -1.903  15.045
  476    HB2  ASP  63           HB2      ASP  63  69.929  -2.330  12.649
  477    HB3  ASP  63           HB1      ASP  63  69.806  -3.391  14.052
  478    H    ILE  64           HN       ILE  64  72.857  -2.898  11.906
  479    HA   ILE  64           HA       ILE  64  74.081  -5.263  13.166
  480    HB   ILE  64           HB       ILE  64  72.190  -5.377  10.851
  481   HG12  ILE  64          HG12      ILE  64  72.584  -7.062  13.347
  482   HG13  ILE  64          HG11      ILE  64  71.327  -5.845  13.116
  483   HG21  ILE  64          HG21      ILE  64  73.081  -7.746  10.556
  484   HG22  ILE  64          HG22      ILE  64  74.464  -7.256  11.535
  485   HG23  ILE  64          HG23      ILE  64  74.149  -6.461   9.992
  486   HD11  ILE  64          HD11      ILE  64  71.376  -8.605  12.231
  487   HD12  ILE  64          HD12      ILE  64  71.156  -7.515  10.862
  488   HD13  ILE  64          HD13      ILE  64  70.035  -7.459  12.223
  489    H    THR  65           HN       THR  65  74.195  -2.695  10.986
  490    HA   THR  65           HA       THR  65  75.846  -1.999   9.494
  491    HB   THR  65           HB       THR  65  77.557  -3.698  11.325
  492    HG1  THR  65           HG1      THR  65  77.569  -0.968  11.544
  493   HG21  THR  65          HG21      THR  65  79.336  -2.043  10.577
  494   HG22  THR  65          HG22      THR  65  78.216  -1.539   9.311
  495   HG23  THR  65          HG23      THR  65  78.815  -3.197   9.348
  496    H    VAL  66           HN       VAL  66  77.536  -5.048  10.076
  497    HA   VAL  66           HA       VAL  66  78.157  -5.677   7.484
  498    HB   VAL  66           HB       VAL  66  77.558  -8.187   8.267
  499   HG11  VAL  66          HG11      VAL  66  79.761  -6.449   9.422
  500   HG12  VAL  66          HG12      VAL  66  79.818  -7.311   7.885
  501   HG13  VAL  66          HG13      VAL  66  79.769  -8.212   9.400
  502   HG21  VAL  66          HG21      VAL  66  76.258  -7.344  10.226
  503   HG22  VAL  66          HG22      VAL  66  77.728  -6.591  10.844
  504   HG23  VAL  66          HG23      VAL  66  77.626  -8.347  10.709
  505    H    ILE  67           HN       ILE  67  75.096  -6.801   9.003
  506    HA   ILE  67           HA       ILE  67  73.844  -6.529   6.310
  507    HB   ILE  67           HB       ILE  67  73.603  -8.918   8.151
  508   HG12  ILE  67          HG12      ILE  67  74.434  -8.750   5.242
  509   HG13  ILE  67          HG11      ILE  67  75.587  -8.741   6.577
  510   HG21  ILE  67          HG21      ILE  67  72.122  -9.707   6.157
  511   HG22  ILE  67          HG22      ILE  67  71.962  -7.987   5.803
  512   HG23  ILE  67          HG23      ILE  67  71.411  -8.623   7.353
  513   HD11  ILE  67          HD11      ILE  67  73.606 -10.934   5.903
  514   HD12  ILE  67          HD12      ILE  67  74.591 -10.908   7.366
  515   HD13  ILE  67          HD13      ILE  67  75.364 -11.023   5.785
  516    H1U  RCY  68           H1U      RCY  68  73.593   1.934   3.796
  517    H1S  RCY  68           H1S      RCY  68  73.208  -2.456   5.283
  518    HB1  RCY  68           HB1      RCY  68  70.597  -2.368   8.657
  519    HB2  RCY  68           HB2      RCY  68  70.403  -2.946   7.001
  520    HA   RCY  68           HA       RCY  68  71.223  -4.452   9.449
  521    HN1  RCY  68           HN1      RCY  68  72.824  -4.612   7.096
  522    HA   PRO  69           HA       PRO  69  67.937  -7.157   8.142
  523    HB2  PRO  69           HB2      PRO  69  66.043  -6.456   9.996
  524    HB3  PRO  69           HB1      PRO  69  67.449  -7.470  10.374
  525    HG2  PRO  69           HG2      PRO  69  67.030  -4.567  10.883
  526    HG3  PRO  69           HG1      PRO  69  67.794  -5.795  11.906
  527    HD2  PRO  69           HD2      PRO  69  69.232  -4.005  10.415
  528    HD3  PRO  69           HD1      PRO  69  69.833  -5.629  10.817
  529    H    TRP  70           HN       TRP  70  67.322  -3.701   8.553
  530    HA   TRP  70           HA       TRP  70  64.784  -3.772   7.130
  531    HD1  TRP  70           HD1      TRP  70  67.951  -1.930   9.456
  532    HE1  TRP  70           HE1      TRP  70  69.913  -0.489   8.612
  533    HE3  TRP  70           HE3      TRP  70  65.931  -0.144   5.120
  534    HZ2  TRP  70           HZ2      TRP  70  70.545   1.201   6.388
  535    HZ3  TRP  70           HZ3      TRP  70  67.230   1.375   3.661
  536    HH2  TRP  70           HH2      TRP  70  69.531   2.051   4.286
  537    HB2  TRP  70           HB2      TRP  70  64.926  -1.333   7.203
  538    HB3  TRP  70           HB1      TRP  70  65.377  -1.992   8.776
  539    H    GLU  71           HN       GLU  71  67.827  -4.390   6.080
  540    HA   GLU  71           HA       GLU  71  67.149  -4.113   3.308
  541    HB2  GLU  71           HB2      GLU  71  67.521  -1.720   3.694
  542    HB3  GLU  71           HB1      GLU  71  69.089  -2.059   4.425
  543    HG2  GLU  71           HG2      GLU  71  69.248  -1.335   2.026
  544    HG3  GLU  71           HG1      GLU  71  69.941  -2.930   2.322
  545    H    ALA  72           HN       ALA  72  67.909  -6.295   3.488
  546    HA   ALA  72           HA       ALA  72  70.405  -7.092   4.523
  547    HB1  ALA  72           HB1      ALA  72  69.128  -8.342   2.088
  548    HB2  ALA  72           HB2      ALA  72  68.480  -8.568   3.713
  549    HB3  ALA  72           HB3      ALA  72  70.107  -9.129   3.326
  550    H1U  RCY  73           H1U      RCY  73  73.420  -1.814   5.025
  551    H1S  RCY  73           H1S      RCY  73  76.212  -3.931   1.653
  552    HB1  RCY  73           HB1      RCY  73  74.618  -8.139   1.674
  553    HB2  RCY  73           HB2      RCY  73  74.646  -7.320   3.233
  554    HA   RCY  73           HA       RCY  73  73.438  -5.389   1.869
  555    HN1  RCY  73           HN1      RCY  73  72.453  -7.387   3.559
  556    H    ASN  74           HN       ASN  74  71.370  -7.951   1.041
  557    HA   ASN  74           HA       ASN  74  72.239  -8.201  -1.742
  558    HB2  ASN  74           HB2      ASN  74  71.002  -9.977  -0.314
  559    HB3  ASN  74           HB1      ASN  74  69.546  -9.046  -0.667
  560   HD21  ASN  74          HD21      ASN  74  72.308 -10.647  -2.338
  561   HD22  ASN  74          HD22      ASN  74  71.433 -11.021  -3.744
  562    H    HIS  75           HN       HIS  75  69.559  -8.149  -2.895
  563    HA   HIS  75           HA       HIS  75  68.049  -6.630  -3.852
  564    HD1  HIS  75           HD1      HIS  75  65.764  -6.093  -0.840
  565    HD2  HIS  75           HD2      HIS  75  66.594  -3.981  -4.340
  566    HE1  HIS  75           HE1      HIS  75  63.525  -5.465  -1.845
  567    HE2  HIS  75           HE2      HIS  75  64.017  -4.180  -3.977
  568    HB2  HIS  75           HB2      HIS  75  68.212  -5.862  -1.195
  569    HB3  HIS  75           HB1      HIS  75  68.635  -4.375  -2.041
  570    H1U  RCY  76           H1U      RCY  76  72.267  -2.549   2.482
  571    H1S  RCY  76           H1S      RCY  76  70.831  -2.729  -1.354
  572    HB1  RCY  76           HB1      RCY  76  72.193  -2.581  -5.255
  573    HB2  RCY  76           HB2      RCY  76  71.813  -3.803  -4.046
  574    HA   RCY  76           HA       RCY  76  69.600  -2.156  -5.243
  575    HN1  RCY  76           HN1      RCY  76  68.474  -3.706  -3.890
  576    H    GLU  77           HN       GLU  77  69.651  -2.063  -7.445
  577    HA   GLU  77           HA       GLU  77  69.447  -4.309  -9.123
  578    HB2  GLU  77           HB2      GLU  77  70.710  -1.652  -9.873
  579    HB3  GLU  77           HB1      GLU  77  69.971  -2.813 -10.975
  580    HG2  GLU  77           HG2      GLU  77  68.230  -1.283 -10.656
  581    HG3  GLU  77           HG1      GLU  77  67.858  -2.514  -9.447
  582    H    LEU  78           HN       LEU  78  70.927  -5.804  -9.811
  583    HA   LEU  78           HA       LEU  78  73.781  -5.082  -9.980
  584    HG   LEU  78           HG       LEU  78  71.764  -7.729  -8.760
  585    HB2  LEU  78           HB2      LEU  78  74.559  -6.792  -8.485
  586    HB3  LEU  78           HB1      LEU  78  73.366  -5.835  -7.610
  587   HD11  LEU  78          HD11      LEU  78  73.684  -8.963  -9.669
  588   HD12  LEU  78          HD12      LEU  78  72.894  -9.911  -8.409
  589   HD13  LEU  78          HD13      LEU  78  74.399  -9.061  -8.060
  590   HD21  LEU  78          HD21      LEU  78  71.943  -8.879  -6.485
  591   HD22  LEU  78          HD22      LEU  78  71.593  -7.151  -6.441
  592   HD23  LEU  78          HD23      LEU  78  73.226  -7.729  -6.109
  593    H    HIS  79           HN       HIS  79  74.874  -6.335 -11.484
  594    HA   HIS  79           HA       HIS  79  73.968  -8.912 -12.392
  595    HD1  HIS  79           HD1      HIS  79  72.477 -10.227 -13.345
  596    HD2  HIS  79           HD2      HIS  79  73.235  -8.028 -16.807
  597    HE1  HIS  79           HE1      HIS  79  72.220 -11.835 -15.284
  598    HE2  HIS  79           HE2      HIS  79  72.679 -10.509 -17.398
  599    HB2  HIS  79           HB2      HIS  79  72.219  -7.281 -13.358
  600    HB3  HIS  79           HB1      HIS  79  73.516  -6.702 -14.404
  601    H    GLU  80           HN       GLU  80  76.029  -6.166 -12.532
  602    HA   GLU  80           HA       GLU  80  78.089  -7.813 -13.881
  603    HB2  GLU  80           HB2      GLU  80  78.704  -5.887 -15.371
  604    HB3  GLU  80           HB1      GLU  80  77.133  -6.591 -15.744
  605    HG2  GLU  80           HG2      GLU  80  76.695  -4.274 -15.737
  606    HG3  GLU  80           HG1      GLU  80  76.183  -4.788 -14.129
  607    H    LEU  81           HN       LEU  81  77.169  -5.140 -11.836
  608    HA   LEU  81           HA       LEU  81  79.915  -4.285 -11.320
  609    HG   LEU  81           HG       LEU  81  76.676  -4.815 -10.019
  610    HB2  LEU  81           HB2      LEU  81  78.722  -3.127  -9.311
  611    HB3  LEU  81           HB1      LEU  81  78.352  -2.566 -10.940
  612   HD11  LEU  81          HD11      LEU  81  76.533  -2.089  -8.698
  613   HD12  LEU  81          HD12      LEU  81  76.830  -3.633  -7.899
  614   HD13  LEU  81          HD13      LEU  81  75.253  -3.300  -8.616
  615   HD21  LEU  81          HD21      LEU  81  76.119  -2.091 -11.238
  616   HD22  LEU  81          HD22      LEU  81  74.919  -3.365 -11.018
  617   HD23  LEU  81          HD23      LEU  81  76.273  -3.610 -12.121
  618    H    ALA  82           HN       ALA  82  77.973  -6.880 -10.334
  619    HA   ALA  82           HA       ALA  82  78.893  -7.218  -7.631
  620    HB1  ALA  82           HB1      ALA  82  77.893  -9.274  -9.621
  621    HB2  ALA  82           HB2      ALA  82  76.892  -8.361  -8.491
  622    HB3  ALA  82           HB3      ALA  82  78.062  -9.532  -7.885
  623    H    GLN  83           HN       GLN  83  81.220  -6.572  -8.766
  624    HA   GLN  83           HA       GLN  83  82.730  -8.725  -9.905
  625    HB2  GLN  83           HB2      GLN  83  83.233  -6.116  -9.617
  626    HB3  GLN  83           HB1      GLN  83  84.077  -6.679  -8.177
  627    HG2  GLN  83           HG2      GLN  83  84.554  -7.591 -11.029
  628    HG3  GLN  83           HG1      GLN  83  85.656  -6.651 -10.023
  629   HE21  GLN  83          HE21      GLN  83  84.478  -9.883 -10.695
  630   HE22  GLN  83          HE22      GLN  83  85.488 -10.690  -9.595
  631    H    TYR  84           HN       TYR  84  82.851  -7.411  -6.566
  632    HA   TYR  84           HA       TYR  84  82.895 -10.118  -5.452
  633    HD1  TYR  84           HD2      TYR  84  85.746  -7.181  -6.683
  634    HD2  TYR  84           HD1      TYR  84  85.324  -8.581  -2.644
  635    HE1  TYR  84           HE2      TYR  84  86.729  -5.063  -5.846
  636    HE2  TYR  84           HE1      TYR  84  86.307  -6.464  -1.807
  637    HH   TYR  84           HH       TYR  84  86.901  -3.751  -3.926
  638    HB2  TYR  84           HB2      TYR  84  85.076 -10.103  -4.525
  639    HB3  TYR  84           HB1      TYR  84  85.309  -9.554  -6.183
  640    H    GLY  85           HN       GLY  85  81.641  -9.943  -3.664
  641    HA2  GLY  85           HA2      GLY  85  81.413  -8.994  -1.378
  642    HA3  GLY  85           HA1      GLY  85  81.795  -7.416  -2.069
  643    H    ILE  86           HN       ILE  86  80.133  -7.619  -4.401
  644    HA   ILE  86           HA       ILE  86  77.929  -7.128  -5.045
  645    HB   ILE  86           HB       ILE  86  77.156  -8.982  -2.769
  646   HG12  ILE  86          HG12      ILE  86  77.719  -9.708  -5.658
  647   HG13  ILE  86          HG11      ILE  86  78.884  -9.940  -4.354
  648   HG21  ILE  86          HG21      ILE  86  75.737  -8.677  -5.400
  649   HG22  ILE  86          HG22      ILE  86  75.465  -7.491  -4.124
  650   HG23  ILE  86          HG23      ILE  86  75.092  -9.192  -3.842
  651   HD11  ILE  86          HD11      ILE  86  77.573 -12.003  -4.809
  652   HD12  ILE  86          HD12      ILE  86  76.094 -11.127  -4.416
  653   HD13  ILE  86          HD13      ILE  86  77.314 -11.401  -3.172
  654    H1U  RCY  87           H1U      RCY  87  80.738  -5.104  -2.060
  655    H1S  RCY  87           H1S      RCY  87  77.999  -4.684  -5.047
  656    HB1  RCY  87           HB1      RCY  87  75.723  -2.268  -3.193
  657    HB2  RCY  87           HB2      RCY  87  74.500  -3.459  -3.636
  658    HA   RCY  87           HA       RCY  87  77.092  -3.839  -2.225
  659    HN1  RCY  87           HN1      RCY  87  76.600  -5.393  -4.578
  Start of MODEL   72
    1    HA   MET   1           HA       MET   1  49.539  -1.124  -6.558
    2    HB2  MET   1           HB2      MET   1  51.397  -2.498  -4.593
    3    HB3  MET   1           HB1      MET   1  51.863  -1.360  -5.859
    4    HG2  MET   1           HG2      MET   1  50.311   0.324  -4.735
    5    HG3  MET   1           HG1      MET   1  50.225  -0.800  -3.378
    6    HE1  MET   1           HE1      MET   1  51.782  -0.062  -1.284
    7    HE2  MET   1           HE2      MET   1  50.807   1.157  -2.102
    8    HE3  MET   1           HE3      MET   1  52.459   1.537  -1.621
    9    H    ASN   2           HN       ASN   2  48.345  -2.893  -7.800
   10    HA   ASN   2           HA       ASN   2  48.428  -4.765  -9.211
   11    HB2  ASN   2           HB2      ASN   2  51.421  -4.736  -8.796
   12    HB3  ASN   2           HB1      ASN   2  50.519  -5.226 -10.231
   13   HD21  ASN   2          HD21      ASN   2  48.790  -2.631  -9.415
   14   HD22  ASN   2          HD22      ASN   2  49.658  -1.395 -10.190
   15    H    LEU   3           HN       LEU   3  50.012  -7.029  -9.217
   16    HA   LEU   3           HA       LEU   3  48.994  -8.467  -6.945
   17    HG   LEU   3           HG       LEU   3  48.549  -8.650  -9.497
   18    HB2  LEU   3           HB2      LEU   3  51.269  -9.453  -8.661
   19    HB3  LEU   3           HB1      LEU   3  49.966 -10.378  -7.917
   20   HD11  LEU   3          HD11      LEU   3  49.618  -8.299 -11.565
   21   HD12  LEU   3          HD12      LEU   3  50.859  -9.507 -11.231
   22   HD13  LEU   3          HD13      LEU   3  50.891  -7.955 -10.394
   23   HD21  LEU   3          HD21      LEU   3  48.494 -10.631 -11.123
   24   HD22  LEU   3          HD22      LEU   3  48.069 -10.989  -9.449
   25   HD23  LEU   3          HD23      LEU   3  49.671 -11.403 -10.060
   26    H    GLU   4           HN       GLU   4  50.055  -6.761  -5.423
   27    HA   GLU   4           HA       GLU   4  52.710  -7.833  -4.560
   28    HB2  GLU   4           HB2      GLU   4  51.778  -4.960  -4.704
   29    HB3  GLU   4           HB1      GLU   4  53.166  -5.463  -3.740
   30    HG2  GLU   4           HG2      GLU   4  52.896  -6.081  -6.691
   31    HG3  GLU   4           HG1      GLU   4  53.731  -4.654  -6.078
   32    HA   PRO   5           HA       PRO   5  50.280  -8.869  -0.907
   33    HB2  PRO   5           HB2      PRO   5  52.994  -8.498   0.322
   34    HB3  PRO   5           HB1      PRO   5  51.816  -9.803   0.569
   35    HG2  PRO   5           HG2      PRO   5  53.952 -10.122  -0.998
   36    HG3  PRO   5           HG1      PRO   5  52.394 -10.871  -1.383
   37    HD2  PRO   5           HD2      PRO   5  53.753  -8.593  -2.717
   38    HD3  PRO   5           HD1      PRO   5  52.537  -9.717  -3.363
   39    HA   PRO   6           HA       PRO   6  49.733  -4.713   0.703
   40    HB2  PRO   6           HB2      PRO   6  47.926  -5.261   2.668
   41    HB3  PRO   6           HB1      PRO   6  47.500  -5.279   0.945
   42    HG2  PRO   6           HG2      PRO   6  48.091  -7.560   2.763
   43    HG3  PRO   6           HG1      PRO   6  46.865  -7.416   1.492
   44    HD2  PRO   6           HD2      PRO   6  49.249  -8.753   1.155
   45    HD3  PRO   6           HD1      PRO   6  48.340  -8.013  -0.181
   46    H    LYS   7           HN       LYS   7  50.172  -3.480   2.694
   47    HA   LYS   7           HA       LYS   7  52.435  -4.422   4.156
   48    HB2  LYS   7           HB2      LYS   7  51.749  -2.476   5.751
   49    HB3  LYS   7           HB1      LYS   7  52.208  -2.080   4.095
   50    HG2  LYS   7           HG2      LYS   7  49.968  -1.762   3.420
   51    HG3  LYS   7           HG1      LYS   7  49.332  -2.632   4.817
   52    HD2  LYS   7           HD2      LYS   7  49.052  -0.166   5.034
   53    HD3  LYS   7           HD1      LYS   7  50.067  -0.840   6.310
   54    HE2  LYS   7           HE2      LYS   7  50.933   1.292   5.178
   55    HE3  LYS   7           HE1      LYS   7  52.065  -0.057   5.277
   56    HZ1  LYS   7           HZ1      LYS   7  51.655  -0.627   3.038
   57    HZ2  LYS   7           HZ2      LYS   7  51.909   1.052   3.058
   58    HZ3  LYS   7           HZ3      LYS   7  50.333   0.430   2.922
   59    H    ALA   8           HN       ALA   8  51.794  -6.512   4.973
   60    HA   ALA   8           HA       ALA   8  50.056  -6.339   7.407
   61    HB1  ALA   8           HB1      ALA   8  49.372  -8.713   6.889
   62    HB2  ALA   8           HB2      ALA   8  50.161  -8.537   5.322
   63    HB3  ALA   8           HB3      ALA   8  48.777  -7.524   5.731
   64    H    GLU   9           HN       GLU   9  52.608  -8.214   5.747
   65    HA   GLU   9           HA       GLU   9  53.424  -9.693   8.057
   66    HB2  GLU   9           HB2      GLU   9  55.208  -8.834   5.764
   67    HB3  GLU   9           HB1      GLU   9  55.403 -10.247   6.801
   68    HG2  GLU   9           HG2      GLU   9  53.307 -11.194   5.930
   69    HG3  GLU   9           HG1      GLU   9  53.081  -9.774   4.909
   70    H1U  RCY  10           H1U      RCY  10  57.653  -4.106   1.295
   71    H1S  RCY  10           H1S      RCY  10  57.091  -4.226   5.677
   72    HB1  RCY  10           HB1      RCY  10  56.493  -4.021   8.266
   73    HB2  RCY  10           HB2      RCY  10  55.425  -4.463   6.936
   74    HA   RCY  10           HA       RCY  10  55.716  -6.059   9.500
   75    HN1  RCY  10           HN1      RCY  10  53.655  -6.399   7.358
   76    H    ARG  11           HN       ARG  11  55.100  -3.040   8.698
   77    HA   ARG  11           HA       ARG  11  52.450  -2.381   9.267
   78    HE   ARG  11           HE       ARG  11  52.590  -3.033  14.350
   79    HB2  ARG  11           HB2      ARG  11  53.826  -3.469  11.605
   80    HB3  ARG  11           HB1      ARG  11  53.275  -1.823  11.900
   81    HG2  ARG  11           HG2      ARG  11  51.024  -2.371  11.540
   82    HG3  ARG  11           HG1      ARG  11  51.424  -3.816  10.610
   83    HD2  ARG  11           HD2      ARG  11  50.654  -4.574  12.755
   84    HD3  ARG  11           HD1      ARG  11  52.405  -4.784  12.744
   85   HH11  ARG  11          HH21      ARG  11  49.416  -3.381  13.051
   86   HH12  ARG  11          HH22      ARG  11  48.678  -2.343  14.225
   87   HH21  ARG  11          HH11      ARG  11  51.645  -1.676  15.891
   88   HH22  ARG  11          HH12      ARG  11  49.939  -1.378  15.833
   89    H    SER  12           HN       SER  12  52.459  -0.140  10.669
   90    HA   SER  12           HA       SER  12  53.779   1.783   9.144
   91    HG   SER  12           HG       SER  12  51.566   1.535  10.084
   92    HB2  SER  12           HB2      SER  12  53.162   2.010  12.103
   93    HB3  SER  12           HB1      SER  12  53.379   3.348  10.978
   94    H    ALA  13           HN       ALA  13  55.695   3.080   9.563
   95    HA   ALA  13           HA       ALA  13  57.583   2.625  11.614
   96    HB1  ALA  13           HB1      ALA  13  58.064   0.433  10.977
   97    HB2  ALA  13           HB2      ALA  13  59.257   1.323  10.033
   98    HB3  ALA  13           HB3      ALA  13  57.771   0.758   9.268
   99    H    THR  14           HN       THR  14  56.778   3.636   8.403
  100    HA   THR  14           HA       THR  14  58.375   6.019   8.615
  101    HB   THR  14           HB       THR  14  60.323   4.828   8.092
  102    HG1  THR  14           HG1      THR  14  59.927   6.458   6.536
  103   HG21  THR  14          HG21      THR  14  59.473   2.631   7.777
  104   HG22  THR  14          HG22      THR  14  60.271   3.036   6.257
  105   HG23  THR  14          HG23      THR  14  58.514   3.121   6.380
  106    H    ARG  15           HN       ARG  15  57.073   7.435   7.566
  107    HA   ARG  15           HA       ARG  15  55.004   6.645   5.758
  108    HE   ARG  15           HE       ARG  15  55.657   6.464   8.371
  109    HB2  ARG  15           HB2      ARG  15  56.243   9.401   5.859
  110    HB3  ARG  15           HB1      ARG  15  54.577   8.972   5.470
  111    HG2  ARG  15           HG2      ARG  15  55.932   8.711   8.169
  112    HG3  ARG  15           HG1      ARG  15  54.634   9.826   7.743
  113    HD2  ARG  15           HD2      ARG  15  53.481   8.076   8.802
  114    HD3  ARG  15           HD1      ARG  15  53.317   7.671   7.093
  115   HH11  ARG  15          HH21      ARG  15  52.299   6.256   7.622
  116   HH12  ARG  15          HH22      ARG  15  52.247   4.527   7.724
  117   HH21  ARG  15          HH11      ARG  15  55.610   4.209   8.509
  118   HH22  ARG  15          HH12      ARG  15  54.122   3.368   8.227
  119    H    VAL  16           HN       VAL  16  56.448   5.263   4.353
  120    HA   VAL  16           HA       VAL  16  57.940   4.967   2.518
  121    HB   VAL  16           HB       VAL  16  56.915   6.032   0.482
  122   HG11  VAL  16          HG11      VAL  16  56.081   3.888   1.394
  123   HG12  VAL  16          HG12      VAL  16  54.770   4.838   0.693
  124   HG13  VAL  16          HG13      VAL  16  54.973   4.772   2.444
  125   HG21  VAL  16          HG21      VAL  16  54.948   7.186   2.479
  126   HG22  VAL  16          HG22      VAL  16  54.956   7.423   0.731
  127   HG23  VAL  16          HG23      VAL  16  56.232   8.129   1.723
  128    H    MET  17           HN       MET  17  59.350   6.602   4.120
  129    HA   MET  17           HA       MET  17  61.145   8.111   4.017
  130    HB2  MET  17           HB2      MET  17  61.211   7.111   1.583
  131    HB3  MET  17           HB1      MET  17  60.541   8.676   1.122
  132    HG2  MET  17           HG2      MET  17  62.451   9.708   2.508
  133    HG3  MET  17           HG1      MET  17  63.177   8.101   2.480
  134    HE1  MET  17           HE1      MET  17  64.792  10.428   1.420
  135    HE2  MET  17           HE2      MET  17  63.336  11.356   1.067
  136    HE3  MET  17           HE3      MET  17  64.488  11.011  -0.221
  137    H    GLY  18           HN       GLY  18  58.544   9.288   1.847
  138    HA2  GLY  18           HA2      GLY  18  57.382  11.226   3.393
  139    HA3  GLY  18           HA1      GLY  18  58.865  12.019   2.855
  140    H    GLY  19           HN       GLY  19  58.675  13.137   0.977
  141    HA2  GLY  19           HA2      GLY  19  56.295  13.159  -0.590
  142    HA3  GLY  19           HA1      GLY  19  57.846  13.819  -1.113
  143    HA   PRO  20           HA       PRO  20  56.489  10.087  -3.754
  144    HB2  PRO  20           HB2      PRO  20  57.835  11.929  -5.695
  145    HB3  PRO  20           HB1      PRO  20  56.383  10.932  -5.910
  146    HG2  PRO  20           HG2      PRO  20  56.233  13.568  -5.527
  147    HG3  PRO  20           HG1      PRO  20  55.019  12.456  -4.874
  148    HD2  PRO  20           HD2      PRO  20  57.147  13.963  -3.440
  149    HD3  PRO  20           HD1      PRO  20  55.580  13.375  -2.842
  150    H1U  RCY  21           H1U      RCY  21  61.262   1.861   0.117
  151    H1S  RCY  21           H1S      RCY  21  60.182   5.167  -3.087
  152    HB1  RCY  21           HB1      RCY  21  59.957   6.589  -5.314
  153    HB2  RCY  21           HB2      RCY  21  59.318   7.125  -3.760
  154    HA   RCY  21           HA       RCY  21  60.911   9.225  -4.290
  155    HN1  RCY  21           HN1      RCY  21  58.162   9.036  -5.457
  156    H    THR  22           HN       THR  22  61.772  10.389  -6.026
  157    HA   THR  22           HA       THR  22  61.380   9.306  -8.763
  158    HB   THR  22           HB       THR  22  62.370  11.389  -9.534
  159    HG1  THR  22           HG1      THR  22  63.920  11.574  -7.868
  160   HG21  THR  22          HG21      THR  22  60.688  12.899  -8.804
  161   HG22  THR  22          HG22      THR  22  60.566  12.121  -7.226
  162   HG23  THR  22          HG23      THR  22  59.957  11.300  -8.663
  163    HA   PRO  23           HA       PRO  23  65.133   6.904  -8.730
  164    HB2  PRO  23           HB2      PRO  23  65.540   8.297 -11.359
  165    HB3  PRO  23           HB1      PRO  23  65.720   6.577 -10.959
  166    HG2  PRO  23           HG2      PRO  23  63.553   7.527 -12.216
  167    HG3  PRO  23           HG1      PRO  23  63.466   6.179 -11.071
  168    HD2  PRO  23           HD2      PRO  23  62.467   8.943 -10.765
  169    HD3  PRO  23           HD1      PRO  23  62.011   7.476  -9.872
  170    H    ARG  24           HN       ARG  24  67.161   7.335  -7.920
  171    HA   ARG  24           HA       ARG  24  68.209  10.132  -8.200
  172    HE   ARG  24           HE       ARG  24  65.032   9.719  -3.424
  173    HB2  ARG  24           HB2      ARG  24  68.635   8.246  -5.863
  174    HB3  ARG  24           HB1      ARG  24  69.156   9.928  -5.973
  175    HG2  ARG  24           HG2      ARG  24  66.866  10.704  -6.015
  176    HG3  ARG  24           HG1      ARG  24  66.260   9.051  -6.129
  177    HD2  ARG  24           HD2      ARG  24  67.028   8.530  -3.911
  178    HD3  ARG  24           HD1      ARG  24  67.922  10.046  -3.802
  179   HH11  ARG  24          HH21      ARG  24  67.688  11.790  -4.163
  180   HH12  ARG  24          HH22      ARG  24  66.870  13.235  -3.671
  181   HH21  ARG  24          HH11      ARG  24  63.949  11.594  -2.777
  182   HH22  ARG  24          HH12      ARG  24  64.753  13.125  -2.887
  183    H    LYS  25           HN       LYS  25  69.921  10.048  -9.575
  184    HA   LYS  25           HA       LYS  25  71.806   9.195 -10.706
  185    HB2  LYS  25           HB2      LYS  25  72.566   8.142  -7.975
  186    HB3  LYS  25           HB1      LYS  25  73.635   8.701  -9.258
  187    HG2  LYS  25           HG2      LYS  25  73.615  10.715  -8.228
  188    HG3  LYS  25           HG1      LYS  25  71.955  10.880  -8.801
  189    HD2  LYS  25           HD2      LYS  25  71.668  11.181  -6.509
  190    HD3  LYS  25           HD1      LYS  25  71.390   9.446  -6.662
  191    HE2  LYS  25           HE2      LYS  25  74.091  10.658  -6.022
  192    HE3  LYS  25           HE1      LYS  25  72.967  10.074  -4.795
  193    HZ1  LYS  25           HZ1      LYS  25  72.988   7.905  -5.974
  194    HZ2  LYS  25           HZ2      LYS  25  74.485   8.334  -5.295
  195    HZ3  LYS  25           HZ3      LYS  25  74.230   8.496  -6.967
  196    H    GLY  26           HN       GLY  26  70.847   7.538 -11.975
  197    HA2  GLY  26           HA2      GLY  26  70.479   4.865 -10.807
  198    HA3  GLY  26           HA1      GLY  26  70.150   5.318 -12.480
  199    HA   PRO  27           HA       PRO  27  73.868   3.748 -14.204
  200    HB2  PRO  27           HB2      PRO  27  74.937   6.535 -14.474
  201    HB3  PRO  27           HB1      PRO  27  74.838   5.245 -15.689
  202    HG2  PRO  27           HG2      PRO  27  73.121   7.295 -15.654
  203    HG3  PRO  27           HG1      PRO  27  72.639   5.667 -16.157
  204    HD2  PRO  27           HD2      PRO  27  71.939   7.142 -13.682
  205    HD3  PRO  27           HD1      PRO  27  71.086   5.801 -14.475
  206    HA   PRO  28           HA       PRO  28  76.942   3.240 -11.045
  207    HB2  PRO  28           HB2      PRO  28  78.977   3.843 -13.161
  208    HB3  PRO  28           HB1      PRO  28  78.905   2.484 -12.023
  209    HG2  PRO  28           HG2      PRO  28  78.219   2.225 -14.600
  210    HG3  PRO  28           HG1      PRO  28  77.428   1.305 -13.310
  211    HD2  PRO  28           HD2      PRO  28  76.358   3.541 -14.934
  212    HD3  PRO  28           HD1      PRO  28  75.485   2.276 -14.043
  213    H    LYS  29           HN       LYS  29  78.628   4.499  -9.868
  214    HA   LYS  29           HA       LYS  29  78.276   7.421 -10.328
  215    HB2  LYS  29           HB2      LYS  29  79.353   5.885  -7.942
  216    HB3  LYS  29           HB1      LYS  29  79.193   7.639  -8.022
  217    HG2  LYS  29           HG2      LYS  29  76.801   5.925  -8.614
  218    HG3  LYS  29           HG1      LYS  29  77.269   6.200  -6.936
  219    HD2  LYS  29           HD2      LYS  29  77.115   8.556  -8.779
  220    HD3  LYS  29           HD1      LYS  29  75.611   7.868  -8.163
  221    HE2  LYS  29           HE2      LYS  29  76.294   8.206  -5.883
  222    HE3  LYS  29           HE1      LYS  29  77.935   8.626  -6.376
  223    HZ1  LYS  29           HZ1      LYS  29  75.716  10.197  -7.462
  224    HZ2  LYS  29           HZ2      LYS  29  77.303  10.675  -7.089
  225    HZ3  LYS  29           HZ3      LYS  29  76.163  10.463  -5.847
  226    H1U  RCY  30           H1U      RCY  30  77.181   6.264  -8.956
  227    H1S  RCY  30           H1S      RCY  30  78.887   7.558 -12.941
  228    HB1  RCY  30           HB1      RCY  30  83.369   7.473 -12.874
  229    HB2  RCY  30           HB2      RCY  30  82.441   8.262 -11.598
  230    HA   RCY  30           HA       RCY  30  82.477   5.326 -12.331
  231    HN1  RCY  30           HN1      RCY  30  80.269   5.267 -11.542
  232    H    LYS  31           HN       LYS  31  81.932   4.803  -9.483
  233    HA   LYS  31           HA       LYS  31  84.539   5.727  -8.326
  234    HB2  LYS  31           HB2      LYS  31  81.864   5.225  -7.003
  235    HB3  LYS  31           HB1      LYS  31  83.369   5.348  -6.091
  236    HG2  LYS  31           HG2      LYS  31  83.753   7.597  -6.935
  237    HG3  LYS  31           HG1      LYS  31  82.342   7.479  -7.987
  238    HD2  LYS  31           HD2      LYS  31  80.835   7.528  -6.172
  239    HD3  LYS  31           HD1      LYS  31  82.089   7.106  -5.005
  240    HE2  LYS  31           HE2      LYS  31  81.262   9.606  -5.213
  241    HE3  LYS  31           HE1      LYS  31  82.974   9.257  -4.972
  242    HZ1  LYS  31           HZ1      LYS  31  82.074  10.791  -6.931
  243    HZ2  LYS  31           HZ2      LYS  31  82.035   9.289  -7.724
  244    HZ3  LYS  31           HZ3      LYS  31  83.490   9.867  -7.063
  245    H    GLN  32           HN       GLN  32  85.536   3.806  -9.262
  246    HA   GLN  32           HA       GLN  32  85.097   1.411  -7.560
  247    HB2  GLN  32           HB2      GLN  32  83.865   1.363  -9.910
  248    HB3  GLN  32           HB1      GLN  32  85.479   0.987 -10.510
  249    HG2  GLN  32           HG2      GLN  32  85.618  -0.873  -8.847
  250    HG3  GLN  32           HG1      GLN  32  83.951  -0.537  -8.379
  251   HE21  GLN  32          HE21      GLN  32  83.053   0.108 -11.124
  252   HE22  GLN  32          HE22      GLN  32  83.016  -1.361 -11.974
  253    H    ARG  33           HN       ARG  33  87.178   3.293  -7.416
  254    HA   ARG  33           HA       ARG  33  89.485   1.550  -8.026
  255    HE   ARG  33           HE       ARG  33  87.188   1.496 -12.163
  256    HB2  ARG  33           HB2      ARG  33  89.078   4.299  -9.219
  257    HB3  ARG  33           HB1      ARG  33  90.695   3.653  -8.959
  258    HG2  ARG  33           HG2      ARG  33  90.443   2.697 -11.006
  259    HG3  ARG  33           HG1      ARG  33  89.415   1.531 -10.172
  260    HD2  ARG  33           HD2      ARG  33  87.494   3.195 -10.563
  261    HD3  ARG  33           HD1      ARG  33  88.576   3.996 -11.703
  262   HH11  ARG  33          HH21      ARG  33  90.069   3.299 -12.738
  263   HH12  ARG  33          HH22      ARG  33  90.431   2.499 -14.231
  264   HH21  ARG  33          HH11      ARG  33  87.643   0.441 -14.109
  265   HH22  ARG  33          HH12      ARG  33  89.057   0.881 -15.007
  266    H    GLN  34           HN       GLN  34  89.092   1.603  -5.579
  267    HA   GLN  34           HA       GLN  34  90.442   3.994  -4.376
  268    HB2  GLN  34           HB2      GLN  34  88.338   2.136  -3.242
  269    HB3  GLN  34           HB1      GLN  34  89.259   3.266  -2.250
  270    HG2  GLN  34           HG2      GLN  34  88.487   5.083  -3.900
  271    HG3  GLN  34           HG1      GLN  34  87.319   3.895  -4.479
  272   HE21  GLN  34          HE21      GLN  34  85.432   4.948  -3.611
  273   HE22  GLN  34          HE22      GLN  34  85.163   5.102  -1.942
  274    H    THR  35           HN       THR  35  89.756   0.733  -3.150
  275    HA   THR  35           HA       THR  35  92.644   0.090  -3.148
  276    HB   THR  35           HB       THR  35  92.671  -0.403  -0.743
  277    HG1  THR  35           HG1      THR  35  90.902  -0.009   0.500
  278   HG21  THR  35          HG21      THR  35  92.753   1.846   0.060
  279   HG22  THR  35          HG22      THR  35  91.567   2.385  -1.128
  280   HG23  THR  35          HG23      THR  35  93.188   1.923  -1.647
  281    H    ARG  36           HN       ARG  36  89.301  -0.816  -2.913
  282    HA   ARG  36           HA       ARG  36  88.246  -2.900  -3.097
  283    HE   ARG  36           HE       ARG  36  87.970  -6.869  -6.816
  284    HB2  ARG  36           HB2      ARG  36  89.604  -2.838  -5.225
  285    HB3  ARG  36           HB1      ARG  36  90.858  -3.745  -4.380
  286    HG2  ARG  36           HG2      ARG  36  89.455  -5.638  -4.097
  287    HG3  ARG  36           HG1      ARG  36  88.001  -4.720  -4.489
  288    HD2  ARG  36           HD2      ARG  36  88.571  -4.590  -6.791
  289    HD3  ARG  36           HD1      ARG  36  90.237  -5.082  -6.487
  290   HH11  ARG  36          HH21      ARG  36  91.015  -6.347  -5.285
  291   HH12  ARG  36          HH22      ARG  36  91.367  -8.034  -5.112
  292   HH21  ARG  36          HH11      ARG  36  88.413  -9.075  -6.599
  293   HH22  ARG  36          HH12      ARG  36  89.894  -9.579  -5.856
  294    H    GLN  37           HN       GLN  37  88.799  -2.774  -0.608
  295    HA   GLN  37           HA       GLN  37  89.529  -5.407   0.248
  296    HB2  GLN  37           HB2      GLN  37  91.814  -4.781  -0.233
  297    HB3  GLN  37           HB1      GLN  37  91.618  -3.236   0.593
  298    HG2  GLN  37           HG2      GLN  37  92.820  -4.978   1.962
  299    HG3  GLN  37           HG1      GLN  37  91.368  -4.338   2.734
  300   HE21  GLN  37          HE21      GLN  37  91.372  -6.689   0.046
  301   HE22  GLN  37          HE22      GLN  37  90.696  -7.962   0.943
  302    H1U  RCY  38           H1U      RCY  38  85.087  -0.260   2.682
  303    H1S  RCY  38           H1S      RCY  38  84.670  -3.160   5.549
  304    HB1  RCY  38           HB1      RCY  38  86.838  -6.040   3.684
  305    HB2  RCY  38           HB2      RCY  38  86.058  -4.508   3.292
  306    HA   RCY  38           HA       RCY  38  87.994  -3.253   3.862
  307    HN1  RCY  38           HN1      RCY  38  88.998  -5.698   2.447
  308    H    LYS  39           HN       LYS  39  89.515  -6.438   4.179
  309    HA   LYS  39           HA       LYS  39  89.928  -6.205   7.040
  310    HB2  LYS  39           HB2      LYS  39  90.550  -8.123   4.920
  311    HB3  LYS  39           HB1      LYS  39  91.895  -7.947   6.044
  312    HG2  LYS  39           HG2      LYS  39  90.446  -9.682   6.901
  313    HG3  LYS  39           HG1      LYS  39  90.252  -8.265   7.934
  314    HD2  LYS  39           HD2      LYS  39  88.176  -7.681   6.913
  315    HD3  LYS  39           HD1      LYS  39  88.432  -8.810   5.582
  316    HE2  LYS  39           HE2      LYS  39  86.840  -9.491   7.555
  317    HE3  LYS  39           HE1      LYS  39  87.967 -10.681   6.904
  318    HZ1  LYS  39           HZ1      LYS  39  89.302 -10.557   8.722
  319    HZ2  LYS  39           HZ2      LYS  39  87.816 -10.200   9.464
  320    HZ3  LYS  39           HZ3      LYS  39  88.895  -8.948   9.071
  321    H    SER  40           HN       SER  40  90.835  -3.982   5.187
  322    HA   SER  40           HA       SER  40  93.760  -4.010   5.478
  323    HG   SER  40           HG       SER  40  93.417  -3.997   3.435
  324    HB2  SER  40           HB2      SER  40  91.749  -2.161   4.239
  325    HB3  SER  40           HB1      SER  40  93.355  -1.545   4.620
  326    H    LYS  41           HN       LYS  41  91.044  -2.033   6.756
  327    HA   LYS  41           HA       LYS  41  92.635  -1.626   9.223
  328    HB2  LYS  41           HB2      LYS  41  91.484   0.911   8.649
  329    HB3  LYS  41           HB1      LYS  41  93.197   0.502   8.712
  330    HG2  LYS  41           HG2      LYS  41  93.258  -0.017   6.378
  331    HG3  LYS  41           HG1      LYS  41  91.499   0.004   6.258
  332    HD2  LYS  41           HD2      LYS  41  91.545   2.436   6.877
  333    HD3  LYS  41           HD1      LYS  41  93.307   2.376   6.798
  334    HE2  LYS  41           HE2      LYS  41  92.410   3.198   4.671
  335    HE3  LYS  41           HE1      LYS  41  93.152   1.615   4.436
  336    HZ1  LYS  41           HZ1      LYS  41  91.225   0.952   3.603
  337    HZ2  LYS  41           HZ2      LYS  41  90.459   2.406   4.033
  338    HZ3  LYS  41           HZ3      LYS  41  90.535   1.123   5.143
  339    HA   PRO  42           HA       PRO  42  88.659  -1.950  11.103
  340    HB2  PRO  42           HB2      PRO  42  88.955  -0.440  13.359
  341    HB3  PRO  42           HB1      PRO  42  89.762  -2.003  13.132
  342    HG2  PRO  42           HG2      PRO  42  90.855   0.746  12.841
  343    HG3  PRO  42           HG1      PRO  42  91.616  -0.709  13.505
  344    HD2  PRO  42           HD2      PRO  42  92.104   0.247  10.964
  345    HD3  PRO  42           HD1      PRO  42  92.297  -1.456  11.434
  346    HA   PRO  43           HA       PRO  43  86.093   1.509  10.043
  347    HB2  PRO  43           HB2      PRO  43  83.992   1.199  11.768
  348    HB3  PRO  43           HB1      PRO  43  84.273   0.123  10.385
  349    HG2  PRO  43           HG2      PRO  43  84.907  -0.301  13.263
  350    HG3  PRO  43           HG1      PRO  43  84.270  -1.442  12.066
  351    HD2  PRO  43           HD2      PRO  43  86.905  -1.392  12.821
  352    HD3  PRO  43           HD1      PRO  43  86.366  -1.930  11.215
  353    H    LYS  44           HN       LYS  44  86.307   3.655  10.546
  354    HA   LYS  44           HA       LYS  44  87.572   4.662  12.822
  355    HB2  LYS  44           HB2      LYS  44  86.898   5.864  10.618
  356    HB3  LYS  44           HB1      LYS  44  85.393   6.237  11.459
  357    HG2  LYS  44           HG2      LYS  44  86.702   7.254  13.308
  358    HG3  LYS  44           HG1      LYS  44  88.186   6.935  12.410
  359    HD2  LYS  44           HD2      LYS  44  87.598   8.453  10.683
  360    HD3  LYS  44           HD1      LYS  44  85.914   8.519  11.205
  361    HE2  LYS  44           HE2      LYS  44  88.293   9.583  12.759
  362    HE3  LYS  44           HE1      LYS  44  87.105  10.559  11.894
  363    HZ1  LYS  44           HZ1      LYS  44  85.860  10.518  13.705
  364    HZ2  LYS  44           HZ2      LYS  44  86.945   9.475  14.492
  365    HZ3  LYS  44           HZ3      LYS  44  85.688   8.839  13.543
  366    H    LYS  45           HN       LYS  45  84.595   3.135  12.809
  367    HA   LYS  45           HA       LYS  45  82.991   2.877  14.504
  368    HB2  LYS  45           HB2      LYS  45  85.234   3.156  15.883
  369    HB3  LYS  45           HB1      LYS  45  84.545   4.724  16.297
  370    HG2  LYS  45           HG2      LYS  45  82.493   3.613  17.104
  371    HG3  LYS  45           HG1      LYS  45  83.183   2.042  16.694
  372    HD2  LYS  45           HD2      LYS  45  83.767   2.157  18.931
  373    HD3  LYS  45           HD1      LYS  45  85.187   2.914  18.208
  374    HE2  LYS  45           HE2      LYS  45  84.540   4.395  19.946
  375    HE3  LYS  45           HE1      LYS  45  83.923   5.140  18.471
  376    HZ1  LYS  45           HZ1      LYS  45  82.491   4.092  20.717
  377    HZ2  LYS  45           HZ2      LYS  45  81.929   3.458  19.244
  378    HZ3  LYS  45           HZ3      LYS  45  81.962   5.138  19.491
  379    H    GLY  46           HN       GLY  46  81.336   4.052  13.480
  380    HA2  GLY  46           HA2      GLY  46  81.276   6.993  13.799
  381    HA3  GLY  46           HA1      GLY  46  80.148   6.036  12.838
  382    H    VAL  47           HN       VAL  47  78.332   7.064  13.862
  383    HA   VAL  47           HA       VAL  47  77.998   6.996  16.744
  384    HB   VAL  47           HB       VAL  47  76.025   7.457  14.487
  385   HG11  VAL  47          HG11      VAL  47  74.684   8.498  16.436
  386   HG12  VAL  47          HG12      VAL  47  75.727   7.542  17.490
  387   HG13  VAL  47          HG13      VAL  47  74.693   6.739  16.308
  388   HG21  VAL  47          HG21      VAL  47  76.309   9.780  14.971
  389   HG22  VAL  47          HG22      VAL  47  77.939   9.109  14.915
  390   HG23  VAL  47          HG23      VAL  47  77.173   9.435  16.469
  391    H    GLN  48           HN       GLN  48  77.814   4.615  14.367
  392    HA   GLN  48           HA       GLN  48  76.583   2.743  16.275
  393    HB2  GLN  48           HB2      GLN  48  75.072   1.949  14.247
  394    HB3  GLN  48           HB1      GLN  48  74.531   3.259  15.297
  395    HG2  GLN  48           HG2      GLN  48  74.297   3.799  12.866
  396    HG3  GLN  48           HG1      GLN  48  75.351   4.925  13.723
  397   HE21  GLN  48          HE21      GLN  48  75.528   1.905  11.760
  398   HE22  GLN  48          HE22      GLN  48  77.040   2.263  11.078
  399    H    GLY  49           HN       GLY  49  78.638   3.506  13.702
  400    HA2  GLY  49           HA2      GLY  49  80.473   1.685  13.538
  401    HA3  GLY  49           HA1      GLY  49  79.135   0.627  13.076
  402    H1U  RCY  50           H1U      RCY  50  84.269   4.245   6.327
  403    H1S  RCY  50           H1S      RCY  50  80.847   3.387   8.404
  404    HB1  RCY  50           HB1      RCY  50  78.644   5.196   9.427
  405    HB2  RCY  50           HB2      RCY  50  78.073   3.687  10.134
  406    HA   RCY  50           HA       RCY  50  80.712   3.128   9.412
  407    HN1  RCY  50           HN1      RCY  50  80.357   3.873  12.183
  408    H    GLY  51           HN       GLY  51  80.232   5.762   8.348
  409    HA2  GLY  51           HA2      GLY  51  82.552   7.145   9.549
  410    HA3  GLY  51           HA1      GLY  51  81.780   7.563   8.017
  411    H    ASP  52           HN       ASP  52  79.076   7.566   9.085
  412    HA   ASP  52           HA       ASP  52  77.604   9.203   9.912
  413    HB2  ASP  52           HB2      ASP  52  78.552   8.021  12.001
  414    HB3  ASP  52           HB1      ASP  52  79.565   9.451  12.198
  415    H    ASP  53           HN       ASP  53  78.148  10.763   8.239
  416    HA   ASP  53           HA       ASP  53  79.085  13.282   9.296
  417    HB2  ASP  53           HB2      ASP  53  81.259  12.061   8.948
  418    HB3  ASP  53           HB1      ASP  53  80.873  11.970   7.229
  419    H    ILE  54           HN       ILE  54  79.442  11.881   6.033
  420    HA   ILE  54           HA       ILE  54  77.534  13.953   5.035
  421    HB   ILE  54           HB       ILE  54  79.401  12.256   3.374
  422   HG12  ILE  54          HG12      ILE  54  79.918  14.938   4.698
  423   HG13  ILE  54          HG11      ILE  54  80.771  13.428   5.022
  424   HG21  ILE  54          HG21      ILE  54  78.308  15.031   2.863
  425   HG22  ILE  54          HG22      ILE  54  77.452  13.572   2.363
  426   HG23  ILE  54          HG23      ILE  54  79.049  13.927   1.704
  427   HD11  ILE  54          HD11      ILE  54  80.825  15.091   2.499
  428   HD12  ILE  54          HD12      ILE  54  81.378  13.416   2.530
  429   HD13  ILE  54          HD13      ILE  54  82.182  14.629   3.527
  430    HA   PRO  55           HA       PRO  55  75.025   9.979   5.255
  431    HB2  PRO  55           HB2      PRO  55  72.974  11.906   4.347
  432    HB3  PRO  55           HB1      PRO  55  72.951  10.808   5.735
  433    HG2  PRO  55           HG2      PRO  55  73.485  13.585   5.734
  434    HG3  PRO  55           HG1      PRO  55  73.552  12.466   7.099
  435    HD2  PRO  55           HD2      PRO  55  75.749  13.800   5.940
  436    HD3  PRO  55           HD1      PRO  55  75.834  12.436   7.077
  437    H    GLY  56           HN       GLY  56  75.879   8.961   3.432
  438    HA2  GLY  56           HA2      GLY  56  76.418   9.427   0.920
  439    HA3  GLY  56           HA1      GLY  56  75.311   8.096   1.234
  440    H    MET  57           HN       MET  57  75.393  11.579   0.538
  441    HA   MET  57           HA       MET  57  73.621  12.970  -0.257
  442    HB2  MET  57           HB2      MET  57  74.087  10.749  -2.246
  443    HB3  MET  57           HB1      MET  57  72.981  12.077  -2.598
  444    HG2  MET  57           HG2      MET  57  75.849  12.495  -1.720
  445    HG3  MET  57           HG1      MET  57  75.352  12.437  -3.412
  446    HE1  MET  57           HE1      MET  57  75.848  16.048  -1.168
  447    HE2  MET  57           HE2      MET  57  76.807  14.631  -1.589
  448    HE3  MET  57           HE3      MET  57  75.691  14.559  -0.228
  449    H    GLU  58           HN       GLU  58  72.529  11.191   1.695
  450    HA   GLU  58           HA       GLU  58  69.772  10.997   0.629
  451    HB2  GLU  58           HB2      GLU  58  70.861   8.754   0.294
  452    HB3  GLU  58           HB1      GLU  58  71.099   8.661   2.038
  453    HG2  GLU  58           HG2      GLU  58  69.054   7.478   1.495
  454    HG3  GLU  58           HG1      GLU  58  68.619   8.972   2.325
  455    H    GLY  59           HN       GLY  59  70.900   9.418   3.567
  456    HA2  GLY  59           HA2      GLY  59  70.696  11.495   5.432
  457    HA3  GLY  59           HA1      GLY  59  69.046  10.922   5.187
  458    H1U  RCY  60           H1U      RCY  60  68.928  11.605   6.624
  459    H1S  RCY  60           H1S      RCY  60  68.557   7.528   6.308
  460    HB1  RCY  60           HB1      RCY  60  72.304   5.733   6.369
  461    HB2  RCY  60           HB2      RCY  60  71.446   6.644   5.128
  462    HA   RCY  60           HA       RCY  60  71.281   7.839   7.819
  463    HN1  RCY  60           HN1      RCY  60  72.208   9.261   5.398
  464    H    GLY  61           HN       GLY  61  73.309   5.956   7.976
  465    HA2  GLY  61           HA2      GLY  61  75.718   7.711   8.139
  466    HA3  GLY  61           HA1      GLY  61  75.430   6.308   9.169
  467    H    THR  62           HN       THR  62  76.744   7.394   6.171
  468    HA   THR  62           HA       THR  62  78.226   4.990   5.755
  469    HB   THR  62           HB       THR  62  76.272   3.860   5.054
  470    HG1  THR  62           HG1      THR  62  76.688   4.670   2.518
  471   HG21  THR  62          HG21      THR  62  75.548   6.505   3.798
  472   HG22  THR  62          HG22      THR  62  74.645   5.573   4.993
  473   HG23  THR  62          HG23      THR  62  74.739   5.011   3.324
  474    H    ASP  63           HN       ASP  63  78.772   7.760   5.750
  475    HA   ASP  63           HA       ASP  63  78.920   8.817   3.066
  476    HB2  ASP  63           HB2      ASP  63  80.612  10.394   4.120
  477    HB3  ASP  63           HB1      ASP  63  79.030  10.372   4.897
  478    H    ILE  64           HN       ILE  64  79.815   6.410   2.498
  479    HA   ILE  64           HA       ILE  64  81.637   5.154   1.752
  480    HB   ILE  64           HB       ILE  64  82.808   7.935   1.496
  481   HG12  ILE  64          HG12      ILE  64  82.180   7.483  -0.951
  482   HG13  ILE  64          HG11      ILE  64  81.207   6.144  -0.342
  483   HG21  ILE  64          HG21      ILE  64  83.711   5.221   0.533
  484   HG22  ILE  64          HG22      ILE  64  84.652   6.462   1.361
  485   HG23  ILE  64          HG23      ILE  64  84.175   6.693  -0.321
  486   HD11  ILE  64          HD11      ILE  64  79.688   7.538   0.700
  487   HD12  ILE  64          HD12      ILE  64  80.170   8.583  -0.636
  488   HD13  ILE  64          HD13      ILE  64  80.879   8.812   0.963
  489    H    THR  65           HN       THR  65  81.933   4.245   3.892
  490    HA   THR  65           HA       THR  65  83.795   5.455   5.761
  491    HB   THR  65           HB       THR  65  82.804   2.591   5.526
  492    HG1  THR  65           HG1      THR  65  81.313   4.414   5.996
  493   HG21  THR  65          HG21      THR  65  83.483   3.011   8.147
  494   HG22  THR  65          HG22      THR  65  84.734   3.927   7.308
  495   HG23  THR  65          HG23      THR  65  84.518   2.210   6.965
  496    H    VAL  66           HN       VAL  66  84.883   5.499   3.242
  497    HA   VAL  66           HA       VAL  66  86.930   5.070   2.202
  498    HB   VAL  66           HB       VAL  66  87.668   3.071   4.322
  499   HG11  VAL  66          HG11      VAL  66  89.874   4.117   4.019
  500   HG12  VAL  66          HG12      VAL  66  89.169   5.312   2.931
  501   HG13  VAL  66          HG13      VAL  66  89.215   3.613   2.463
  502   HG21  VAL  66          HG21      VAL  66  87.011   5.942   4.731
  503   HG22  VAL  66          HG22      VAL  66  88.516   5.379   5.458
  504   HG23  VAL  66          HG23      VAL  66  86.988   4.609   5.885
  505    H    ILE  67           HN       ILE  67  84.690   2.634   3.152
  506    HA   ILE  67           HA       ILE  67  85.537   1.001   0.803
  507    HB   ILE  67           HB       ILE  67  85.072   0.034   3.625
  508   HG12  ILE  67          HG12      ILE  67  87.088  -1.422   2.761
  509   HG13  ILE  67          HG11      ILE  67  87.214  -0.169   1.525
  510   HG21  ILE  67          HG21      ILE  67  85.161  -2.293   2.425
  511   HG22  ILE  67          HG22      ILE  67  84.579  -1.394   1.024
  512   HG23  ILE  67          HG23      ILE  67  83.625  -1.430   2.507
  513   HD11  ILE  67          HD11      ILE  67  88.313  -0.040   4.071
  514   HD12  ILE  67          HD12      ILE  67  86.851   0.935   4.211
  515   HD13  ILE  67          HD13      ILE  67  88.061   1.331   2.990
  516    H1U  RCY  68           H1U      RCY  68  75.352   3.481  -1.391
  517    H1S  RCY  68           H1S      RCY  68  79.029   1.902  -0.006
  518    HB1  RCY  68           HB1      RCY  68  80.414   1.998  -1.626
  519    HB2  RCY  68           HB2      RCY  68  82.049   2.641  -1.518
  520    HA   RCY  68           HA       RCY  68  81.082   0.782   0.632
  521    HN1  RCY  68           HN1      RCY  68  83.805   1.206  -0.546
  522    HA   PRO  69           HA       PRO  69  80.473  -2.890  -1.705
  523    HB2  PRO  69           HB2      PRO  69  78.334  -1.472  -3.254
  524    HB3  PRO  69           HB1      PRO  69  78.287  -3.064  -2.467
  525    HG2  PRO  69           HG2      PRO  69  77.140  -0.942  -1.353
  526    HG3  PRO  69           HG1      PRO  69  77.975  -2.155  -0.368
  527    HD2  PRO  69           HD2      PRO  69  78.833   0.616  -1.058
  528    HD3  PRO  69           HD1      PRO  69  79.226  -0.364   0.371
  529    H    TRP  70           HN       TRP  70  80.542   0.069  -3.650
  530    HA   TRP  70           HA       TRP  70  81.342  -1.381  -6.061
  531    HD1  TRP  70           HD1      TRP  70  79.995  -1.167  -7.873
  532    HE1  TRP  70           HE1      TRP  70  77.479  -0.839  -8.324
  533    HE3  TRP  70           HE3      TRP  70  79.106   2.934  -4.964
  534    HZ2  TRP  70           HZ2      TRP  70  75.364   0.933  -7.552
  535    HZ3  TRP  70           HZ3      TRP  70  76.839   3.920  -4.840
  536    HH2  TRP  70           HH2      TRP  70  74.968   2.928  -6.127
  537    HB2  TRP  70           HB2      TRP  70  81.125   1.547  -5.346
  538    HB3  TRP  70           HB1      TRP  70  81.784   1.012  -6.890
  539    H    GLU  71           HN       GLU  71  83.070  -1.766  -3.696
  540    HA   GLU  71           HA       GLU  71  85.612  -0.997  -4.999
  541    HB2  GLU  71           HB2      GLU  71  84.774  -0.065  -2.247
  542    HB3  GLU  71           HB1      GLU  71  86.468  -0.183  -2.713
  543    HG2  GLU  71           HG2      GLU  71  85.995   2.026  -3.298
  544    HG3  GLU  71           HG1      GLU  71  85.682   1.194  -4.822
  545    H    ALA  72           HN       ALA  72  84.948  -2.040  -1.664
  546    HA   ALA  72           HA       ALA  72  86.971  -4.003  -1.607
  547    HB1  ALA  72           HB1      ALA  72  85.904  -3.104   0.404
  548    HB2  ALA  72           HB2      ALA  72  85.841  -4.864   0.398
  549    HB3  ALA  72           HB3      ALA  72  84.403  -3.928  -0.011
  550    H1U  RCY  73           H1U      RCY  73  80.299  -6.207   2.272
  551    H1S  RCY  73           H1S      RCY  73  82.615  -6.814   0.783
  552    HB1  RCY  73           HB1      RCY  73  84.329  -9.357  -0.945
  553    HB2  RCY  73           HB2      RCY  73  82.849  -8.402  -0.892
  554    HA   RCY  73           HA       RCY  73  85.246  -8.011  -2.513
  555    HN1  RCY  73           HN1      RCY  73  85.125  -6.120  -0.475
  556    H    ASN  74           HN       ASN  74  84.571  -7.206  -4.526
  557    HA   ASN  74           HA       ASN  74  81.924  -6.034  -4.870
  558    HB2  ASN  74           HB2      ASN  74  82.467  -5.974  -7.233
  559    HB3  ASN  74           HB1      ASN  74  83.892  -5.472  -6.323
  560   HD21  ASN  74          HD21      ASN  74  82.997  -7.424  -8.870
  561   HD22  ASN  74          HD22      ASN  74  84.250  -8.567  -8.799
  562    H    HIS  75           HN       HIS  75  83.419  -9.188  -5.677
  563    HA   HIS  75           HA       HIS  75  80.879 -10.236  -6.666
  564    HD1  HIS  75           HD1      HIS  75  81.546 -13.693  -7.969
  565    HD2  HIS  75           HD2      HIS  75  82.671  -9.859  -9.165
  566    HE1  HIS  75           HE1      HIS  75  81.056 -13.545 -10.449
  567    HE2  HIS  75           HE2      HIS  75  81.737 -11.216 -11.190
  568    HB2  HIS  75           HB2      HIS  75  83.655 -11.116  -6.584
  569    HB3  HIS  75           HB1      HIS  75  82.575 -12.418  -6.094
  570    H1U  RCY  76           H1U      RCY  76  81.286  -5.815   0.708
  571    H1S  RCY  76           H1S      RCY  76  78.247  -9.395  -0.507
  572    HB1  RCY  76           HB1      RCY  76  81.406 -10.413  -2.172
  573    HB2  RCY  76           HB2      RCY  76  81.517 -11.554  -0.834
  574    HA   RCY  76           HA       RCY  76  82.018 -13.152  -2.350
  575    HN1  RCY  76           HN1      RCY  76  82.643 -12.237  -4.415
  576    H    GLU  77           HN       GLU  77  79.206 -11.723  -4.034
  577    HA   GLU  77           HA       GLU  77  77.219 -13.460  -3.100
  578    HB2  GLU  77           HB2      GLU  77  76.849 -11.461  -4.569
  579    HB3  GLU  77           HB1      GLU  77  77.450 -12.401  -5.933
  580    HG2  GLU  77           HG2      GLU  77  75.025 -12.527  -5.928
  581    HG3  GLU  77           HG1      GLU  77  75.666 -14.106  -5.470
  582    H    LEU  78           HN       LEU  78  77.663 -14.002  -6.480
  583    HA   LEU  78           HA       LEU  78  78.221 -15.936  -7.699
  584    HG   LEU  78           HG       LEU  78  79.260 -18.101  -7.736
  585    HB2  LEU  78           HB2      LEU  78  80.195 -15.894  -5.932
  586    HB3  LEU  78           HB1      LEU  78  79.316 -17.251  -5.228
  587   HD11  LEU  78          HD11      LEU  78  81.284 -17.460  -8.967
  588   HD12  LEU  78          HD12      LEU  78  81.747 -16.364  -7.664
  589   HD13  LEU  78          HD13      LEU  78  80.307 -16.031  -8.627
  590   HD21  LEU  78          HD21      LEU  78  81.756 -18.202  -6.010
  591   HD22  LEU  78          HD22      LEU  78  81.348 -19.344  -7.291
  592   HD23  LEU  78          HD23      LEU  78  80.350 -19.254  -5.839
  593    H    HIS  79           HN       HIS  79  75.655 -15.666  -6.728
  594    HA   HIS  79           HA       HIS  79  74.796 -18.439  -6.582
  595    HD1  HIS  79           HD1      HIS  79  72.276 -17.687  -2.934
  596    HD2  HIS  79           HD2      HIS  79  74.086 -20.499  -5.427
  597    HE1  HIS  79           HE1      HIS  79  70.896 -19.803  -2.746
  598    HE2  HIS  79           HE2      HIS  79  71.988 -21.523  -4.259
  599    HB2  HIS  79           HB2      HIS  79  75.494 -17.902  -4.203
  600    HB3  HIS  79           HB1      HIS  79  74.201 -16.703  -4.172
  601    H    GLU  80           HN       GLU  80  73.651 -15.162  -5.652
  602    HA   GLU  80           HA       GLU  80  71.103 -15.726  -7.064
  603    HB2  GLU  80           HB2      GLU  80  71.377 -14.675  -4.674
  604    HB3  GLU  80           HB1      GLU  80  71.694 -13.187  -5.557
  605    HG2  GLU  80           HG2      GLU  80  69.379 -13.075  -5.320
  606    HG3  GLU  80           HG1      GLU  80  69.520 -13.864  -6.892
  607    H    LEU  81           HN       LEU  81  71.598 -12.421  -6.965
  608    HA   LEU  81           HA       LEU  81  71.698 -12.170  -9.821
  609    HG   LEU  81           HG       LEU  81  69.930  -9.374  -8.301
  610    HB2  LEU  81           HB2      LEU  81  72.060 -10.225  -7.542
  611    HB3  LEU  81           HB1      LEU  81  72.262  -9.714  -9.217
  612   HD11  LEU  81          HD11      LEU  81  69.683 -11.398 -10.477
  613   HD12  LEU  81          HD12      LEU  81  70.712 -10.002 -10.793
  614   HD13  LEU  81          HD13      LEU  81  69.015  -9.769 -10.376
  615   HD21  LEU  81          HD21      LEU  81  69.695 -12.378  -8.552
  616   HD22  LEU  81          HD22      LEU  81  68.541 -11.250  -7.840
  617   HD23  LEU  81          HD23      LEU  81  70.058 -11.601  -7.011
  618    H    ALA  82           HN       ALA  82  73.982 -13.644  -8.462
  619    HA   ALA  82           HA       ALA  82  76.391 -12.230  -8.492
  620    HB1  ALA  82           HB1      ALA  82  77.398 -14.442  -9.312
  621    HB2  ALA  82           HB2      ALA  82  75.744 -15.056  -9.347
  622    HB3  ALA  82           HB3      ALA  82  76.452 -14.514  -7.825
  623    H    GLN  83           HN       GLN  83  77.463 -11.142 -10.057
  624    HA   GLN  83           HA       GLN  83  77.464 -12.018 -12.838
  625    HB2  GLN  83           HB2      GLN  83  75.259 -10.744 -12.518
  626    HB3  GLN  83           HB1      GLN  83  76.250  -9.303 -12.288
  627    HG2  GLN  83           HG2      GLN  83  75.681  -9.362 -14.615
  628    HG3  GLN  83           HG1      GLN  83  77.368  -9.863 -14.504
  629   HE21  GLN  83          HE21      GLN  83  77.825 -11.715 -15.691
  630   HE22  GLN  83          HE22      GLN  83  76.711 -12.943 -16.056
  631    H    TYR  84           HN       TYR  84  77.832  -8.934 -11.065
  632    HA   TYR  84           HA       TYR  84  80.750  -9.021 -11.542
  633    HD1  TYR  84           HD1      TYR  84  82.436  -8.143 -13.006
  634    HD2  TYR  84           HD2      TYR  84  78.595  -7.885 -14.911
  635    HE1  TYR  84           HE1      TYR  84  83.391  -9.138 -15.068
  636    HE2  TYR  84           HE2      TYR  84  79.550  -8.879 -16.973
  637    HH   TYR  84           HH       TYR  84  82.664  -8.985 -17.688
  638    HB2  TYR  84           HB2      TYR  84  78.859  -7.024 -12.762
  639    HB3  TYR  84           HB1      TYR  84  80.468  -6.493 -12.274
  640    H    GLY  85           HN       GLY  85  78.443  -8.841  -9.396
  641    HA2  GLY  85           HA2      GLY  85  78.795  -8.213  -7.097
  642    HA3  GLY  85           HA1      GLY  85  79.982  -7.022  -7.631
  643    H    ILE  86           HN       ILE  86  76.642  -7.515  -8.797
  644    HA   ILE  86           HA       ILE  86  75.996  -4.792  -9.015
  645    HB   ILE  86           HB       ILE  86  74.531  -6.570  -9.880
  646   HG12  ILE  86          HG12      ILE  86  73.034  -4.995  -7.770
  647   HG13  ILE  86          HG11      ILE  86  73.640  -4.265  -9.257
  648   HG21  ILE  86          HG21      ILE  86  74.756  -8.211  -8.109
  649   HG22  ILE  86          HG22      ILE  86  73.052  -7.775  -8.240
  650   HG23  ILE  86          HG23      ILE  86  74.036  -7.107  -6.938
  651   HD11  ILE  86          HD11      ILE  86  72.216  -5.558 -10.617
  652   HD12  ILE  86          HD12      ILE  86  71.195  -5.140  -9.241
  653   HD13  ILE  86          HD13      ILE  86  71.926  -6.742  -9.343
  654    H1U  RCY  87           H1U      RCY  87  73.364  -3.412   1.025
  655    H1S  RCY  87           H1S      RCY  87  72.736  -5.479  -2.900
  656    HB1  RCY  87           HB1      RCY  87  75.787  -6.484  -2.651
  657    HB2  RCY  87           HB2      RCY  87  76.163  -7.518  -4.030
  658    HA   RCY  87           HA       RCY  87  74.783  -4.881  -4.461
  659    HN1  RCY  87           HN1      RCY  87  76.122  -6.836  -6.181
  Start of MODEL   73
    1    HA   MET   1           HA       MET   1  45.522  -0.244  -8.165
    2    HB2  MET   1           HB2      MET   1  47.689  -1.087  -9.251
    3    HB3  MET   1           HB1      MET   1  46.184  -1.554 -10.043
    4    HG2  MET   1           HG2      MET   1  47.658   0.946 -10.862
    5    HG3  MET   1           HG1      MET   1  48.090  -0.626 -11.534
    6    HE1  MET   1           HE1      MET   1  45.360   2.103 -13.382
    7    HE2  MET   1           HE2      MET   1  47.052   2.072 -12.892
    8    HE3  MET   1           HE3      MET   1  45.800   2.398 -11.695
    9    H    ASN   2           HN       ASN   2  48.157  -0.225  -7.565
   10    HA   ASN   2           HA       ASN   2  49.691   1.063  -6.332
   11    HB2  ASN   2           HB2      ASN   2  49.258   2.823  -8.765
   12    HB3  ASN   2           HB1      ASN   2  50.556   3.052  -7.592
   13   HD21  ASN   2          HD21      ASN   2  49.190   0.441  -9.685
   14   HD22  ASN   2          HD22      ASN   2  50.694  -0.263 -10.035
   15    H    LEU   3           HN       LEU   3  46.722   1.551  -5.946
   16    HA   LEU   3           HA       LEU   3  46.421   4.383  -5.401
   17    HG   LEU   3           HG       LEU   3  44.868   3.242  -6.972
   18    HB2  LEU   3           HB2      LEU   3  44.844   1.914  -4.672
   19    HB3  LEU   3           HB1      LEU   3  44.411   3.495  -4.022
   20   HD11  LEU   3          HD11      LEU   3  42.363   2.738  -7.141
   21   HD12  LEU   3          HD12      LEU   3  42.449   2.257  -5.447
   22   HD13  LEU   3          HD13      LEU   3  43.394   1.391  -6.658
   23   HD21  LEU   3          HD21      LEU   3  44.395   5.403  -5.657
   24   HD22  LEU   3          HD22      LEU   3  42.759   4.779  -5.445
   25   HD23  LEU   3          HD23      LEU   3  43.379   5.097  -7.065
   26    H    GLU   4           HN       GLU   4  48.774   3.847  -4.228
   27    HA   GLU   4           HA       GLU   4  48.498   3.023  -1.452
   28    HB2  GLU   4           HB2      GLU   4  50.792   4.592  -2.640
   29    HB3  GLU   4           HB1      GLU   4  50.828   3.495  -1.259
   30    HG2  GLU   4           HG2      GLU   4  50.292   2.709  -4.139
   31    HG3  GLU   4           HG1      GLU   4  51.773   2.388  -3.236
   32    HA   PRO   5           HA       PRO   5  46.658   6.915  -0.090
   33    HB2  PRO   5           HB2      PRO   5  48.074   6.078   2.420
   34    HB3  PRO   5           HB1      PRO   5  46.411   6.660   2.209
   35    HG2  PRO   5           HG2      PRO   5  46.962   4.070   2.551
   36    HG3  PRO   5           HG1      PRO   5  45.644   4.616   1.502
   37    HD2  PRO   5           HD2      PRO   5  48.256   3.420   0.754
   38    HD3  PRO   5           HD1      PRO   5  46.730   3.455  -0.155
   39    HA   PRO   6           HA       PRO   6  50.084   9.721  -0.354
   40    HB2  PRO   6           HB2      PRO   6  49.113  11.896   0.997
   41    HB3  PRO   6           HB1      PRO   6  48.547  11.421  -0.617
   42    HG2  PRO   6           HG2      PRO   6  47.288  10.950   2.037
   43    HG3  PRO   6           HG1      PRO   6  46.538  11.384   0.492
   44    HD2  PRO   6           HD2      PRO   6  46.535   8.828   1.483
   45    HD3  PRO   6           HD1      PRO   6  46.492   9.194  -0.255
   46    H    LYS   7           HN       LYS   7  51.904  10.420   0.820
   47    HA   LYS   7           HA       LYS   7  53.452  10.247   2.588
   48    HB2  LYS   7           HB2      LYS   7  51.130  11.158   4.291
   49    HB3  LYS   7           HB1      LYS   7  52.843  11.528   4.496
   50    HG2  LYS   7           HG2      LYS   7  51.102  12.443   2.188
   51    HG3  LYS   7           HG1      LYS   7  51.654  13.453   3.525
   52    HD2  LYS   7           HD2      LYS   7  54.038  12.735   2.828
   53    HD3  LYS   7           HD1      LYS   7  53.293  12.201   1.321
   54    HE2  LYS   7           HE2      LYS   7  54.113  14.502   1.084
   55    HE3  LYS   7           HE1      LYS   7  52.351  14.475   1.002
   56    HZ1  LYS   7           HZ1      LYS   7  53.592  16.160   2.540
   57    HZ2  LYS   7           HZ2      LYS   7  53.632  14.842   3.613
   58    HZ3  LYS   7           HZ3      LYS   7  52.144  15.434   3.045
   59    H    ALA   8           HN       ALA   8  52.368   7.776   2.048
   60    HA   ALA   8           HA       ALA   8  52.418   6.545   4.742
   61    HB1  ALA   8           HB1      ALA   8  50.384   5.397   4.549
   62    HB2  ALA   8           HB2      ALA   8  50.310   5.622   2.801
   63    HB3  ALA   8           HB3      ALA   8  49.983   6.978   3.880
   64    H    GLU   9           HN       GLU   9  51.850   3.926   3.936
   65    HA   GLU   9           HA       GLU   9  52.777   2.072   2.835
   66    HB2  GLU   9           HB2      GLU   9  52.394   3.723   0.800
   67    HB3  GLU   9           HB1      GLU   9  54.153   3.850   0.842
   68    HG2  GLU   9           HG2      GLU   9  52.530   1.304   0.563
   69    HG3  GLU   9           HG1      GLU   9  53.542   2.050  -0.675
   70    H1U  RCY  10           H1U      RCY  10  63.278   1.903   2.639
   71    H1S  RCY  10           H1S      RCY  10  58.981   3.304   3.557
   72    HB1  RCY  10           HB1      RCY  10  56.838   5.902   4.878
   73    HB2  RCY  10           HB2      RCY  10  56.938   6.077   3.126
   74    HA   RCY  10           HA       RCY  10  57.405   3.532   3.095
   75    HN1  RCY  10           HN1      RCY  10  54.937   4.901   3.054
   76    H    ARG  11           HN       ARG  11  58.671   2.692   4.830
   77    HA   ARG  11           HA       ARG  11  59.044   1.632   6.885
   78    HE   ARG  11           HE       ARG  11  58.912   5.390   9.331
   79    HB2  ARG  11           HB2      ARG  11  57.638   3.948   7.521
   80    HB3  ARG  11           HB1      ARG  11  56.678   2.686   8.285
   81    HG2  ARG  11           HG2      ARG  11  58.271   3.218   9.936
   82    HG3  ARG  11           HG1      ARG  11  58.957   1.788   9.162
   83    HD2  ARG  11           HD2      ARG  11  60.748   3.362   9.310
   84    HD3  ARG  11           HD1      ARG  11  60.220   3.396   7.627
   85   HH11  ARG  11          HH21      ARG  11  61.557   4.558   7.282
   86   HH12  ARG  11          HH22      ARG  11  61.923   6.199   6.865
   87   HH21  ARG  11          HH11      ARG  11  59.375   7.537   8.799
   88   HH22  ARG  11          HH12      ARG  11  60.688   7.886   7.725
   89    H    SER  12           HN       SER  12  57.877   0.078   5.058
   90    HA   SER  12           HA       SER  12  55.319  -0.972   5.445
   91    HG   SER  12           HG       SER  12  58.756  -2.082   4.293
   92    HB2  SER  12           HB2      SER  12  56.233  -3.112   4.569
   93    HB3  SER  12           HB1      SER  12  56.785  -1.726   3.634
   94    H    ALA  13           HN       ALA  13  58.199  -2.635   6.779
   95    HA   ALA  13           HA       ALA  13  56.917  -2.819   9.418
   96    HB1  ALA  13           HB1      ALA  13  56.834  -5.254   9.465
   97    HB2  ALA  13           HB2      ALA  13  57.491  -5.338   7.830
   98    HB3  ALA  13           HB3      ALA  13  55.879  -4.675   8.100
   99    H    THR  14           HN       THR  14  58.838  -5.473   9.158
  100    HA   THR  14           HA       THR  14  61.025  -4.208  10.585
  101    HB   THR  14           HB       THR  14  62.045  -6.468  10.530
  102    HG1  THR  14           HG1      THR  14  59.818  -7.010   8.862
  103   HG21  THR  14          HG21      THR  14  60.427  -7.513  11.917
  104   HG22  THR  14          HG22      THR  14  59.087  -6.743  11.069
  105   HG23  THR  14          HG23      THR  14  60.138  -5.784  12.112
  106    H    ARG  15           HN       ARG  15  60.598  -3.139   7.911
  107    HA   ARG  15           HA       ARG  15  61.863  -2.521   6.034
  108    HE   ARG  15           HE       ARG  15  67.029  -0.595   5.145
  109    HB2  ARG  15           HB2      ARG  15  63.490  -2.114   8.006
  110    HB3  ARG  15           HB1      ARG  15  64.267  -3.613   7.499
  111    HG2  ARG  15           HG2      ARG  15  64.618  -2.699   5.249
  112    HG3  ARG  15           HG1      ARG  15  63.792  -1.210   5.710
  113    HD2  ARG  15           HD2      ARG  15  65.544  -1.031   7.592
  114    HD3  ARG  15           HD1      ARG  15  66.443  -2.260   6.703
  115   HH11  ARG  15          HH21      ARG  15  64.240   0.280   6.974
  116   HH12  ARG  15          HH22      ARG  15  64.132   1.870   6.298
  117   HH21  ARG  15          HH11      ARG  15  66.904   1.477   4.252
  118   HH22  ARG  15          HH12      ARG  15  65.640   2.549   4.757
  119    H    VAL  16           HN       VAL  16  60.637  -5.029   5.837
  120    HA   VAL  16           HA       VAL  16  62.569  -6.418   4.055
  121    HB   VAL  16           HB       VAL  16  62.684  -7.612   6.212
  122   HG11  VAL  16          HG11      VAL  16  60.326  -6.891   6.879
  123   HG12  VAL  16          HG12      VAL  16  60.749  -8.564   7.245
  124   HG13  VAL  16          HG13      VAL  16  59.738  -8.195   5.847
  125   HG21  VAL  16          HG21      VAL  16  62.683  -8.803   3.936
  126   HG22  VAL  16          HG22      VAL  16  61.013  -9.246   4.291
  127   HG23  VAL  16          HG23      VAL  16  62.316  -9.802   5.342
  128    H    MET  17           HN       MET  17  61.555  -7.394   2.278
  129    HA   MET  17           HA       MET  17  59.857  -7.576   0.661
  130    HB2  MET  17           HB2      MET  17  59.214  -9.390   2.230
  131    HB3  MET  17           HB1      MET  17  58.229  -8.240   3.134
  132    HG2  MET  17           HG2      MET  17  56.752  -7.906   1.278
  133    HG3  MET  17           HG1      MET  17  57.837  -8.757   0.179
  134    HE1  MET  17           HE1      MET  17  55.230 -10.442   3.520
  135    HE2  MET  17           HE2      MET  17  55.769  -8.787   3.251
  136    HE3  MET  17           HE3      MET  17  56.877  -9.965   3.951
  137    H    GLY  18           HN       GLY  18  59.756  -5.326   0.108
  138    HA2  GLY  18           HA2      GLY  18  57.255  -4.084   0.216
  139    HA3  GLY  18           HA1      GLY  18  58.148  -3.443   1.597
  140    H    GLY  19           HN       GLY  19  57.653  -3.164  -1.762
  141    HA2  GLY  19           HA2      GLY  19  58.920  -0.753  -2.162
  142    HA3  GLY  19           HA1      GLY  19  60.220  -1.924  -2.393
  143    HA   PRO  20           HA       PRO  20  56.535  -2.824  -5.635
  144    HB2  PRO  20           HB2      PRO  20  55.904   0.092  -5.914
  145    HB3  PRO  20           HB1      PRO  20  54.831  -1.313  -6.065
  146    HG2  PRO  20           HG2      PRO  20  54.813   0.216  -3.890
  147    HG3  PRO  20           HG1      PRO  20  54.589  -1.538  -3.788
  148    HD2  PRO  20           HD2      PRO  20  56.965   0.099  -3.033
  149    HD3  PRO  20           HD1      PRO  20  56.400  -1.448  -2.365
  150    H1U  RCY  21           H1U      RCY  21  61.444   7.044  -5.905
  151    H1S  RCY  21           H1S      RCY  21  61.904   2.889  -4.748
  152    HB1  RCY  21           HB1      RCY  21  59.319   1.510  -7.829
  153    HB2  RCY  21           HB2      RCY  21  61.065   1.266  -7.886
  154    HA   RCY  21           HA       RCY  21  59.564  -0.785  -8.354
  155    HN1  RCY  21           HN1      RCY  21  59.184  -0.738  -5.383
  156    H    THR  22           HN       THR  22  60.909  -2.562  -8.534
  157    HA   THR  22           HA       THR  22  63.032  -3.074  -6.607
  158    HB   THR  22           HB       THR  22  63.419  -5.047  -7.796
  159    HG1  THR  22           HG1      THR  22  63.057  -3.381  -9.913
  160   HG21  THR  22          HG21      THR  22  61.021  -4.829  -7.049
  161   HG22  THR  22          HG22      THR  22  61.262  -5.952  -8.387
  162   HG23  THR  22          HG23      THR  22  60.615  -4.340  -8.694
  163    HA   PRO  23           HA       PRO  23  66.091  -0.225  -8.160
  164    HB2  PRO  23           HB2      PRO  23  67.883  -2.611  -7.802
  165    HB3  PRO  23           HB1      PRO  23  68.131  -0.930  -7.293
  166    HG2  PRO  23           HG2      PRO  23  67.360  -2.830  -5.578
  167    HG3  PRO  23           HG1      PRO  23  66.801  -1.156  -5.440
  168    HD2  PRO  23           HD2      PRO  23  65.286  -3.566  -6.260
  169    HD3  PRO  23           HD1      PRO  23  64.686  -2.021  -5.619
  170    H    ARG  24           HN       ARG  24  67.608  -3.206  -9.276
  171    HA   ARG  24           HA       ARG  24  66.601  -3.491 -11.860
  172    HE   ARG  24           HE       ARG  24  66.355   0.523 -11.741
  173    HB2  ARG  24           HB2      ARG  24  68.125  -1.019 -11.557
  174    HB3  ARG  24           HB1      ARG  24  68.883  -2.078 -12.740
  175    HG2  ARG  24           HG2      ARG  24  66.970  -2.126 -14.113
  176    HG3  ARG  24           HG1      ARG  24  65.910  -1.586 -12.810
  177    HD2  ARG  24           HD2      ARG  24  68.131   0.154 -13.895
  178    HD3  ARG  24           HD1      ARG  24  66.509   0.165 -14.587
  179   HH11  ARG  24          HH21      ARG  24  67.258   2.055 -14.694
  180   HH12  ARG  24          HH22      ARG  24  66.922   3.655 -14.122
  181   HH21  ARG  24          HH11      ARG  24  65.911   2.603 -10.976
  182   HH22  ARG  24          HH12      ARG  24  66.159   3.965 -12.017
  183    H    LYS  25           HN       LYS  25  67.661  -5.231 -12.799
  184    HA   LYS  25           HA       LYS  25  69.489  -6.780 -11.357
  185    HB2  LYS  25           HB2      LYS  25  69.721  -8.111 -13.276
  186    HB3  LYS  25           HB1      LYS  25  68.171  -7.321 -13.555
  187    HG2  LYS  25           HG2      LYS  25  69.513  -5.501 -14.787
  188    HG3  LYS  25           HG1      LYS  25  70.854  -6.647 -14.771
  189    HD2  LYS  25           HD2      LYS  25  69.038  -8.315 -15.715
  190    HD3  LYS  25           HD1      LYS  25  68.224  -6.828 -16.202
  191    HE2  LYS  25           HE2      LYS  25  69.654  -7.571 -18.026
  192    HE3  LYS  25           HE1      LYS  25  70.335  -6.100 -17.331
  193    HZ1  LYS  25           HZ1      LYS  25  71.243  -8.523 -16.069
  194    HZ2  LYS  25           HZ2      LYS  25  72.132  -7.181 -16.613
  195    HZ3  LYS  25           HZ3      LYS  25  71.684  -8.405 -17.703
  196    H    GLY  26           HN       GLY  26  70.108  -4.109 -13.566
  197    HA2  GLY  26           HA2      GLY  26  73.031  -4.351 -12.978
  198    HA3  GLY  26           HA1      GLY  26  72.373  -3.563 -14.415
  199    HA   PRO  27           HA       PRO  27  72.035  -0.886 -10.239
  200    HB2  PRO  27           HB2      PRO  27  75.010  -0.850 -10.039
  201    HB3  PRO  27           HB1      PRO  27  73.793  -0.891  -8.749
  202    HG2  PRO  27           HG2      PRO  27  75.217  -3.045  -9.383
  203    HG3  PRO  27           HG1      PRO  27  73.515  -3.170  -8.906
  204    HD2  PRO  27           HD2      PRO  27  74.727  -3.395 -11.638
  205    HD3  PRO  27           HD1      PRO  27  73.328  -4.251 -10.949
  206    HA   PRO  28           HA       PRO  28  72.501   2.272 -13.453
  207    HB2  PRO  28           HB2      PRO  28  72.177   4.004 -11.025
  208    HB3  PRO  28           HB1      PRO  28  71.373   4.117 -12.604
  209    HG2  PRO  28           HG2      PRO  28  70.134   3.100 -10.471
  210    HG3  PRO  28           HG1      PRO  28  69.861   2.461 -12.100
  211    HD2  PRO  28           HD2      PRO  28  71.346   1.239  -9.834
  212    HD3  PRO  28           HD1      PRO  28  70.548   0.454 -11.214
  213    H    LYS  29           HN       LYS  29  74.419   3.080 -14.209
  214    HA   LYS  29           HA       LYS  29  76.832   3.001 -12.692
  215    HB2  LYS  29           HB2      LYS  29  76.253   4.684 -15.149
  216    HB3  LYS  29           HB1      LYS  29  77.843   4.189 -14.568
  217    HG2  LYS  29           HG2      LYS  29  76.981   1.773 -14.790
  218    HG3  LYS  29           HG1      LYS  29  75.664   2.460 -15.741
  219    HD2  LYS  29           HD2      LYS  29  78.608   2.870 -16.338
  220    HD3  LYS  29           HD1      LYS  29  77.573   1.701 -17.159
  221    HE2  LYS  29           HE2      LYS  29  76.032   3.711 -17.669
  222    HE3  LYS  29           HE1      LYS  29  77.412   4.714 -17.222
  223    HZ1  LYS  29           HZ1      LYS  29  78.246   2.650 -18.955
  224    HZ2  LYS  29           HZ2      LYS  29  78.331   4.332 -19.181
  225    HZ3  LYS  29           HZ3      LYS  29  76.942   3.477 -19.658
  226    H1U  RCY  30           H1U      RCY  30  76.560   6.156  -2.956
  227    H1S  RCY  30           H1S      RCY  30  76.929   7.556  -7.525
  228    HB1  RCY  30           HB1      RCY  30  77.975   7.171  -9.144
  229    HB2  RCY  30           HB2      RCY  30  77.812   5.448  -9.473
  230    HA   RCY  30           HA       RCY  30  76.580   7.325 -11.434
  231    HN1  RCY  30           HN1      RCY  30  78.138   4.838 -11.967
  232    H    LYS  31           HN       LYS  31  79.828   6.105 -10.574
  233    HA   LYS  31           HA       LYS  31  80.982   8.645 -11.564
  234    HB2  LYS  31           HB2      LYS  31  82.139   6.285 -10.058
  235    HB3  LYS  31           HB1      LYS  31  83.144   7.584 -10.698
  236    HG2  LYS  31           HG2      LYS  31  82.556   8.028  -8.348
  237    HG3  LYS  31           HG1      LYS  31  81.827   9.234  -9.409
  238    HD2  LYS  31           HD2      LYS  31  79.688   8.432  -9.085
  239    HD3  LYS  31           HD1      LYS  31  80.238   6.778  -8.811
  240    HE2  LYS  31           HE2      LYS  31  79.351   8.174  -6.780
  241    HE3  LYS  31           HE1      LYS  31  80.805   7.196  -6.578
  242    HZ1  LYS  31           HZ1      LYS  31  81.697   9.585  -7.572
  243    HZ2  LYS  31           HZ2      LYS  31  81.806   9.060  -5.960
  244    HZ3  LYS  31           HZ3      LYS  31  80.500  10.028  -6.455
  245    H    GLN  32           HN       GLN  32  83.406   6.508 -11.953
  246    HA   GLN  32           HA       GLN  32  82.670   5.390 -14.562
  247    HB2  GLN  32           HB2      GLN  32  84.652   7.670 -14.309
  248    HB3  GLN  32           HB1      GLN  32  84.571   6.609 -15.715
  249    HG2  GLN  32           HG2      GLN  32  82.076   7.217 -15.827
  250    HG3  GLN  32           HG1      GLN  32  82.459   8.515 -14.696
  251   HE21  GLN  32          HE21      GLN  32  84.791   9.595 -15.541
  252   HE22  GLN  32          HE22      GLN  32  84.710  10.097 -17.161
  253    H    ARG  33           HN       ARG  33  83.305   3.648 -12.859
  254    HA   ARG  33           HA       ARG  33  84.846   2.038 -12.132
  255    HE   ARG  33           HE       ARG  33  85.726   2.921 -17.270
  256    HB2  ARG  33           HB2      ARG  33  86.425   3.127 -14.487
  257    HB3  ARG  33           HB1      ARG  33  86.760   1.613 -13.646
  258    HG2  ARG  33           HG2      ARG  33  84.559   0.744 -14.269
  259    HG3  ARG  33           HG1      ARG  33  84.153   2.275 -15.047
  260    HD2  ARG  33           HD2      ARG  33  86.370   0.373 -15.862
  261    HD3  ARG  33           HD1      ARG  33  84.878   0.687 -16.749
  262   HH11  ARG  33          HH21      ARG  33  87.858   0.788 -15.600
  263   HH12  ARG  33          HH22      ARG  33  89.285   1.680 -16.009
  264   HH21  ARG  33          HH11      ARG  33  87.577   4.098 -17.814
  265   HH22  ARG  33          HH12      ARG  33  89.126   3.554 -17.262
  266    H    GLN  34           HN       GLN  34  86.838   1.832 -10.906
  267    HA   GLN  34           HA       GLN  34  88.178   2.738  -9.184
  268    HB2  GLN  34           HB2      GLN  34  90.078   4.009 -10.067
  269    HB3  GLN  34           HB1      GLN  34  89.692   2.672 -11.147
  270    HG2  GLN  34           HG2      GLN  34  88.562   4.133 -12.689
  271    HG3  GLN  34           HG1      GLN  34  88.624   5.478 -11.550
  272   HE21  GLN  34          HE21      GLN  34  90.845   3.264 -13.335
  273   HE22  GLN  34          HE22      GLN  34  92.072   4.421 -13.535
  274    H    THR  35           HN       THR  35  85.620   4.204  -9.851
  275    HA   THR  35           HA       THR  35  84.766   6.461  -9.693
  276    HB   THR  35           HB       THR  35  84.128   5.269  -7.702
  277    HG1  THR  35           HG1      THR  35  84.316   7.764  -7.804
  278   HG21  THR  35          HG21      THR  35  86.963   5.855  -6.836
  279   HG22  THR  35          HG22      THR  35  86.178   4.284  -6.995
  280   HG23  THR  35          HG23      THR  35  85.708   5.376  -5.692
  281    H    ARG  36           HN       ARG  36  86.069   7.750  -7.093
  282    HA   ARG  36           HA       ARG  36  88.492   8.914  -8.324
  283    HE   ARG  36           HE       ARG  36  83.418  12.094  -9.042
  284    HB2  ARG  36           HB2      ARG  36  87.562  11.242  -7.696
  285    HB3  ARG  36           HB1      ARG  36  86.927  10.491  -9.160
  286    HG2  ARG  36           HG2      ARG  36  84.920   9.808  -8.055
  287    HG3  ARG  36           HG1      ARG  36  85.585  10.188  -6.466
  288    HD2  ARG  36           HD2      ARG  36  85.055  12.383  -6.648
  289    HD3  ARG  36           HD1      ARG  36  85.633  12.468  -8.312
  290   HH11  ARG  36          HH21      ARG  36  83.861  11.273  -5.723
  291   HH12  ARG  36          HH22      ARG  36  82.177  10.997  -5.429
  292   HH21  ARG  36          HH11      ARG  36  81.216  11.739  -8.677
  293   HH22  ARG  36          HH12      ARG  36  80.679  11.261  -7.101
  294    H    GLN  37           HN       GLN  37  87.868   7.185  -6.037
  295    HA   GLN  37           HA       GLN  37  88.523   6.967  -3.795
  296    HB2  GLN  37           HB2      GLN  37  89.946   9.616  -4.155
  297    HB3  GLN  37           HB1      GLN  37  90.344   8.319  -3.030
  298    HG2  GLN  37           HG2      GLN  37  90.913   6.837  -4.902
  299    HG3  GLN  37           HG1      GLN  37  90.466   8.098  -6.052
  300   HE21  GLN  37          HE21      GLN  37  91.855  10.049  -6.134
  301   HE22  GLN  37          HE22      GLN  37  93.444   9.995  -5.540
  302    H1U  RCY  38           H1U      RCY  38  83.716   4.593   1.899
  303    H1S  RCY  38           H1S      RCY  38  83.339   8.442   0.723
  304    HB1  RCY  38           HB1      RCY  38  84.179   7.358  -1.733
  305    HB2  RCY  38           HB2      RCY  38  83.831   8.240  -3.220
  306    HA   RCY  38           HA       RCY  38  85.408  10.032  -2.472
  307    HN1  RCY  38           HN1      RCY  38  86.290   7.329  -3.159
  308    H    LYS  39           HN       LYS  39  87.861   8.941  -1.173
  309    HA   LYS  39           HA       LYS  39  86.989   8.721   1.665
  310    HB2  LYS  39           HB2      LYS  39  89.595   8.171   0.231
  311    HB3  LYS  39           HB1      LYS  39  89.495   8.248   1.990
  312    HG2  LYS  39           HG2      LYS  39  89.229   5.935   1.371
  313    HG3  LYS  39           HG1      LYS  39  87.641   6.525   1.863
  314    HD2  LYS  39           HD2      LYS  39  86.876   6.677  -0.369
  315    HD3  LYS  39           HD1      LYS  39  88.512   6.601  -1.025
  316    HE2  LYS  39           HE2      LYS  39  87.053   4.346   0.385
  317    HE3  LYS  39           HE1      LYS  39  87.380   4.448  -1.345
  318    HZ1  LYS  39           HZ1      LYS  39  89.167   3.790   0.844
  319    HZ2  LYS  39           HZ2      LYS  39  89.822   4.799  -0.356
  320    HZ3  LYS  39           HZ3      LYS  39  89.193   3.276  -0.773
  321    H    SER  40           HN       SER  40  88.024  10.106   3.263
  322    HA   SER  40           HA       SER  40  89.839  12.162   2.874
  323    HG   SER  40           HG       SER  40  87.533  14.107   3.698
  324    HB2  SER  40           HB2      SER  40  88.754  13.390   1.257
  325    HB3  SER  40           HB1      SER  40  87.164  12.798   1.728
  326    H    LYS  41           HN       LYS  41  86.863  11.101   4.400
  327    HA   LYS  41           HA       LYS  41  87.041  13.038   6.568
  328    HB2  LYS  41           HB2      LYS  41  85.497  10.436   6.466
  329    HB3  LYS  41           HB1      LYS  41  85.203  11.793   7.555
  330    HG2  LYS  41           HG2      LYS  41  85.029  13.138   5.267
  331    HG3  LYS  41           HG1      LYS  41  84.613  11.544   4.635
  332    HD2  LYS  41           HD2      LYS  41  82.507  12.222   5.276
  333    HD3  LYS  41           HD1      LYS  41  83.042  11.528   6.807
  334    HE2  LYS  41           HE2      LYS  41  82.906  14.428   6.001
  335    HE3  LYS  41           HE1      LYS  41  82.241  13.649   7.437
  336    HZ1  LYS  41           HZ1      LYS  41  84.402  13.366   8.331
  337    HZ2  LYS  41           HZ2      LYS  41  84.293  14.983   7.821
  338    HZ3  LYS  41           HZ3      LYS  41  85.147  13.850   6.886
  339    HA   PRO  42           HA       PRO  42  89.948  11.047   9.236
  340    HB2  PRO  42           HB2      PRO  42  88.090  11.353  11.529
  341    HB3  PRO  42           HB1      PRO  42  89.703  12.046  11.289
  342    HG2  PRO  42           HG2      PRO  42  87.466  13.517  11.146
  343    HG3  PRO  42           HG1      PRO  42  88.904  13.868  10.175
  344    HD2  PRO  42           HD2      PRO  42  86.322  12.614   9.331
  345    HD3  PRO  42           HD1      PRO  42  87.417  13.672   8.413
  346    HA   PRO  43           HA       PRO  43  88.698   6.854   9.961
  347    HB2  PRO  43           HB2      PRO  43  90.263   6.074  12.047
  348    HB3  PRO  43           HB1      PRO  43  90.921   6.415  10.434
  349    HG2  PRO  43           HG2      PRO  43  90.948   8.103  12.880
  350    HG3  PRO  43           HG1      PRO  43  92.192   7.893  11.637
  351    HD2  PRO  43           HD2      PRO  43  90.475  10.063  11.761
  352    HD3  PRO  43           HD1      PRO  43  91.288   9.516  10.279
  353    H    LYS  44           HN       LYS  44  87.700   5.316  11.556
  354    HA   LYS  44           HA       LYS  44  86.753   6.414  14.099
  355    HB2  LYS  44           HB2      LYS  44  85.233   7.036  11.888
  356    HB3  LYS  44           HB1      LYS  44  84.456   5.557  12.446
  357    HG2  LYS  44           HG2      LYS  44  85.079   7.925  14.236
  358    HG3  LYS  44           HG1      LYS  44  83.507   7.641  13.487
  359    HD2  LYS  44           HD2      LYS  44  83.436   5.401  14.603
  360    HD3  LYS  44           HD1      LYS  44  84.932   5.813  15.442
  361    HE2  LYS  44           HE2      LYS  44  83.908   7.513  16.700
  362    HE3  LYS  44           HE1      LYS  44  82.551   7.652  15.581
  363    HZ1  LYS  44           HZ1      LYS  44  82.259   6.402  17.816
  364    HZ2  LYS  44           HZ2      LYS  44  83.009   5.117  16.996
  365    HZ3  LYS  44           HZ3      LYS  44  81.558   5.773  16.405
  366    H    LYS  45           HN       LYS  45  86.607   3.842  11.662
  367    HA   LYS  45           HA       LYS  45  86.756   1.852  13.839
  368    HB2  LYS  45           HB2      LYS  45  84.331   2.134  13.503
  369    HB3  LYS  45           HB1      LYS  45  84.528   1.821  11.779
  370    HG2  LYS  45           HG2      LYS  45  85.103  -0.436  12.128
  371    HG3  LYS  45           HG1      LYS  45  85.503  -0.167  13.825
  372    HD2  LYS  45           HD2      LYS  45  82.710   0.448  12.997
  373    HD3  LYS  45           HD1      LYS  45  83.164  -1.256  13.054
  374    HE2  LYS  45           HE2      LYS  45  82.235  -0.127  15.222
  375    HE3  LYS  45           HE1      LYS  45  83.640  -1.186  15.348
  376    HZ1  LYS  45           HZ1      LYS  45  84.451   0.609  16.432
  377    HZ2  LYS  45           HZ2      LYS  45  83.466   1.715  15.599
  378    HZ3  LYS  45           HZ3      LYS  45  84.861   1.089  14.858
  379    H    GLY  46           HN       GLY  46  85.692   1.209  10.536
  380    HA2  GLY  46           HA2      GLY  46  87.929  -0.598  10.120
  381    HA3  GLY  46           HA1      GLY  46  86.699  -0.188   8.925
  382    H    VAL  47           HN       VAL  47  89.757   0.863  10.350
  383    HA   VAL  47           HA       VAL  47  90.031   2.994   8.314
  384    HB   VAL  47           HB       VAL  47  91.993   3.678   9.529
  385   HG11  VAL  47          HG11      VAL  47  89.811   2.737  11.414
  386   HG12  VAL  47          HG12      VAL  47  89.893   4.299  10.601
  387   HG13  VAL  47          HG13      VAL  47  91.073   3.891  11.846
  388   HG21  VAL  47          HG21      VAL  47  93.143   1.657   9.967
  389   HG22  VAL  47          HG22      VAL  47  91.747   0.936  10.768
  390   HG23  VAL  47          HG23      VAL  47  92.657   2.219  11.566
  391    H    GLN  48           HN       GLN  48  91.104   2.652   6.425
  392    HA   GLN  48           HA       GLN  48  93.424   0.964   6.199
  393    HB2  GLN  48           HB2      GLN  48  91.638  -0.786   6.390
  394    HB3  GLN  48           HB1      GLN  48  90.892  -0.129   4.936
  395    HG2  GLN  48           HG2      GLN  48  93.139  -0.476   3.780
  396    HG3  GLN  48           HG1      GLN  48  93.617  -1.413   5.195
  397   HE21  GLN  48          HE21      GLN  48  91.444  -2.935   5.823
  398   HE22  GLN  48          HE22      GLN  48  90.959  -3.899   4.512
  399    H    GLY  49           HN       GLY  49  91.275   0.750   3.516
  400    HA2  GLY  49           HA2      GLY  49  91.318   3.144   2.197
  401    HA3  GLY  49           HA1      GLY  49  92.973   2.574   1.975
  402    H1U  RCY  50           H1U      RCY  50  87.013  -4.986  -3.689
  403    H1S  RCY  50           H1S      RCY  50  89.650  -1.239  -2.111
  404    HB1  RCY  50           HB1      RCY  50  91.156  -0.985  -0.583
  405    HB2  RCY  50           HB2      RCY  50  92.759  -0.315  -0.882
  406    HA   RCY  50           HA       RCY  50  91.491   1.478  -2.286
  407    HN1  RCY  50           HN1      RCY  50  91.915   2.746  -0.352
  408    H    GLY  51           HN       GLY  51  89.450   1.658   0.430
  409    HA2  GLY  51           HA2      GLY  51  87.067   2.137  -0.768
  410    HA3  GLY  51           HA1      GLY  51  87.149   0.380  -0.894
  411    H    ASP  52           HN       ASP  52  87.817   2.831   1.643
  412    HA   ASP  52           HA       ASP  52  85.751   1.932   3.388
  413    HB2  ASP  52           HB2      ASP  52  87.437   0.871   5.097
  414    HB3  ASP  52           HB1      ASP  52  86.815  -0.117   3.775
  415    H    ASP  53           HN       ASP  53  88.692   2.235   5.093
  416    HA   ASP  53           HA       ASP  53  89.647   4.002   6.301
  417    HB2  ASP  53           HB2      ASP  53  88.225   5.907   4.433
  418    HB3  ASP  53           HB1      ASP  53  89.733   6.158   5.311
  419    H    ILE  54           HN       ILE  54  86.280   4.603   5.317
  420    HA   ILE  54           HA       ILE  54  85.543   4.940   8.149
  421    HB   ILE  54           HB       ILE  54  86.157   7.233   7.421
  422   HG12  ILE  54          HG12      ILE  54  83.843   8.270   7.795
  423   HG13  ILE  54          HG11      ILE  54  83.223   6.619   7.835
  424   HG21  ILE  54          HG21      ILE  54  83.871   7.383   5.537
  425   HG22  ILE  54          HG22      ILE  54  85.273   6.478   4.967
  426   HG23  ILE  54          HG23      ILE  54  85.451   8.163   5.455
  427   HD11  ILE  54          HD11      ILE  54  85.548   7.442   9.569
  428   HD12  ILE  54          HD12      ILE  54  84.453   6.075   9.773
  429   HD13  ILE  54          HD13      ILE  54  83.885   7.714  10.090
  430    HA   PRO  55           HA       PRO  55  82.393   2.865   5.488
  431    HB2  PRO  55           HB2      PRO  55  82.312   0.488   6.789
  432    HB3  PRO  55           HB1      PRO  55  83.554   0.864   5.580
  433    HG2  PRO  55           HG2      PRO  55  83.752   0.805   8.535
  434    HG3  PRO  55           HG1      PRO  55  84.963   0.400   7.310
  435    HD2  PRO  55           HD2      PRO  55  84.817   2.822   8.737
  436    HD3  PRO  55           HD1      PRO  55  85.776   2.535   7.269
  437    H    GLY  56           HN       GLY  56  81.263   4.699   6.843
  438    HA2  GLY  56           HA2      GLY  56  79.019   3.500   8.205
  439    HA3  GLY  56           HA1      GLY  56  80.093   4.303   9.352
  440    H    MET  57           HN       MET  57  80.689   6.106   6.799
  441    HA   MET  57           HA       MET  57  78.200   7.660   6.656
  442    HB2  MET  57           HB2      MET  57  79.055   9.670   7.656
  443    HB3  MET  57           HB1      MET  57  79.340   8.367   8.808
  444    HG2  MET  57           HG2      MET  57  81.630   8.266   7.301
  445    HG3  MET  57           HG1      MET  57  81.283   9.996   7.298
  446    HE1  MET  57           HE1      MET  57  79.987  10.829   9.420
  447    HE2  MET  57           HE2      MET  57  81.570  11.580   9.604
  448    HE3  MET  57           HE3      MET  57  80.795  10.822  10.993
  449    H    GLU  58           HN       GLU  58  81.374   6.864   5.579
  450    HA   GLU  58           HA       GLU  58  80.846   8.001   2.963
  451    HB2  GLU  58           HB2      GLU  58  82.202   9.651   4.908
  452    HB3  GLU  58           HB1      GLU  58  83.322   9.252   3.608
  453    HG2  GLU  58           HG2      GLU  58  80.516  10.259   3.090
  454    HG3  GLU  58           HG1      GLU  58  81.905  11.338   3.232
  455    H    GLY  59           HN       GLY  59  83.403   8.050   1.912
  456    HA2  GLY  59           HA2      GLY  59  85.329   6.711   1.490
  457    HA3  GLY  59           HA1      GLY  59  84.852   5.653   2.819
  458    H1U  RCY  60           H1U      RCY  60  79.675  -2.087   1.852
  459    H1S  RCY  60           H1S      RCY  60  81.980   0.967   3.132
  460    HB1  RCY  60           HB1      RCY  60  82.995   1.245   0.549
  461    HB2  RCY  60           HB2      RCY  60  81.875   2.433  -0.112
  462    HA   RCY  60           HA       RCY  60  84.722   2.340  -0.403
  463    HN1  RCY  60           HN1      RCY  60  85.287   3.845   1.331
  464    H    GLY  61           HN       GLY  61  85.298   4.494  -1.753
  465    HA2  GLY  61           HA2      GLY  61  83.117   5.784  -3.126
  466    HA3  GLY  61           HA1      GLY  61  84.806   5.815  -3.634
  467    H    THR  62           HN       THR  62  85.371   3.189  -4.137
  468    HA   THR  62           HA       THR  62  84.014   2.752  -6.653
  469    HB   THR  62           HB       THR  62  86.398   2.108  -6.192
  470    HG1  THR  62           HG1      THR  62  85.522  -0.319  -6.843
  471   HG21  THR  62          HG21      THR  62  85.582   1.103  -3.880
  472   HG22  THR  62          HG22      THR  62  86.965   0.407  -4.724
  473   HG23  THR  62          HG23      THR  62  85.383  -0.362  -4.841
  474    H    ASP  63           HN       ASP  63  82.141   2.760  -4.479
  475    HA   ASP  63           HA       ASP  63  81.445   0.057  -3.728
  476    HB2  ASP  63           HB2      ASP  63  80.720   2.305  -2.631
  477    HB3  ASP  63           HB1      ASP  63  79.460   2.324  -3.862
  478    H    ILE  64           HN       ILE  64  80.804   2.038  -6.525
  479    HA   ILE  64           HA       ILE  64  78.691   0.183  -7.463
  480    HB   ILE  64           HB       ILE  64  77.953   2.301  -8.006
  481   HG12  ILE  64          HG12      ILE  64  78.607   0.884 -10.135
  482   HG13  ILE  64          HG11      ILE  64  78.096   2.562 -10.322
  483   HG21  ILE  64          HG21      ILE  64  80.886   2.994  -8.229
  484   HG22  ILE  64          HG22      ILE  64  79.707   3.599  -7.065
  485   HG23  ILE  64          HG23      ILE  64  79.623   4.109  -8.751
  486   HD11  ILE  64          HD11      ILE  64  80.364   1.638 -11.422
  487   HD12  ILE  64          HD12      ILE  64  80.996   2.075  -9.834
  488   HD13  ILE  64          HD13      ILE  64  80.215   3.296 -10.839
  489    H    THR  65           HN       THR  65  81.730  -0.293  -7.272
  490    HA   THR  65           HA       THR  65  83.226  -0.539  -9.459
  491    HB   THR  65           HB       THR  65  82.528  -3.171  -8.183
  492    HG1  THR  65           HG1      THR  65  83.479  -2.557  -6.314
  493   HG21  THR  65          HG21      THR  65  85.249  -1.937  -8.521
  494   HG22  THR  65          HG22      THR  65  84.423  -2.649  -9.907
  495   HG23  THR  65          HG23      THR  65  84.798  -3.642  -8.499
  496    H    VAL  66           HN       VAL  66  81.530  -0.126 -11.159
  497    HA   VAL  66           HA       VAL  66  80.472  -0.883 -13.103
  498    HB   VAL  66           HB       VAL  66  81.060  -3.746 -12.470
  499   HG11  VAL  66          HG11      VAL  66  81.474  -1.989 -14.909
  500   HG12  VAL  66          HG12      VAL  66  80.092  -3.050 -14.634
  501   HG13  VAL  66          HG13      VAL  66  81.701  -3.737 -14.853
  502   HG21  VAL  66          HG21      VAL  66  83.163  -3.159 -11.779
  503   HG22  VAL  66          HG22      VAL  66  83.072  -1.564 -12.526
  504   HG23  VAL  66          HG23      VAL  66  83.448  -2.978 -13.510
  505    H    ILE  67           HN       ILE  67  79.943  -2.888 -10.214
  506    HA   ILE  67           HA       ILE  67  77.016  -2.734 -10.738
  507    HB   ILE  67           HB       ILE  67  78.591  -5.239 -10.061
  508   HG12  ILE  67          HG12      ILE  67  76.560  -4.748 -12.253
  509   HG13  ILE  67          HG11      ILE  67  78.290  -4.491 -12.483
  510   HG21  ILE  67          HG21      ILE  67  76.442  -4.840  -8.699
  511   HG22  ILE  67          HG22      ILE  67  76.547  -6.356  -9.595
  512   HG23  ILE  67          HG23      ILE  67  75.582  -5.022 -10.228
  513   HD11  ILE  67          HD11      ILE  67  77.119  -7.104 -11.496
  514   HD12  ILE  67          HD12      ILE  67  78.775  -6.803 -12.024
  515   HD13  ILE  67          HD13      ILE  67  77.458  -6.776 -13.196
  516    H1U  RCY  68           H1U      RCY  68  73.017  -1.719  -1.614
  517    H1S  RCY  68           H1S      RCY  68  76.160  -1.240  -4.404
  518    HB1  RCY  68           HB1      RCY  68  75.251  -0.347  -6.443
  519    HB2  RCY  68           HB2      RCY  68  76.414   0.340  -7.577
  520    HA   RCY  68           HA       RCY  68  77.897  -1.663  -6.449
  521    HN1  RCY  68           HN1      RCY  68  76.537  -1.368  -8.992
  522    HA   PRO  69           HA       PRO  69  75.384  -5.113  -5.165
  523    HB2  PRO  69           HB2      PRO  69  76.228  -5.279  -2.573
  524    HB3  PRO  69           HB1      PRO  69  77.215  -5.817  -3.946
  525    HG2  PRO  69           HG2      PRO  69  77.378  -3.286  -2.389
  526    HG3  PRO  69           HG1      PRO  69  78.678  -4.307  -3.025
  527    HD2  PRO  69           HD2      PRO  69  77.859  -1.987  -4.247
  528    HD3  PRO  69           HD1      PRO  69  78.583  -3.350  -5.129
  529    H    TRP  70           HN       TRP  70  75.104  -1.933  -3.963
  530    HA   TRP  70           HA       TRP  70  73.037  -2.519  -1.981
  531    HD1  TRP  70           HD1      TRP  70  73.065  -1.235   0.317
  532    HE1  TRP  70           HE1      TRP  70  71.105   0.059   1.377
  533    HE3  TRP  70           HE3      TRP  70  71.759   1.757  -3.609
  534    HZ2  TRP  70           HZ2      TRP  70  69.227   2.098   0.655
  535    HZ3  TRP  70           HZ3      TRP  70  69.887   3.362  -3.398
  536    HH2  TRP  70           HH2      TRP  70  68.619   3.538  -1.275
  537    HB2  TRP  70           HB2      TRP  70  74.594  -0.508  -1.915
  538    HB3  TRP  70           HB1      TRP  70  73.644   0.163  -3.242
  539    H    GLU  71           HN       GLU  71  72.954  -2.803  -5.255
  540    HA   GLU  71           HA       GLU  71  70.114  -1.821  -5.370
  541    HB2  GLU  71           HB2      GLU  71  72.145  -2.038  -7.606
  542    HB3  GLU  71           HB1      GLU  71  70.462  -1.559  -7.812
  543    HG2  GLU  71           HG2      GLU  71  72.334  -0.117  -5.926
  544    HG3  GLU  71           HG1      GLU  71  72.152   0.351  -7.617
  545    H    ALA  72           HN       ALA  72  72.104  -4.034  -7.358
  546    HA   ALA  72           HA       ALA  72  69.843  -5.848  -7.651
  547    HB1  ALA  72           HB1      ALA  72  72.757  -6.175  -8.424
  548    HB2  ALA  72           HB2      ALA  72  71.473  -5.566  -9.468
  549    HB3  ALA  72           HB3      ALA  72  71.447  -7.243  -8.923
  550    H1U  RCY  73           H1U      RCY  73  76.259  -2.466  -3.611
  551    H1S  RCY  73           H1S      RCY  73  76.580  -6.069  -5.427
  552    HB1  RCY  73           HB1      RCY  73  74.470  -8.484  -3.760
  553    HB2  RCY  73           HB2      RCY  73  74.483  -6.720  -3.779
  554    HA   RCY  73           HA       RCY  73  72.342  -8.595  -4.782
  555    HN1  RCY  73           HN1      RCY  73  72.969  -5.978  -5.923
  556    H    ASN  74           HN       ASN  74  70.273  -6.801  -4.202
  557    HA   ASN  74           HA       ASN  74  68.978  -6.067  -2.392
  558    HB2  ASN  74           HB2      ASN  74  70.900  -7.535  -0.589
  559    HB3  ASN  74           HB1      ASN  74  69.164  -7.295  -0.385
  560   HD21  ASN  74          HD21      ASN  74  71.299  -9.689  -1.108
  561   HD22  ASN  74          HD22      ASN  74  70.346 -10.639  -2.142
  562    H    HIS  75           HN       HIS  75  70.219  -5.728   0.344
  563    HA   HIS  75           HA       HIS  75  71.053  -2.959  -0.026
  564    HD1  HIS  75           HD1      HIS  75  72.840  -2.217   2.982
  565    HD2  HIS  75           HD2      HIS  75  68.813  -1.489   2.177
  566    HE1  HIS  75           HE1      HIS  75  72.401   0.189   3.643
  567    HE2  HIS  75           HE2      HIS  75  69.953   0.644   3.158
  568    HB2  HIS  75           HB2      HIS  75  69.732  -4.132   1.958
  569    HB3  HIS  75           HB1      HIS  75  71.355  -4.399   2.591
  570    H1U  RCY  76           H1U      RCY  76  77.570   1.072   4.081
  571    H1S  RCY  76           H1S      RCY  76  78.366  -3.258   2.194
  572    HB1  RCY  76           HB1      RCY  76  75.737  -1.811   1.270
  573    HB2  RCY  76           HB2      RCY  76  74.984  -2.604  -0.113
  574    HA   RCY  76           HA       RCY  76  75.207  -4.758   1.420
  575    HN1  RCY  76           HN1      RCY  76  72.945  -3.182   2.323
  576    H    GLU  77           HN       GLU  77  73.508  -3.106   3.729
  577    HA   GLU  77           HA       GLU  77  75.504  -2.039   5.441
  578    HB2  GLU  77           HB2      GLU  77  72.829  -2.109   5.582
  579    HB3  GLU  77           HB1      GLU  77  73.174  -3.451   6.672
  580    HG2  GLU  77           HG2      GLU  77  73.171  -1.590   8.110
  581    HG3  GLU  77           HG1      GLU  77  74.886  -1.826   7.768
  582    H    LEU  78           HN       LEU  78  75.007  -3.598   7.870
  583    HA   LEU  78           HA       LEU  78  76.106  -6.270   7.285
  584    HG   LEU  78           HG       LEU  78  79.528  -6.041   8.262
  585    HB2  LEU  78           HB2      LEU  78  77.924  -4.272   7.569
  586    HB3  LEU  78           HB1      LEU  78  77.713  -4.719   9.258
  587   HD11  LEU  78          HD11      LEU  78  77.783  -7.023   9.913
  588   HD12  LEU  78          HD12      LEU  78  78.824  -8.153   9.048
  589   HD13  LEU  78          HD13      LEU  78  77.164  -7.897   8.512
  590   HD21  LEU  78          HD21      LEU  78  79.383  -7.051   6.221
  591   HD22  LEU  78          HD22      LEU  78  78.050  -5.925   5.961
  592   HD23  LEU  78          HD23      LEU  78  77.720  -7.573   6.493
  593    H    HIS  79           HN       HIS  79  74.626  -3.972   9.432
  594    HA   HIS  79           HA       HIS  79  73.743  -6.225  11.130
  595    HD1  HIS  79           HD1      HIS  79  76.341  -5.632  14.584
  596    HD2  HIS  79           HD2      HIS  79  72.488  -6.404  13.182
  597    HE1  HIS  79           HE1      HIS  79  75.242  -7.133  16.302
  598    HE2  HIS  79           HE2      HIS  79  72.896  -7.611  15.461
  599    HB2  HIS  79           HB2      HIS  79  75.937  -5.040  12.017
  600    HB3  HIS  79           HB1      HIS  79  74.799  -3.810  12.566
  601    H    GLU  80           HN       GLU  80  73.646  -2.653  10.767
  602    HA   GLU  80           HA       GLU  80  71.124  -2.329  12.066
  603    HB2  GLU  80           HB2      GLU  80  72.111  -0.594   9.794
  604    HB3  GLU  80           HB1      GLU  80  71.087  -0.127  11.149
  605    HG2  GLU  80           HG2      GLU  80  73.066  -0.800  12.652
  606    HG3  GLU  80           HG1      GLU  80  74.033  -0.789  11.177
  607    H    LEU  81           HN       LEU  81  71.569  -1.849   8.555
  608    HA   LEU  81           HA       LEU  81  68.837  -2.930   8.149
  609    HG   LEU  81           HG       LEU  81  71.005  -0.254   7.611
  610    HB2  LEU  81           HB2      LEU  81  70.488  -1.873   5.887
  611    HB3  LEU  81           HB1      LEU  81  68.758  -1.704   6.186
  612   HD11  LEU  81          HD11      LEU  81  69.956   1.740   6.681
  613   HD12  LEU  81          HD12      LEU  81  68.653   0.770   5.994
  614   HD13  LEU  81          HD13      LEU  81  70.295   0.607   5.372
  615   HD21  LEU  81          HD21      LEU  81  69.576  -0.383   9.390
  616   HD22  LEU  81          HD22      LEU  81  68.198  -0.812   8.377
  617   HD23  LEU  81          HD23      LEU  81  68.695   0.874   8.522
  618    H    ALA  82           HN       ALA  82  71.285  -4.620   8.718
  619    HA   ALA  82           HA       ALA  82  71.999  -5.992   6.282
  620    HB1  ALA  82           HB1      ALA  82  72.896  -6.047   8.889
  621    HB2  ALA  82           HB2      ALA  82  73.371  -7.200   7.644
  622    HB3  ALA  82           HB3      ALA  82  72.061  -7.595   8.757
  623    H    GLN  83           HN       GLN  83  69.108  -5.604   6.672
  624    HA   GLN  83           HA       GLN  83  67.627  -7.793   7.510
  625    HB2  GLN  83           HB2      GLN  83  67.166  -6.460   4.830
  626    HB3  GLN  83           HB1      GLN  83  65.960  -7.185   5.893
  627    HG2  GLN  83           HG2      GLN  83  67.611  -4.709   6.481
  628    HG3  GLN  83           HG1      GLN  83  65.884  -4.752   6.122
  629   HE21  GLN  83          HE21      GLN  83  68.026  -4.588   8.688
  630   HE22  GLN  83          HE22      GLN  83  67.038  -5.233   9.908
  631    H    TYR  84           HN       TYR  84  68.511  -7.479   4.068
  632    HA   TYR  84           HA       TYR  84  68.218 -10.265   3.539
  633    HD1  TYR  84           HD1      TYR  84  68.383  -6.408   2.547
  634    HD2  TYR  84           HD2      TYR  84  67.106 -10.050   0.663
  635    HE1  TYR  84           HE1      TYR  84  66.289  -5.297   1.819
  636    HE2  TYR  84           HE2      TYR  84  65.012  -8.940  -0.065
  637    HH   TYR  84           HH       TYR  84  64.589  -5.637  -0.065
  638    HB2  TYR  84           HB2      TYR  84  69.968  -8.266   2.068
  639    HB3  TYR  84           HB1      TYR  84  69.373  -9.800   1.433
  640    H    GLY  85           HN       GLY  85  71.131  -8.292   4.192
  641    HA2  GLY  85           HA2      GLY  85  73.340  -8.994   4.666
  642    HA3  GLY  85           HA1      GLY  85  72.516 -10.054   5.814
  643    H    ILE  86           HN       ILE  86  71.696 -10.466   2.523
  644    HA   ILE  86           HA       ILE  86  73.013 -13.111   2.530
  645    HB   ILE  86           HB       ILE  86  70.542 -12.694   1.914
  646   HG12  ILE  86          HG12      ILE  86  72.198 -14.104  -0.196
  647   HG13  ILE  86          HG11      ILE  86  71.934 -14.773   1.415
  648   HG21  ILE  86          HG21      ILE  86  71.342 -10.742   0.360
  649   HG22  ILE  86          HG22      ILE  86  70.018 -11.775  -0.176
  650   HG23  ILE  86          HG23      ILE  86  71.645 -12.030  -0.805
  651   HD11  ILE  86          HD11      ILE  86  69.411 -14.368   0.923
  652   HD12  ILE  86          HD12      ILE  86  70.203 -15.742   0.150
  653   HD13  ILE  86          HD13      ILE  86  69.916 -14.260  -0.763
  654    H1U  RCY  87           H1U      RCY  87  76.542  -7.429   1.707
  655    H1S  RCY  87           H1S      RCY  87  79.259 -10.356  -0.985
  656    HB1  RCY  87           HB1      RCY  87  77.046 -13.977   0.424
  657    HB2  RCY  87           HB2      RCY  87  77.552 -12.719   1.553
  658    HA   RCY  87           HA       RCY  87  76.276 -11.048   0.232
  659    HN1  RCY  87           HN1      RCY  87  75.087 -13.024   1.857
  Start of MODEL   74
    1    HA   MET   1           HA       MET   1  54.288 -21.734   2.411
    2    HB2  MET   1           HB2      MET   1  53.976 -24.297   2.071
    3    HB3  MET   1           HB1      MET   1  55.605 -24.252   1.396
    4    HG2  MET   1           HG2      MET   1  56.000 -24.682   3.672
    5    HG3  MET   1           HG1      MET   1  56.211 -22.935   3.563
    6    HE1  MET   1           HE1      MET   1  55.456 -21.619   5.402
    7    HE2  MET   1           HE2      MET   1  55.968 -23.095   6.215
    8    HE3  MET   1           HE3      MET   1  54.486 -22.288   6.720
    9    H    ASN   2           HN       ASN   2  55.651 -22.278  -0.765
   10    HA   ASN   2           HA       ASN   2  58.354 -21.480  -0.018
   11    HB2  ASN   2           HB2      ASN   2  57.777 -22.942  -2.002
   12    HB3  ASN   2           HB1      ASN   2  57.121 -21.503  -2.786
   13   HD21  ASN   2          HD21      ASN   2  60.086 -23.143  -1.866
   14   HD22  ASN   2          HD22      ASN   2  61.149 -22.032  -2.586
   15    H    LEU   3           HN       LEU   3  59.352 -19.506  -1.136
   16    HA   LEU   3           HA       LEU   3  57.731 -17.168  -0.468
   17    HG   LEU   3           HG       LEU   3  60.574 -18.642   0.111
   18    HB2  LEU   3           HB2      LEU   3  60.425 -17.168  -1.845
   19    HB3  LEU   3           HB1      LEU   3  59.716 -15.896  -0.850
   20   HD11  LEU   3          HD11      LEU   3  62.362 -16.892  -0.403
   21   HD12  LEU   3          HD12      LEU   3  62.346 -17.508   1.249
   22   HD13  LEU   3          HD13      LEU   3  61.655 -15.926   0.892
   23   HD21  LEU   3          HD21      LEU   3  60.092 -17.486   2.379
   24   HD22  LEU   3          HD22      LEU   3  58.708 -18.047   1.442
   25   HD23  LEU   3          HD23      LEU   3  59.142 -16.337   1.436
   26    H    GLU   4           HN       GLU   4  56.025 -17.199  -2.019
   27    HA   GLU   4           HA       GLU   4  56.497 -17.403  -4.853
   28    HB2  GLU   4           HB2      GLU   4  54.155 -16.035  -3.510
   29    HB3  GLU   4           HB1      GLU   4  54.190 -16.783  -5.107
   30    HG2  GLU   4           HG2      GLU   4  54.566 -18.988  -4.081
   31    HG3  GLU   4           HG1      GLU   4  54.561 -18.250  -2.479
   32    HA   PRO   5           HA       PRO   5  58.588 -13.417  -5.335
   33    HB2  PRO   5           HB2      PRO   5  57.262 -13.767  -8.009
   34    HB3  PRO   5           HB1      PRO   5  58.912 -13.226  -7.635
   35    HG2  PRO   5           HG2      PRO   5  58.410 -15.721  -8.426
   36    HG3  PRO   5           HG1      PRO   5  59.656 -15.365  -7.219
   37    HD2  PRO   5           HD2      PRO   5  57.022 -16.675  -6.850
   38    HD3  PRO   5           HD1      PRO   5  58.479 -16.768  -5.837
   39    HA   PRO   6           HA       PRO   6  54.627 -11.169  -4.827
   40    HB2  PRO   6           HB2      PRO   6  55.292  -9.748  -2.642
   41    HB3  PRO   6           HB1      PRO   6  54.896 -11.475  -2.533
   42    HG2  PRO   6           HG2      PRO   6  57.541 -10.139  -2.431
   43    HG3  PRO   6           HG1      PRO   6  56.971 -11.589  -1.591
   44    HD2  PRO   6           HD2      PRO   6  58.546 -11.537  -3.940
   45    HD3  PRO   6           HD1      PRO   6  57.713 -12.955  -3.265
   46    H    LYS   7           HN       LYS   7  54.129  -8.806  -4.908
   47    HA   LYS   7           HA       LYS   7  56.385  -7.205  -6.061
   48    HB2  LYS   7           HB2      LYS   7  53.446  -7.164  -6.814
   49    HB3  LYS   7           HB1      LYS   7  54.670  -6.070  -7.458
   50    HG2  LYS   7           HG2      LYS   7  55.904  -7.957  -8.406
   51    HG3  LYS   7           HG1      LYS   7  54.753  -9.092  -7.700
   52    HD2  LYS   7           HD2      LYS   7  53.898  -6.906  -9.605
   53    HD3  LYS   7           HD1      LYS   7  54.387  -8.505 -10.166
   54    HE2  LYS   7           HE2      LYS   7  52.324  -9.277  -9.714
   55    HE3  LYS   7           HE1      LYS   7  52.568  -8.889  -8.011
   56    HZ1  LYS   7           HZ1      LYS   7  50.779  -7.584  -8.486
   57    HZ2  LYS   7           HZ2      LYS   7  51.234  -7.331 -10.103
   58    HZ3  LYS   7           HZ3      LYS   7  52.023  -6.491  -8.855
   59    H    ALA   8           HN       ALA   8  53.832  -7.417  -3.766
   60    HA   ALA   8           HA       ALA   8  54.012  -4.510  -3.135
   61    HB1  ALA   8           HB1      ALA   8  51.758  -5.641  -3.335
   62    HB2  ALA   8           HB2      ALA   8  52.034  -4.837  -1.790
   63    HB3  ALA   8           HB3      ALA   8  52.180  -6.591  -1.911
   64    H    GLU   9           HN       GLU   9  56.279  -4.967  -2.350
   65    HA   GLU   9           HA       GLU   9  57.043  -6.649  -0.282
   66    HB2  GLU   9           HB2      GLU   9  58.574  -5.081  -1.430
   67    HB3  GLU   9           HB1      GLU   9  57.819  -3.732  -0.584
   68    HG2  GLU   9           HG2      GLU   9  58.565  -5.769   1.320
   69    HG3  GLU   9           HG1      GLU   9  59.962  -5.340   0.332
   70    H1U  RCY  10           H1U      RCY  10  57.278  -3.932   6.341
   71    H1S  RCY  10           H1S      RCY  10  52.973  -5.515   6.334
   72    HB1  RCY  10           HB1      RCY  10  53.331  -7.403   2.831
   73    HB2  RCY  10           HB2      RCY  10  52.786  -6.041   1.853
   74    HA   RCY  10           HA       RCY  10  54.604  -4.653   2.918
   75    HN1  RCY  10           HN1      RCY  10  55.411  -7.008   1.264
   76    H    ARG  11           HN       ARG  11  54.577  -4.975   5.271
   77    HA   ARG  11           HA       ARG  11  56.943  -5.969   6.363
   78    HE   ARG  11           HE       ARG  11  52.123  -6.116   9.820
   79    HB2  ARG  11           HB2      ARG  11  55.495  -6.246   8.537
   80    HB3  ARG  11           HB1      ARG  11  55.738  -4.642   7.858
   81    HG2  ARG  11           HG2      ARG  11  53.432  -4.611   8.104
   82    HG3  ARG  11           HG1      ARG  11  53.548  -5.277   6.475
   83    HD2  ARG  11           HD2      ARG  11  52.118  -6.814   7.483
   84    HD3  ARG  11           HD1      ARG  11  53.683  -7.582   7.749
   85   HH11  ARG  11          HH21      ARG  11  54.750  -8.095   8.789
   86   HH12  ARG  11          HH22      ARG  11  55.201  -8.563  10.395
   87   HH21  ARG  11          HH11      ARG  11  52.697  -6.715  11.923
   88   HH22  ARG  11          HH12      ARG  11  54.039  -7.782  12.169
   89    H    SER  12           HN       SER  12  54.336  -7.782   5.119
   90    HA   SER  12           HA       SER  12  55.017 -10.194   6.703
   91    HG   SER  12           HG       SER  12  53.468 -11.660   6.695
   92    HB2  SER  12           HB2      SER  12  52.621  -9.513   6.050
   93    HB3  SER  12           HB1      SER  12  53.041 -10.035   4.421
   94    H    ALA  13           HN       ALA  13  56.639  -8.762   4.415
   95    HA   ALA  13           HA       ALA  13  56.811 -10.719   2.297
   96    HB1  ALA  13           HB1      ALA  13  58.701  -9.465   1.525
   97    HB2  ALA  13           HB2      ALA  13  58.980  -8.777   3.125
   98    HB3  ALA  13           HB3      ALA  13  57.569  -8.287   2.188
   99    H    THR  14           HN       THR  14  59.441 -11.382   2.007
  100    HA   THR  14           HA       THR  14  59.846 -13.261   4.274
  101    HB   THR  14           HB       THR  14  60.350 -14.686   2.592
  102    HG1  THR  14           HG1      THR  14  62.343 -14.198   1.424
  103   HG21  THR  14          HG21      THR  14  60.425 -12.251   0.786
  104   HG22  THR  14          HG22      THR  14  59.010 -13.253   1.111
  105   HG23  THR  14          HG23      THR  14  60.387 -13.927   0.238
  106    H    ARG  15           HN       ARG  15  61.910 -13.400   5.329
  107    HA   ARG  15           HA       ARG  15  63.229 -10.826   5.618
  108    HE   ARG  15           HE       ARG  15  61.434 -15.578   7.997
  109    HB2  ARG  15           HB2      ARG  15  64.758 -13.008   6.776
  110    HB3  ARG  15           HB1      ARG  15  63.916 -11.694   7.591
  111    HG2  ARG  15           HG2      ARG  15  62.753 -13.554   8.396
  112    HG3  ARG  15           HG1      ARG  15  61.760 -13.094   7.013
  113    HD2  ARG  15           HD2      ARG  15  62.859 -14.759   5.613
  114    HD3  ARG  15           HD1      ARG  15  63.971 -15.166   6.920
  115   HH11  ARG  15          HH21      ARG  15  63.245 -16.635   5.260
  116   HH12  ARG  15          HH22      ARG  15  62.480 -18.187   5.186
  117   HH21  ARG  15          HH11      ARG  15  60.424 -17.599   7.917
  118   HH22  ARG  15          HH12      ARG  15  60.883 -18.733   6.690
  119    H    VAL  16           HN       VAL  16  63.712 -13.620   3.656
  120    HA   VAL  16           HA       VAL  16  66.523 -13.413   3.191
  121    HB   VAL  16           HB       VAL  16  64.551 -14.229   1.058
  122   HG11  VAL  16          HG11      VAL  16  66.289 -15.622   0.311
  123   HG12  VAL  16          HG12      VAL  16  67.095 -15.614   1.880
  124   HG13  VAL  16          HG13      VAL  16  67.153 -14.183   0.852
  125   HG21  VAL  16          HG21      VAL  16  65.284 -15.691   3.607
  126   HG22  VAL  16          HG22      VAL  16  64.648 -16.518   2.185
  127   HG23  VAL  16          HG23      VAL  16  63.669 -15.305   3.010
  128    H    MET  17           HN       MET  17  65.881 -13.164   0.137
  129    HA   MET  17           HA       MET  17  65.047 -10.547  -0.479
  130    HB2  MET  17           HB2      MET  17  67.626 -10.613   0.832
  131    HB3  MET  17           HB1      MET  17  67.835 -10.057  -0.825
  132    HG2  MET  17           HG2      MET  17  66.229  -8.292  -0.523
  133    HG3  MET  17           HG1      MET  17  65.726  -8.939   1.038
  134    HE1  MET  17           HE1      MET  17  67.322  -5.813   2.361
  135    HE2  MET  17           HE2      MET  17  66.285  -7.144   2.867
  136    HE3  MET  17           HE3      MET  17  65.983  -6.335   1.332
  137    H    GLY  18           HN       GLY  18  64.367 -12.228  -2.093
  138    HA2  GLY  18           HA2      GLY  18  66.343 -12.323  -4.318
  139    HA3  GLY  18           HA1      GLY  18  65.546 -13.819  -3.826
  140    H    GLY  19           HN       GLY  19  63.879 -14.305  -5.161
  141    HA2  GLY  19           HA2      GLY  19  61.983 -14.031  -6.517
  142    HA3  GLY  19           HA1      GLY  19  61.668 -12.552  -5.606
  143    HA   PRO  20           HA       PRO  20  64.128 -12.116  -9.985
  144    HB2  PRO  20           HB2      PRO  20  61.331 -12.264 -11.069
  145    HB3  PRO  20           HB1      PRO  20  62.863 -12.716 -11.842
  146    HG2  PRO  20           HG2      PRO  20  61.222 -14.551 -10.823
  147    HG3  PRO  20           HG1      PRO  20  62.982 -14.726 -10.729
  148    HD2  PRO  20           HD2      PRO  20  61.044 -14.096  -8.564
  149    HD3  PRO  20           HD1      PRO  20  62.650 -14.849  -8.457
  150    H1U  RCY  21           H1U      RCY  21  65.389  -2.167  -3.597
  151    H1S  RCY  21           H1S      RCY  21  63.688  -5.696  -5.175
  152    HB1  RCY  21           HB1      RCY  21  64.779  -7.457  -7.843
  153    HB2  RCY  21           HB2      RCY  21  63.670  -8.441  -6.887
  154    HA   RCY  21           HA       RCY  21  62.071  -8.139  -8.956
  155    HN1  RCY  21           HN1      RCY  21  64.231 -10.099  -8.585
  156    H    THR  22           HN       THR  22  62.651  -5.932  -9.844
  157    HA   THR  22           HA       THR  22  64.500  -6.229 -12.185
  158    HB   THR  22           HB       THR  22  62.028  -4.512 -11.827
  159    HG1  THR  22           HG1      THR  22  61.530  -6.622 -12.307
  160   HG21  THR  22          HG21      THR  22  64.088  -4.668 -14.034
  161   HG22  THR  22          HG22      THR  22  63.558  -3.240 -13.146
  162   HG23  THR  22          HG23      THR  22  62.469  -4.019 -14.293
  163    HA   PRO  23           HA       PRO  23  66.642  -3.156  -9.496
  164    HB2  PRO  23           HB2      PRO  23  68.792  -3.670 -11.485
  165    HB3  PRO  23           HB1      PRO  23  68.857  -3.734  -9.714
  166    HG2  PRO  23           HG2      PRO  23  68.890  -5.945 -11.217
  167    HG3  PRO  23           HG1      PRO  23  68.098  -5.895  -9.633
  168    HD2  PRO  23           HD2      PRO  23  66.858  -5.860 -12.362
  169    HD3  PRO  23           HD1      PRO  23  66.262  -6.604 -10.860
  170    H    ARG  24           HN       ARG  24  68.693  -1.754 -11.183
  171    HA   ARG  24           HA       ARG  24  66.815   0.123 -12.520
  172    HE   ARG  24           HE       ARG  24  70.077   2.693  -9.647
  173    HB2  ARG  24           HB2      ARG  24  69.022   1.508 -12.666
  174    HB3  ARG  24           HB1      ARG  24  68.251   1.320 -11.091
  175    HG2  ARG  24           HG2      ARG  24  69.763  -0.493 -10.510
  176    HG3  ARG  24           HG1      ARG  24  70.472  -0.466 -12.125
  177    HD2  ARG  24           HD2      ARG  24  71.981   0.762 -10.740
  178    HD3  ARG  24           HD1      ARG  24  71.088   1.971 -11.663
  179   HH11  ARG  24          HH21      ARG  24  71.651  -0.357  -9.324
  180   HH12  ARG  24          HH22      ARG  24  71.475  -0.415  -7.602
  181   HH21  ARG  24          HH11      ARG  24  69.839   2.635  -7.400
  182   HH22  ARG  24          HH12      ARG  24  70.449   1.279  -6.513
  183    H    LYS  25           HN       LYS  25  69.561  -1.995 -13.182
  184    HA   LYS  25           HA       LYS  25  68.952  -1.762 -16.081
  185    HB2  LYS  25           HB2      LYS  25  71.614  -1.197 -14.772
  186    HB3  LYS  25           HB1      LYS  25  71.531  -1.776 -16.433
  187    HG2  LYS  25           HG2      LYS  25  71.255   0.393 -17.027
  188    HG3  LYS  25           HG1      LYS  25  69.625   0.250 -16.367
  189    HD2  LYS  25           HD2      LYS  25  70.502   2.105 -15.216
  190    HD3  LYS  25           HD1      LYS  25  70.749   0.778 -14.080
  191    HE2  LYS  25           HE2      LYS  25  73.061   0.570 -14.697
  192    HE3  LYS  25           HE1      LYS  25  72.857   1.663 -16.066
  193    HZ1  LYS  25           HZ1      LYS  25  72.078   3.301 -14.234
  194    HZ2  LYS  25           HZ2      LYS  25  73.739   3.046 -14.485
  195    HZ3  LYS  25           HZ3      LYS  25  72.946   2.280 -13.193
  196    H    GLY  26           HN       GLY  26  71.669  -3.272 -14.334
  197    HA2  GLY  26           HA2      GLY  26  70.464  -5.931 -14.532
  198    HA3  GLY  26           HA1      GLY  26  71.788  -5.670 -15.668
  199    HA   PRO  27           HA       PRO  27  73.218  -7.347 -11.401
  200    HB2  PRO  27           HB2      PRO  27  75.172  -8.798 -12.960
  201    HB3  PRO  27           HB1      PRO  27  73.841  -9.451 -11.992
  202    HG2  PRO  27           HG2      PRO  27  74.012  -9.020 -14.877
  203    HG3  PRO  27           HG1      PRO  27  72.934 -10.075 -13.951
  204    HD2  PRO  27           HD2      PRO  27  72.062  -7.807 -15.199
  205    HD3  PRO  27           HD1      PRO  27  71.312  -8.433 -13.712
  206    HA   PRO  28           HA       PRO  28  76.755  -4.822 -10.662
  207    HB2  PRO  28           HB2      PRO  28  78.487  -7.266 -10.905
  208    HB3  PRO  28           HB1      PRO  28  78.510  -5.992  -9.669
  209    HG2  PRO  28           HG2      PRO  28  77.365  -8.366  -9.225
  210    HG3  PRO  28           HG1      PRO  28  76.712  -6.868  -8.543
  211    HD2  PRO  28           HD2      PRO  28  75.603  -8.571 -10.692
  212    HD3  PRO  28           HD1      PRO  28  74.782  -7.377  -9.665
  213    H    LYS  29           HN       LYS  29  77.757  -3.494 -12.117
  214    HA   LYS  29           HA       LYS  29  79.368  -4.580 -14.305
  215    HB2  LYS  29           HB2      LYS  29  78.030  -3.378 -16.068
  216    HB3  LYS  29           HB1      LYS  29  77.186  -4.748 -15.349
  217    HG2  LYS  29           HG2      LYS  29  75.922  -3.272 -13.890
  218    HG3  LYS  29           HG1      LYS  29  76.843  -1.875 -14.448
  219    HD2  LYS  29           HD2      LYS  29  74.808  -1.815 -15.684
  220    HD3  LYS  29           HD1      LYS  29  76.012  -2.459 -16.802
  221    HE2  LYS  29           HE2      LYS  29  74.406  -4.340 -15.094
  222    HE3  LYS  29           HE1      LYS  29  73.702  -3.678 -16.570
  223    HZ1  LYS  29           HZ1      LYS  29  75.733  -5.674 -16.255
  224    HZ2  LYS  29           HZ2      LYS  29  76.199  -4.439 -17.325
  225    HZ3  LYS  29           HZ3      LYS  29  74.770  -5.314 -17.605
  226    H1U  RCY  30           H1U      RCY  30  77.292   4.335  -9.083
  227    H1S  RCY  30           H1S      RCY  30  76.542   2.723 -13.294
  228    HB1  RCY  30           HB1      RCY  30  79.642   1.507 -13.585
  229    HB2  RCY  30           HB2      RCY  30  79.174   0.024 -12.753
  230    HA   RCY  30           HA       RCY  30  79.753   0.241 -15.724
  231    HN1  RCY  30           HN1      RCY  30  78.650  -1.836 -15.664
  232    H    LYS  31           HN       LYS  31  81.492   1.485 -13.977
  233    HA   LYS  31           HA       LYS  31  83.815  -0.390 -14.005
  234    HB2  LYS  31           HB2      LYS  31  85.059   1.887 -13.654
  235    HB3  LYS  31           HB1      LYS  31  84.403   1.515 -15.249
  236    HG2  LYS  31           HG2      LYS  31  82.439   2.863 -14.832
  237    HG3  LYS  31           HG1      LYS  31  82.905   3.102 -13.147
  238    HD2  LYS  31           HD2      LYS  31  84.985   4.250 -13.938
  239    HD3  LYS  31           HD1      LYS  31  84.383   4.118 -15.591
  240    HE2  LYS  31           HE2      LYS  31  83.247   5.723 -13.304
  241    HE3  LYS  31           HE1      LYS  31  83.697   6.275 -14.918
  242    HZ1  LYS  31           HZ1      LYS  31  81.491   4.369 -14.361
  243    HZ2  LYS  31           HZ2      LYS  31  81.873   5.082 -15.855
  244    HZ3  LYS  31           HZ3      LYS  31  81.274   6.036 -14.583
  245    H    GLN  32           HN       GLN  32  84.732  -0.994 -12.077
  246    HA   GLN  32           HA       GLN  32  84.018   0.561  -9.628
  247    HB2  GLN  32           HB2      GLN  32  83.722  -1.592  -8.411
  248    HB3  GLN  32           HB1      GLN  32  82.526  -1.375  -9.689
  249    HG2  GLN  32           HG2      GLN  32  84.221  -2.667 -11.184
  250    HG3  GLN  32           HG1      GLN  32  84.935  -3.183  -9.655
  251   HE21  GLN  32          HE21      GLN  32  82.225  -3.635 -11.813
  252   HE22  GLN  32          HE22      GLN  32  81.427  -4.811 -10.886
  253    H    ARG  33           HN       ARG  33  86.315  -1.263 -11.446
  254    HA   ARG  33           HA       ARG  33  88.211  -1.833  -9.385
  255    HE   ARG  33           HE       ARG  33  88.898  -3.500  -9.328
  256    HB2  ARG  33           HB2      ARG  33  88.303  -2.757 -11.716
  257    HB3  ARG  33           HB1      ARG  33  88.790  -1.161 -12.283
  258    HG2  ARG  33           HG2      ARG  33  90.915  -1.850 -11.892
  259    HG3  ARG  33           HG1      ARG  33  90.536  -1.617 -10.184
  260    HD2  ARG  33           HD2      ARG  33  90.048  -4.200 -11.694
  261    HD3  ARG  33           HD1      ARG  33  91.469  -3.891 -10.695
  262   HH11  ARG  33          HH21      ARG  33  91.513  -5.584 -10.168
  263   HH12  ARG  33          HH22      ARG  33  91.252  -6.666  -8.841
  264   HH21  ARG  33          HH11      ARG  33  88.542  -4.901  -7.590
  265   HH22  ARG  33          HH12      ARG  33  89.570  -6.279  -7.381
  266    H    GLN  34           HN       GLN  34  88.110   0.868 -11.697
  267    HA   GLN  34           HA       GLN  34  89.205   2.955 -11.619
  268    HB2  GLN  34           HB2      GLN  34  87.254   2.884  -9.794
  269    HB3  GLN  34           HB1      GLN  34  88.613   3.065  -8.685
  270    HG2  GLN  34           HG2      GLN  34  89.371   5.055  -9.944
  271    HG3  GLN  34           HG1      GLN  34  87.996   4.882 -11.036
  272   HE21  GLN  34          HE21      GLN  34  88.016   4.425  -7.475
  273   HE22  GLN  34          HE22      GLN  34  86.903   5.665  -7.155
  274    H    THR  35           HN       THR  35  90.345   3.950  -8.985
  275    HA   THR  35           HA       THR  35  92.898   2.384  -9.093
  276    HB   THR  35           HB       THR  35  92.679   5.246  -8.160
  277    HG1  THR  35           HG1      THR  35  91.837   5.233 -10.228
  278   HG21  THR  35          HG21      THR  35  95.045   5.270  -8.911
  279   HG22  THR  35          HG22      THR  35  94.896   3.575  -9.377
  280   HG23  THR  35          HG23      THR  35  94.755   4.040  -7.681
  281    H    ARG  36           HN       ARG  36  90.224   2.895  -7.217
  282    HA   ARG  36           HA       ARG  36  89.782   2.660  -4.920
  283    HE   ARG  36           HE       ARG  36  90.065  -0.541  -2.939
  284    HB2  ARG  36           HB2      ARG  36  92.293   0.997  -5.249
  285    HB3  ARG  36           HB1      ARG  36  91.343   1.031  -3.763
  286    HG2  ARG  36           HG2      ARG  36  89.326   0.389  -5.160
  287    HG3  ARG  36           HG1      ARG  36  90.437   0.115  -6.503
  288    HD2  ARG  36           HD2      ARG  36  89.959  -1.983  -5.267
  289    HD3  ARG  36           HD1      ARG  36  91.665  -1.544  -5.175
  290   HH11  ARG  36          HH21      ARG  36  91.935  -3.106  -4.284
  291   HH12  ARG  36          HH22      ARG  36  92.345  -3.791  -2.747
  292   HH21  ARG  36          HH11      ARG  36  90.590  -1.421  -0.924
  293   HH22  ARG  36          HH12      ARG  36  91.584  -2.837  -0.845
  294    H    GLN  37           HN       GLN  37  90.072   4.777  -4.156
  295    HA   GLN  37           HA       GLN  37  92.568   5.216  -2.633
  296    HB2  GLN  37           HB2      GLN  37  92.755   6.230  -5.008
  297    HB3  GLN  37           HB1      GLN  37  91.553   7.397  -4.463
  298    HG2  GLN  37           HG2      GLN  37  93.182   8.585  -3.458
  299    HG3  GLN  37           HG1      GLN  37  93.527   7.204  -2.416
  300   HE21  GLN  37          HE21      GLN  37  94.121   8.059  -5.884
  301   HE22  GLN  37          HE22      GLN  37  95.735   7.534  -5.882
  302    H1U  RCY  38           H1U      RCY  38  86.761   4.231  -0.535
  303    H1S  RCY  38           H1S      RCY  38  88.945   6.124  -2.154
  304    HB1  RCY  38           HB1      RCY  38  88.908   8.359  -2.528
  305    HB2  RCY  38           HB2      RCY  38  88.444   9.426  -1.205
  306    HA   RCY  38           HA       RCY  38  90.644   9.256  -0.621
  307    HN1  RCY  38           HN1      RCY  38  91.935   7.996  -2.112
  308    H    LYS  39           HN       LYS  39  91.413   6.116  -0.188
  309    HA   LYS  39           HA       LYS  39  89.920   5.802   2.372
  310    HB2  LYS  39           HB2      LYS  39  91.189   3.497   2.254
  311    HB3  LYS  39           HB1      LYS  39  89.783   3.768   1.226
  312    HG2  LYS  39           HG2      LYS  39  91.173   4.298  -0.670
  313    HG3  LYS  39           HG1      LYS  39  92.625   4.314   0.333
  314    HD2  LYS  39           HD2      LYS  39  90.964   1.828   0.307
  315    HD3  LYS  39           HD1      LYS  39  91.974   2.167  -1.100
  316    HE2  LYS  39           HE2      LYS  39  93.110   2.342   1.686
  317    HE3  LYS  39           HE1      LYS  39  93.013   0.793   0.848
  318    HZ1  LYS  39           HZ1      LYS  39  94.223   3.173  -0.422
  319    HZ2  LYS  39           HZ2      LYS  39  94.408   1.538  -0.845
  320    HZ3  LYS  39           HZ3      LYS  39  95.131   2.139   0.570
  321    H    SER  40           HN       SER  40  91.136   5.371   4.327
  322    HA   SER  40           HA       SER  40  92.946   5.646   5.804
  323    HG   SER  40           HG       SER  40  94.547   3.374   3.955
  324    HB2  SER  40           HB2      SER  40  94.877   5.924   3.527
  325    HB3  SER  40           HB1      SER  40  95.070   5.077   5.060
  326    H    LYS  41           HN       LYS  41  92.615   7.713   3.006
  327    HA   LYS  41           HA       LYS  41  93.362  10.053   4.693
  328    HB2  LYS  41           HB2      LYS  41  94.302  10.994   2.431
  329    HB3  LYS  41           HB1      LYS  41  95.303   9.906   3.393
  330    HG2  LYS  41           HG2      LYS  41  94.710   8.019   2.016
  331    HG3  LYS  41           HG1      LYS  41  93.486   8.959   1.163
  332    HD2  LYS  41           HD2      LYS  41  95.569   8.742  -0.169
  333    HD3  LYS  41           HD1      LYS  41  95.224  10.424   0.237
  334    HE2  LYS  41           HE2      LYS  41  97.649   9.527   0.592
  335    HE3  LYS  41           HE1      LYS  41  96.919  10.515   1.858
  336    HZ1  LYS  41           HZ1      LYS  41  98.027   8.200   2.375
  337    HZ2  LYS  41           HZ2      LYS  41  96.481   7.628   1.963
  338    HZ3  LYS  41           HZ3      LYS  41  96.667   8.744   3.230
  339    HA   PRO  42           HA       PRO  42  89.165  10.486   2.800
  340    HB2  PRO  42           HB2      PRO  42  88.378  12.430   4.650
  341    HB3  PRO  42           HB1      PRO  42  88.096  10.687   4.805
  342    HG2  PRO  42           HG2      PRO  42  90.179  12.382   6.058
  343    HG3  PRO  42           HG1      PRO  42  89.341  10.959   6.696
  344    HD2  PRO  42           HD2      PRO  42  91.908  10.854   5.783
  345    HD3  PRO  42           HD1      PRO  42  90.797   9.471   5.667
  346    HA   PRO  43           HA       PRO  43  90.006  14.128   0.426
  347    HB2  PRO  43           HB2      PRO  43  87.475  14.845  -0.333
  348    HB3  PRO  43           HB1      PRO  43  88.329  13.441  -1.005
  349    HG2  PRO  43           HG2      PRO  43  86.239  13.538   1.113
  350    HG3  PRO  43           HG1      PRO  43  86.453  12.381  -0.211
  351    HD2  PRO  43           HD2      PRO  43  87.212  11.841   2.362
  352    HD3  PRO  43           HD1      PRO  43  88.029  11.139   0.948
  353    H    LYS  44           HN       LYS  44  89.517  16.501   0.303
  354    HA   LYS  44           HA       LYS  44  89.782  17.933   2.611
  355    HB2  LYS  44           HB2      LYS  44  88.154  19.668   1.314
  356    HB3  LYS  44           HB1      LYS  44  89.821  19.373   0.819
  357    HG2  LYS  44           HG2      LYS  44  89.178  17.924  -0.924
  358    HG3  LYS  44           HG1      LYS  44  87.574  17.664  -0.237
  359    HD2  LYS  44           HD2      LYS  44  87.589  19.195  -2.237
  360    HD3  LYS  44           HD1      LYS  44  86.902  19.923  -0.785
  361    HE2  LYS  44           HE2      LYS  44  89.836  20.238  -1.340
  362    HE3  LYS  44           HE1      LYS  44  88.680  21.259  -2.195
  363    HZ1  LYS  44           HZ1      LYS  44  89.563  21.424   0.495
  364    HZ2  LYS  44           HZ2      LYS  44  87.873  21.258   0.437
  365    HZ3  LYS  44           HZ3      LYS  44  88.634  22.528  -0.397
  366    H    LYS  45           HN       LYS  45  86.568  17.225   1.182
  367    HA   LYS  45           HA       LYS  45  85.183  18.142   3.571
  368    HB2  LYS  45           HB2      LYS  45  83.166  17.274   2.458
  369    HB3  LYS  45           HB1      LYS  45  84.131  18.226   1.329
  370    HG2  LYS  45           HG2      LYS  45  85.231  15.959   0.695
  371    HG3  LYS  45           HG1      LYS  45  83.829  15.231   1.482
  372    HD2  LYS  45           HD2      LYS  45  82.345  16.597   0.009
  373    HD3  LYS  45           HD1      LYS  45  83.778  17.192  -0.830
  374    HE2  LYS  45           HE2      LYS  45  83.145  15.390  -2.179
  375    HE3  LYS  45           HE1      LYS  45  84.340  14.647  -1.115
  376    HZ1  LYS  45           HZ1      LYS  45  82.126  13.460  -1.413
  377    HZ2  LYS  45           HZ2      LYS  45  81.468  14.675  -0.425
  378    HZ3  LYS  45           HZ3      LYS  45  82.693  13.661   0.173
  379    H    GLY  46           HN       GLY  46  83.275  15.821   3.507
  380    HA2  GLY  46           HA2      GLY  46  82.965  13.929   4.872
  381    HA3  GLY  46           HA1      GLY  46  84.430  13.345   4.080
  382    H    VAL  47           HN       VAL  47  83.946  16.062   6.348
  383    HA   VAL  47           HA       VAL  47  86.363  15.560   7.777
  384    HB   VAL  47           HB       VAL  47  85.404  17.067   9.502
  385   HG11  VAL  47          HG11      VAL  47  86.407  18.180   7.645
  386   HG12  VAL  47          HG12      VAL  47  84.853  18.978   7.887
  387   HG13  VAL  47          HG13      VAL  47  85.046  17.799   6.590
  388   HG21  VAL  47          HG21      VAL  47  82.899  16.677   7.841
  389   HG22  VAL  47          HG22      VAL  47  83.096  17.998   8.994
  390   HG23  VAL  47          HG23      VAL  47  83.113  16.326   9.556
  391    H    GLN  48           HN       GLN  48  86.717  14.495   9.781
  392    HA   GLN  48           HA       GLN  48  85.402  12.062  10.236
  393    HB2  GLN  48           HB2      GLN  48  86.431  12.095  12.485
  394    HB3  GLN  48           HB1      GLN  48  87.575  12.618  11.250
  395    HG2  GLN  48           HG2      GLN  48  87.899  14.341  12.739
  396    HG3  GLN  48           HG1      GLN  48  86.514  15.013  11.876
  397   HE21  GLN  48          HE21      GLN  48  85.434  16.074  13.602
  398   HE22  GLN  48          HE22      GLN  48  84.868  15.273  14.987
  399    H    GLY  49           HN       GLY  49  83.368  11.639  10.907
  400    HA2  GLY  49           HA2      GLY  49  81.868  12.109  12.984
  401    HA3  GLY  49           HA1      GLY  49  81.887  13.769  12.385
  402    H1U  RCY  50           H1U      RCY  50  77.365   4.824   5.377
  403    H1S  RCY  50           H1S      RCY  50  79.476   7.546   8.457
  404    HB1  RCY  50           HB1      RCY  50  78.460  10.591   8.828
  405    HB2  RCY  50           HB2      RCY  50  79.664  10.356  10.094
  406    HA   RCY  50           HA       RCY  50  80.401  12.201   7.874
  407    HN1  RCY  50           HN1      RCY  50  81.974  12.602   9.562
  408    H    GLY  51           HN       GLY  51  79.027  13.753   7.201
  409    HA2  GLY  51           HA2      GLY  51  76.820  14.593   9.035
  410    HA3  GLY  51           HA1      GLY  51  77.771  15.797   8.161
  411    H    ASP  52           HN       ASP  52  75.187  15.976   7.599
  412    HA   ASP  52           HA       ASP  52  74.281  14.200   5.496
  413    HB2  ASP  52           HB2      ASP  52  72.590  16.099   5.118
  414    HB3  ASP  52           HB1      ASP  52  72.573  15.332   6.707
  415    H    ASP  53           HN       ASP  53  76.767  14.823   4.672
  416    HA   ASP  53           HA       ASP  53  77.277  17.128   3.190
  417    HB2  ASP  53           HB2      ASP  53  77.971  14.243   2.591
  418    HB3  ASP  53           HB1      ASP  53  78.591  15.590   1.636
  419    H    ILE  54           HN       ILE  54  77.240  17.239   0.680
  420    HA   ILE  54           HA       ILE  54  74.595  17.376  -0.238
  421    HB   ILE  54           HB       ILE  54  75.524  17.578  -2.485
  422   HG12  ILE  54          HG12      ILE  54  77.981  16.346  -1.204
  423   HG13  ILE  54          HG11      ILE  54  77.026  15.690  -2.535
  424   HG21  ILE  54          HG21      ILE  54  75.938  19.365  -0.686
  425   HG22  ILE  54          HG22      ILE  54  76.986  19.417  -2.104
  426   HG23  ILE  54          HG23      ILE  54  77.581  18.729  -0.592
  427   HD11  ILE  54          HD11      ILE  54  78.851  18.095  -2.554
  428   HD12  ILE  54          HD12      ILE  54  77.623  17.857  -3.797
  429   HD13  ILE  54          HD13      ILE  54  78.910  16.669  -3.590
  430    HA   PRO  55           HA       PRO  55  73.613  13.085  -0.923
  431    HB2  PRO  55           HB2      PRO  55  71.444  13.365  -2.549
  432    HB3  PRO  55           HB1      PRO  55  71.398  13.758  -0.820
  433    HG2  PRO  55           HG2      PRO  55  71.677  15.585  -3.156
  434    HG3  PRO  55           HG1      PRO  55  70.720  15.781  -1.677
  435    HD2  PRO  55           HD2      PRO  55  73.153  16.995  -2.058
  436    HD3  PRO  55           HD1      PRO  55  72.524  16.559  -0.453
  437    H    GLY  56           HN       GLY  56  75.781  13.951  -2.531
  438    HA2  GLY  56           HA2      GLY  56  76.915  13.253  -4.468
  439    HA3  GLY  56           HA1      GLY  56  75.587  12.125  -4.750
  440    H    MET  57           HN       MET  57  75.119  15.591  -4.399
  441    HA   MET  57           HA       MET  57  74.187  17.143  -5.887
  442    HB2  MET  57           HB2      MET  57  76.483  16.690  -6.918
  443    HB3  MET  57           HB1      MET  57  75.666  15.590  -8.025
  444    HG2  MET  57           HG2      MET  57  74.361  18.219  -7.795
  445    HG3  MET  57           HG1      MET  57  75.993  18.291  -8.461
  446    HE1  MET  57           HE1      MET  57  74.013  19.350 -10.283
  447    HE2  MET  57           HE2      MET  57  72.675  18.526  -9.485
  448    HE3  MET  57           HE3      MET  57  72.952  18.278 -11.207
  449    H    GLU  58           HN       GLU  58  72.393  15.213  -5.256
  450    HA   GLU  58           HA       GLU  58  70.938  14.846  -7.822
  451    HB2  GLU  58           HB2      GLU  58  72.280  12.729  -6.746
  452    HB3  GLU  58           HB1      GLU  58  70.732  12.571  -5.920
  453    HG2  GLU  58           HG2      GLU  58  70.415  11.335  -7.901
  454    HG3  GLU  58           HG1      GLU  58  69.687  12.896  -8.277
  455    H    GLY  59           HN       GLY  59  70.419  13.790  -4.436
  456    HA2  GLY  59           HA2      GLY  59  68.852  15.579  -3.252
  457    HA3  GLY  59           HA1      GLY  59  67.749  15.087  -4.538
  458    H1U  RCY  60           H1U      RCY  60  73.800   9.531  -3.437
  459    H1S  RCY  60           H1S      RCY  60  71.646  10.537  -5.449
  460    HB1  RCY  60           HB1      RCY  60  68.660   9.101  -2.881
  461    HB2  RCY  60           HB2      RCY  60  70.114   9.989  -2.426
  462    HA   RCY  60           HA       RCY  60  67.305  10.975  -2.742
  463    HN1  RCY  60           HN1      RCY  60  69.413  12.362  -4.033
  464    H    GLY  61           HN       GLY  61  69.371  13.237  -1.413
  465    HA2  GLY  61           HA2      GLY  61  70.158  12.267   1.083
  466    HA3  GLY  61           HA1      GLY  61  69.635  13.931   0.820
  467    H    THR  62           HN       THR  62  66.921  13.230   0.032
  468    HA   THR  62           HA       THR  62  65.667  13.227   2.592
  469    HB   THR  62           HB       THR  62  64.594  14.098   0.526
  470    HG1  THR  62           HG1      THR  62  63.346  12.073   2.034
  471   HG21  THR  62          HG21      THR  62  63.886  12.703  -1.222
  472   HG22  THR  62          HG22      THR  62  63.989  11.249  -0.230
  473   HG23  THR  62          HG23      THR  62  65.462  12.031  -0.804
  474    H    ASP  63           HN       ASP  63  65.959  10.602   0.174
  475    HA   ASP  63           HA       ASP  63  64.704   8.638   1.880
  476    HB2  ASP  63           HB2      ASP  63  64.985   8.531  -0.664
  477    HB3  ASP  63           HB1      ASP  63  66.652   8.046  -0.355
  478    H    ILE  64           HN       ILE  64  67.302  10.262   2.666
  479    HA   ILE  64           HA       ILE  64  68.732   7.877   3.780
  480    HB   ILE  64           HB       ILE  64  69.896  10.497   2.793
  481   HG12  ILE  64          HG12      ILE  64  70.514   7.647   1.969
  482   HG13  ILE  64          HG11      ILE  64  69.338   8.658   1.128
  483   HG21  ILE  64          HG21      ILE  64  72.055   9.035   3.415
  484   HG22  ILE  64          HG22      ILE  64  70.943   8.380   4.617
  485   HG23  ILE  64          HG23      ILE  64  71.291  10.109   4.587
  486   HD11  ILE  64          HD11      ILE  64  70.990  10.210   0.444
  487   HD12  ILE  64          HD12      ILE  64  71.747   8.635   0.202
  488   HD13  ILE  64          HD13      ILE  64  72.162   9.605   1.615
  489    H    THR  65           HN       THR  65  68.000  11.336   4.257
  490    HA   THR  65           HA       THR  65  67.928  12.600   6.251
  491    HB   THR  65           HB       THR  65  66.313  11.805   7.731
  492    HG1  THR  65           HG1      THR  65  66.099   9.548   8.144
  493   HG21  THR  65          HG21      THR  65  65.920   9.928   5.387
  494   HG22  THR  65          HG22      THR  65  65.558  11.653   5.326
  495   HG23  THR  65          HG23      THR  65  64.673  10.605   6.434
  496    H    VAL  66           HN       VAL  66  70.337  10.867   5.771
  497    HA   VAL  66           HA       VAL  66  72.327  10.397   6.914
  498    HB   VAL  66           HB       VAL  66  71.077  11.639   9.370
  499   HG11  VAL  66          HG11      VAL  66  73.918  11.667   8.312
  500   HG12  VAL  66          HG12      VAL  66  73.321  10.500   9.492
  501   HG13  VAL  66          HG13      VAL  66  73.370  12.216   9.896
  502   HG21  VAL  66          HG21      VAL  66  72.166  13.780   8.421
  503   HG22  VAL  66          HG22      VAL  66  70.636  13.273   7.705
  504   HG23  VAL  66          HG23      VAL  66  72.152  12.946   6.867
  505    H    ILE  67           HN       ILE  67  69.271   9.622   8.483
  506    HA   ILE  67           HA       ILE  67  70.539   7.110   9.504
  507    HB   ILE  67           HB       ILE  67  68.313   8.695  10.821
  508   HG12  ILE  67          HG12      ILE  67  71.163   8.214  11.740
  509   HG13  ILE  67          HG11      ILE  67  70.609   9.709  10.985
  510   HG21  ILE  67          HG21      ILE  67  68.684   7.041  12.670
  511   HG22  ILE  67          HG22      ILE  67  69.762   6.147  11.598
  512   HG23  ILE  67          HG23      ILE  67  68.052   6.307  11.197
  513   HD11  ILE  67          HD11      ILE  67  68.831   9.823  12.808
  514   HD12  ILE  67          HD12      ILE  67  70.491  10.078  13.347
  515   HD13  ILE  67          HD13      ILE  67  69.706   8.523  13.618
  516    H1U  RCY  68           H1U      RCY  68  73.859   3.978   1.683
  517    H1S  RCY  68           H1S      RCY  68  70.273   4.641   3.388
  518    HB1  RCY  68           HB1      RCY  68  68.645   6.189   5.296
  519    HB2  RCY  68           HB2      RCY  68  67.425   4.946   5.031
  520    HA   RCY  68           HA       RCY  68  66.913   5.818   7.178
  521    HN1  RCY  68           HN1      RCY  68  69.848   5.944   7.671
  522    HA   PRO  69           HA       PRO  69  66.060   2.009   9.210
  523    HB2  PRO  69           HB2      PRO  69  65.674   0.936   6.427
  524    HB3  PRO  69           HB1      PRO  69  64.668   0.698   7.871
  525    HG2  PRO  69           HG2      PRO  69  64.052   2.486   5.959
  526    HG3  PRO  69           HG1      PRO  69  63.657   2.739   7.666
  527    HD2  PRO  69           HD2      PRO  69  65.602   4.175   6.001
  528    HD3  PRO  69           HD1      PRO  69  64.969   4.605   7.605
  529    H    TRP  70           HN       TRP  70  68.275   1.942   6.439
  530    HA   TRP  70           HA       TRP  70  69.440  -0.618   7.250
  531    HD1  TRP  70           HD1      TRP  70  69.723  -2.388   5.229
  532    HE1  TRP  70           HE1      TRP  70  67.893  -2.984   3.517
  533    HE3  TRP  70           HE3      TRP  70  68.366   2.298   3.722
  534    HZ2  TRP  70           HZ2      TRP  70  66.087  -1.649   1.738
  535    HZ3  TRP  70           HZ3      TRP  70  66.593   2.608   2.022
  536    HH2  TRP  70           HH2      TRP  70  65.452   0.645   1.029
  537    HB2  TRP  70           HB2      TRP  70  70.223   1.440   5.179
  538    HB3  TRP  70           HB1      TRP  70  71.154  -0.025   5.477
  539    H    GLU  71           HN       GLU  71  70.322   2.827   7.517
  540    HA   GLU  71           HA       GLU  71  72.944   2.571   8.489
  541    HB2  GLU  71           HB2      GLU  71  70.742   4.496   9.287
  542    HB3  GLU  71           HB1      GLU  71  72.391   4.640   9.886
  543    HG2  GLU  71           HG2      GLU  71  71.313   5.420   7.299
  544    HG3  GLU  71           HG1      GLU  71  72.880   5.805   8.010
  545    H    ALA  72           HN       ALA  72  69.947   1.680  10.004
  546    HA   ALA  72           HA       ALA  72  71.059   1.498  12.694
  547    HB1  ALA  72           HB1      ALA  72  68.621   1.804  12.274
  548    HB2  ALA  72           HB2      ALA  72  68.954   0.375  13.252
  549    HB3  ALA  72           HB3      ALA  72  68.569   0.201  11.540
  550    H1U  RCY  73           H1U      RCY  73  77.653  -2.547   4.503
  551    H1S  RCY  73           H1S      RCY  73  73.110  -1.522   5.827
  552    HB1  RCY  73           HB1      RCY  73  74.172  -2.878   9.525
  553    HB2  RCY  73           HB2      RCY  73  74.013  -1.124   9.433
  554    HA   RCY  73           HA       RCY  73  71.735  -2.823  10.442
  555    HN1  RCY  73           HN1      RCY  73  71.997  -0.061  10.084
  556    H    ASN  74           HN       ASN  74  74.046  -0.622  12.026
  557    HA   ASN  74           HA       ASN  74  74.102  -2.214  14.427
  558    HB2  ASN  74           HB2      ASN  74  75.525  -3.568  12.759
  559    HB3  ASN  74           HB1      ASN  74  76.696  -2.255  12.877
  560   HD21  ASN  74          HD21      ASN  74  76.376  -1.621  15.659
  561   HD22  ASN  74          HD22      ASN  74  76.930  -2.940  16.572
  562    H    HIS  75           HN       HIS  75  73.606   0.456  14.055
  563    HA   HIS  75           HA       HIS  75  74.286   2.598  14.722
  564    HD1  HIS  75           HD1      HIS  75  73.197   1.630  18.021
  565    HD2  HIS  75           HD2      HIS  75  75.787   4.653  16.776
  566    HE1  HIS  75           HE1      HIS  75  72.413   3.755  19.155
  567    HE2  HIS  75           HE2      HIS  75  73.982   5.603  18.406
  568    HB2  HIS  75           HB2      HIS  75  75.113   0.726  16.667
  569    HB3  HIS  75           HB1      HIS  75  76.497   1.792  16.436
  570    H1U  RCY  76           H1U      RCY  76  75.567   0.194   8.615
  571    H1S  RCY  76           H1S      RCY  76  77.293   4.015   8.981
  572    HB1  RCY  76           HB1      RCY  76  77.676   4.264  12.669
  573    HB2  RCY  76           HB2      RCY  76  76.584   4.099  11.296
  574    HA   RCY  76           HA       RCY  76  77.417   1.768  10.962
  575    HN1  RCY  76           HN1      RCY  76  75.591   1.373  12.383
  576    H    GLU  77           HN       GLU  77  78.189  -0.076  12.679
  577    HA   GLU  77           HA       GLU  77  80.359   0.690  14.430
  578    HB2  GLU  77           HB2      GLU  77  78.880  -1.503  14.354
  579    HB3  GLU  77           HB1      GLU  77  80.142  -2.071  13.265
  580    HG2  GLU  77           HG2      GLU  77  81.852  -1.538  14.969
  581    HG3  GLU  77           HG1      GLU  77  80.582  -0.991  16.064
  582    H    LEU  78           HN       LEU  78  81.928  -1.719  13.075
  583    HA   LEU  78           HA       LEU  78  82.970  -0.376  10.675
  584    HG   LEU  78           HG       LEU  78  83.546  -0.193  14.170
  585    HB2  LEU  78           HB2      LEU  78  85.365  -0.602  11.774
  586    HB3  LEU  78           HB1      LEU  78  84.383   0.829  12.080
  587   HD11  LEU  78          HD11      LEU  78  83.602  -2.514  13.821
  588   HD12  LEU  78          HD12      LEU  78  84.956  -2.260  14.922
  589   HD13  LEU  78          HD13      LEU  78  85.251  -2.475  13.197
  590   HD21  LEU  78          HD21      LEU  78  85.542   1.216  14.294
  591   HD22  LEU  78          HD22      LEU  78  86.567  -0.159  13.883
  592   HD23  LEU  78          HD23      LEU  78  85.706  -0.130  15.422
  593    H    HIS  79           HN       HIS  79  84.821  -1.708   9.744
  594    HA   HIS  79           HA       HIS  79  84.693  -3.959   8.662
  595    HD1  HIS  79           HD1      HIS  79  88.156  -6.038  10.725
  596    HD2  HIS  79           HD2      HIS  79  86.080  -5.228   7.199
  597    HE1  HIS  79           HE1      HIS  79  88.715  -7.915   9.119
  598    HE2  HIS  79           HE2      HIS  79  87.457  -7.434   6.968
  599    HB2  HIS  79           HB2      HIS  79  86.909  -3.099   9.518
  600    HB3  HIS  79           HB1      HIS  79  86.640  -4.057  10.973
  601    H    GLU  80           HN       GLU  80  84.897  -4.330  12.217
  602    HA   GLU  80           HA       GLU  80  84.399  -6.926  12.687
  603    HB2  GLU  80           HB2      GLU  80  84.234  -4.881  14.303
  604    HB3  GLU  80           HB1      GLU  80  82.503  -4.986  13.989
  605    HG2  GLU  80           HG2      GLU  80  82.758  -6.371  15.866
  606    HG3  GLU  80           HG1      GLU  80  82.808  -7.525  14.533
  607    H    LEU  81           HN       LEU  81  81.747  -4.722  11.662
  608    HA   LEU  81           HA       LEU  81  79.839  -6.909  11.564
  609    HG   LEU  81           HG       LEU  81  80.365  -4.357   9.182
  610    HB2  LEU  81           HB2      LEU  81  78.284  -5.321  10.644
  611    HB3  LEU  81           HB1      LEU  81  79.194  -4.503  11.909
  612   HD11  LEU  81          HD11      LEU  81  77.738  -3.071   9.942
  613   HD12  LEU  81          HD12      LEU  81  78.124  -3.986   8.484
  614   HD13  LEU  81          HD13      LEU  81  78.795  -2.372   8.716
  615   HD21  LEU  81          HD21      LEU  81  81.210  -2.347   9.974
  616   HD22  LEU  81          HD22      LEU  81  81.002  -3.211  11.498
  617   HD23  LEU  81          HD23      LEU  81  79.798  -2.030  10.981
  618    H    ALA  82           HN       ALA  82  82.387  -7.070   9.922
  619    HA   ALA  82           HA       ALA  82  81.633  -6.900   7.142
  620    HB1  ALA  82           HB1      ALA  82  83.971  -6.918   7.614
  621    HB2  ALA  82           HB2      ALA  82  83.637  -8.475   6.856
  622    HB3  ALA  82           HB3      ALA  82  83.835  -8.370   8.605
  623    H    GLN  83           HN       GLN  83  79.441  -8.066   7.977
  624    HA   GLN  83           HA       GLN  83  79.655 -10.988   8.042
  625    HB2  GLN  83           HB2      GLN  83  77.185 -10.930   8.149
  626    HB3  GLN  83           HB1      GLN  83  77.900  -9.846   9.342
  627    HG2  GLN  83           HG2      GLN  83  77.685  -8.047   7.444
  628    HG3  GLN  83           HG1      GLN  83  76.495  -9.162   6.772
  629   HE21  GLN  83          HE21      GLN  83  75.493  -6.729   7.600
  630   HE22  GLN  83          HE22      GLN  83  74.637  -6.895   9.056
  631    H    TYR  84           HN       TYR  84  78.069  -8.655   5.819
  632    HA   TYR  84           HA       TYR  84  77.822 -10.710   3.756
  633    HD1  TYR  84           HD2      TYR  84  75.640 -11.017   3.335
  634    HD2  TYR  84           HD1      TYR  84  75.610  -7.050   4.983
  635    HE1  TYR  84           HE2      TYR  84  73.466 -11.489   4.432
  636    HE2  TYR  84           HE1      TYR  84  73.436  -7.522   6.079
  637    HH   TYR  84           HH       TYR  84  71.597  -8.981   5.959
  638    HB2  TYR  84           HB2      TYR  84  77.398  -7.707   3.648
  639    HB3  TYR  84           HB1      TYR  84  76.986  -8.826   2.353
  640    H    GLY  85           HN       GLY  85  79.360  -7.494   3.495
  641    HA2  GLY  85           HA2      GLY  85  81.984  -7.943   3.132
  642    HA3  GLY  85           HA1      GLY  85  81.356  -8.670   1.653
  643    H    ILE  86           HN       ILE  86  81.140  -5.622   3.520
  644    HA   ILE  86           HA       ILE  86  81.567  -4.127   1.028
  645    HB   ILE  86           HB       ILE  86  79.552  -2.723   1.287
  646   HG12  ILE  86          HG12      ILE  86  79.255  -2.980   3.715
  647   HG13  ILE  86          HG11      ILE  86  77.779  -3.452   2.872
  648   HG21  ILE  86          HG21      ILE  86  78.821  -5.665   1.247
  649   HG22  ILE  86          HG22      ILE  86  79.524  -4.807  -0.124
  650   HG23  ILE  86          HG23      ILE  86  77.936  -4.343   0.487
  651   HD11  ILE  86          HD11      ILE  86  78.017  -5.258   4.304
  652   HD12  ILE  86          HD12      ILE  86  79.778  -5.164   4.296
  653   HD13  ILE  86          HD13      ILE  86  78.926  -5.847   2.912
  654    H1U  RCY  87           H1U      RCY  87  80.249   1.380   0.279
  655    H1S  RCY  87           H1S      RCY  87  79.214   1.004   4.969
  656    HB1  RCY  87           HB1      RCY  87  81.418  -1.014   6.876
  657    HB2  RCY  87           HB2      RCY  87  80.795  -2.660   6.831
  658    HA   RCY  87           HA       RCY  87  82.222  -1.207   4.587
  659    HN1  RCY  87           HN1      RCY  87  80.538  -3.605   4.445
  Start of MODEL   75
    1    HA   MET   1           HA       MET   1  60.842 -25.218  -2.861
    2    HB2  MET   1           HB2      MET   1  58.014 -24.199  -3.250
    3    HB3  MET   1           HB1      MET   1  59.079 -24.889  -4.476
    4    HG2  MET   1           HG2      MET   1  57.994 -26.362  -2.056
    5    HG3  MET   1           HG1      MET   1  57.425 -26.553  -3.714
    6    HE1  MET   1           HE1      MET   1  57.861 -28.833  -2.366
    7    HE2  MET   1           HE2      MET   1  59.225 -29.840  -2.845
    8    HE3  MET   1           HE3      MET   1  58.080 -29.280  -4.062
    9    H    ASN   2           HN       ASN   2  59.071 -22.882  -4.203
   10    HA   ASN   2           HA       ASN   2  61.143 -20.866  -3.831
   11    HB2  ASN   2           HB2      ASN   2  59.546 -19.480  -5.278
   12    HB3  ASN   2           HB1      ASN   2  60.169 -20.961  -6.007
   13   HD21  ASN   2          HD21      ASN   2  57.979 -21.784  -3.561
   14   HD22  ASN   2          HD22      ASN   2  56.597 -22.002  -4.523
   15    H    LEU   3           HN       LEU   3  59.343 -21.720  -1.523
   16    HA   LEU   3           HA       LEU   3  57.674 -19.427  -0.914
   17    HG   LEU   3           HG       LEU   3  57.336 -19.233   1.588
   18    HB2  LEU   3           HB2      LEU   3  57.460 -21.800   0.044
   19    HB3  LEU   3           HB1      LEU   3  58.815 -21.381   1.092
   20   HD11  LEU   3          HD11      LEU   3  55.195 -21.298   1.046
   21   HD12  LEU   3          HD12      LEU   3  55.631 -20.067  -0.140
   22   HD13  LEU   3          HD13      LEU   3  54.986 -19.590   1.431
   23   HD21  LEU   3          HD21      LEU   3  56.252 -20.554   3.463
   24   HD22  LEU   3          HD22      LEU   3  57.997 -20.766   3.328
   25   HD23  LEU   3          HD23      LEU   3  56.907 -22.012   2.719
   26    H    GLU   4           HN       GLU   4  58.293 -17.519   0.015
   27    HA   GLU   4           HA       GLU   4  61.108 -16.981   0.423
   28    HB2  GLU   4           HB2      GLU   4  58.810 -15.248   1.346
   29    HB3  GLU   4           HB1      GLU   4  60.439 -14.739   0.899
   30    HG2  GLU   4           HG2      GLU   4  58.357 -15.917  -0.965
   31    HG3  GLU   4           HG1      GLU   4  58.896 -14.238  -0.932
   32    HA   PRO   5           HA       PRO   5  61.593 -18.622   4.562
   33    HB2  PRO   5           HB2      PRO   5  63.166 -16.081   4.850
   34    HB3  PRO   5           HB1      PRO   5  63.591 -17.730   5.353
   35    HG2  PRO   5           HG2      PRO   5  64.589 -16.633   3.130
   36    HG3  PRO   5           HG1      PRO   5  64.209 -18.359   3.234
   37    HD2  PRO   5           HD2      PRO   5  62.827 -16.238   1.701
   38    HD3  PRO   5           HD1      PRO   5  62.804 -17.998   1.461
   39    HA   PRO   6           HA       PRO   6  58.519 -15.713   6.323
   40    HB2  PRO   6           HB2      PRO   6  56.880 -17.556   7.420
   41    HB3  PRO   6           HB1      PRO   6  56.878 -17.227   5.676
   42    HG2  PRO   6           HG2      PRO   6  58.067 -19.501   7.163
   43    HG3  PRO   6           HG1      PRO   6  57.311 -19.467   5.563
   44    HD2  PRO   6           HD2      PRO   6  60.078 -19.447   6.065
   45    HD3  PRO   6           HD1      PRO   6  59.300 -19.024   4.524
   46    H    LYS   7           HN       LYS   7  58.817 -14.746   8.303
   47    HA   LYS   7           HA       LYS   7  59.472 -16.439  10.652
   48    HB2  LYS   7           HB2      LYS   7  61.114 -14.156  10.941
   49    HB3  LYS   7           HB1      LYS   7  61.645 -15.811  10.660
   50    HG2  LYS   7           HG2      LYS   7  62.596 -14.417   8.921
   51    HG3  LYS   7           HG1      LYS   7  61.340 -15.417   8.191
   52    HD2  LYS   7           HD2      LYS   7  60.633 -13.410   7.349
   53    HD3  LYS   7           HD1      LYS   7  59.851 -13.279   8.925
   54    HE2  LYS   7           HE2      LYS   7  62.605 -12.204   8.247
   55    HE3  LYS   7           HE1      LYS   7  61.138 -11.234   8.382
   56    HZ1  LYS   7           HZ1      LYS   7  60.962 -12.274  10.696
   57    HZ2  LYS   7           HZ2      LYS   7  62.115 -11.050  10.458
   58    HZ3  LYS   7           HZ3      LYS   7  62.598 -12.678  10.501
   59    H    ALA   8           HN       ALA   8  57.996 -13.694   9.241
   60    HA   ALA   8           HA       ALA   8  56.206 -13.174  11.310
   61    HB1  ALA   8           HB1      ALA   8  57.714 -12.475  12.922
   62    HB2  ALA   8           HB2      ALA   8  57.446 -10.935  12.108
   63    HB3  ALA   8           HB3      ALA   8  58.876 -11.894  11.730
   64    H    GLU   9           HN       GLU   9  56.783 -12.947   8.360
   65    HA   GLU   9           HA       GLU   9  56.092 -11.586   6.581
   66    HB2  GLU   9           HB2      GLU   9  54.032 -11.533   8.126
   67    HB3  GLU   9           HB1      GLU   9  54.602  -9.945   8.637
   68    HG2  GLU   9           HG2      GLU   9  53.085  -9.525   6.847
   69    HG3  GLU   9           HG1      GLU   9  54.696  -9.339   6.151
   70    H1U  RCY  10           H1U      RCY  10  61.098  -3.031   7.423
   71    H1S  RCY  10           H1S      RCY  10  59.557  -6.992   7.387
   72    HB1  RCY  10           HB1      RCY  10  57.432  -5.837   6.275
   73    HB2  RCY  10           HB2      RCY  10  56.404  -7.159   5.721
   74    HA   RCY  10           HA       RCY  10  58.237  -7.694   8.021
   75    HN1  RCY  10           HN1      RCY  10  55.437  -8.626   7.823
   76    H    ARG  11           HN       ARG  11  55.944  -7.809   9.838
   77    HA   ARG  11           HA       ARG  11  54.889  -6.434  11.413
   78    HE   ARG  11           HE       ARG  11  56.910  -3.309  15.255
   79    HB2  ARG  11           HB2      ARG  11  57.311  -5.570  11.476
   80    HB3  ARG  11           HB1      ARG  11  56.738  -4.234  10.478
   81    HG2  ARG  11           HG2      ARG  11  55.092  -3.621  12.172
   82    HG3  ARG  11           HG1      ARG  11  55.545  -5.014  13.155
   83    HD2  ARG  11           HD2      ARG  11  57.885  -4.080  13.258
   84    HD3  ARG  11           HD1      ARG  11  57.278  -2.625  12.468
   85   HH11  ARG  11          HH21      ARG  11  55.483  -1.844  12.480
   86   HH12  ARG  11          HH22      ARG  11  54.479  -0.771  13.397
   87   HH21  ARG  11          HH11      ARG  11  55.608  -1.916  16.469
   88   HH22  ARG  11          HH12      ARG  11  54.550  -0.812  15.656
   89    H    SER  12           HN       SER  12  55.713  -3.876   9.070
   90    HA   SER  12           HA       SER  12  52.859  -3.120   8.987
   91    HG   SER  12           HG       SER  12  52.775  -0.725   7.904
   92    HB2  SER  12           HB2      SER  12  54.417  -1.296   9.229
   93    HB3  SER  12           HB1      SER  12  55.367  -1.853   7.854
   94    H    ALA  13           HN       ALA  13  55.364  -4.381   6.820
   95    HA   ALA  13           HA       ALA  13  55.114  -5.522   4.778
   96    HB1  ALA  13           HB1      ALA  13  53.113  -6.599   4.342
   97    HB2  ALA  13           HB2      ALA  13  52.137  -5.211   4.819
   98    HB3  ALA  13           HB3      ALA  13  52.876  -6.234   6.051
   99    H    THR  14           HN       THR  14  55.289  -2.588   5.047
  100    HA   THR  14           HA       THR  14  53.551  -1.338   3.120
  101    HB   THR  14           HB       THR  14  56.342  -0.472   3.933
  102    HG1  THR  14           HG1      THR  14  55.486  -0.170   5.807
  103   HG21  THR  14          HG21      THR  14  55.289   0.669   1.966
  104   HG22  THR  14          HG22      THR  14  55.569   1.748   3.332
  105   HG23  THR  14          HG23      THR  14  53.947   1.137   3.010
  106    H    ARG  15           HN       ARG  15  53.818  -3.205   1.513
  107    HA   ARG  15           HA       ARG  15  56.343  -3.314   0.040
  108    HE   ARG  15           HE       ARG  15  55.391  -8.188  -1.114
  109    HB2  ARG  15           HB2      ARG  15  54.594  -5.214   0.355
  110    HB3  ARG  15           HB1      ARG  15  53.717  -4.417  -0.951
  111    HG2  ARG  15           HG2      ARG  15  55.895  -4.497  -2.283
  112    HG3  ARG  15           HG1      ARG  15  56.505  -5.587  -1.037
  113    HD2  ARG  15           HD2      ARG  15  53.932  -6.067  -2.563
  114    HD3  ARG  15           HD1      ARG  15  55.486  -6.757  -3.031
  115   HH11  ARG  15          HH21      ARG  15  52.846  -5.868  -1.269
  116   HH12  ARG  15          HH22      ARG  15  51.895  -6.631  -0.040
  117   HH21  ARG  15          HH11      ARG  15  54.164  -9.199   0.492
  118   HH22  ARG  15          HH12      ARG  15  52.641  -8.518   0.958
  119    H    VAL  16           HN       VAL  16  56.889  -1.904  -1.539
  120    HA   VAL  16           HA       VAL  16  54.833  -0.810  -3.340
  121    HB   VAL  16           HB       VAL  16  55.599   1.547  -2.914
  122   HG11  VAL  16          HG11      VAL  16  53.546   0.439  -1.851
  123   HG12  VAL  16          HG12      VAL  16  54.166   1.875  -1.037
  124   HG13  VAL  16          HG13      VAL  16  54.522   0.272  -0.393
  125   HG21  VAL  16          HG21      VAL  16  56.779   1.977  -0.772
  126   HG22  VAL  16          HG22      VAL  16  57.760   1.008  -1.871
  127   HG23  VAL  16          HG23      VAL  16  56.928   0.237  -0.520
  128    H    MET  17           HN       MET  17  57.782  -2.130  -2.866
  129    HA   MET  17           HA       MET  17  59.530  -0.595  -4.522
  130    HB2  MET  17           HB2      MET  17  59.463  -3.578  -3.973
  131    HB3  MET  17           HB1      MET  17  60.798  -2.738  -4.762
  132    HG2  MET  17           HG2      MET  17  59.763  -1.913  -2.044
  133    HG3  MET  17           HG1      MET  17  61.037  -3.116  -2.240
  134    HE1  MET  17           HE1      MET  17  63.134  -0.210  -1.049
  135    HE2  MET  17           HE2      MET  17  63.257  -1.950  -1.299
  136    HE3  MET  17           HE3      MET  17  61.828  -1.277  -0.518
  137    H    GLY  18           HN       GLY  18  58.561  -3.824  -5.587
  138    HA2  GLY  18           HA2      GLY  18  57.421  -4.460  -7.582
  139    HA3  GLY  18           HA1      GLY  18  57.257  -2.754  -8.002
  140    H    GLY  19           HN       GLY  19  58.009  -4.058 -10.118
  141    HA2  GLY  19           HA2      GLY  19  59.708  -3.960 -11.761
  142    HA3  GLY  19           HA1      GLY  19  60.774  -3.231 -10.558
  143    HA   PRO  20           HA       PRO  20  60.585  -8.212 -10.060
  144    HB2  PRO  20           HB2      PRO  20  60.722  -8.543 -13.037
  145    HB3  PRO  20           HB1      PRO  20  59.975  -9.597 -11.819
  146    HG2  PRO  20           HG2      PRO  20  58.505  -7.997 -13.353
  147    HG3  PRO  20           HG1      PRO  20  58.087  -8.289 -11.656
  148    HD2  PRO  20           HD2      PRO  20  59.252  -5.847 -12.911
  149    HD3  PRO  20           HD1      PRO  20  58.220  -5.994 -11.472
  150    H1U  RCY  21           H1U      RCY  21  66.813  -5.597  -2.316
  151    H1S  RCY  21           H1S      RCY  21  64.875  -7.072  -6.059
  152    HB1  RCY  21           HB1      RCY  21  66.246  -8.313  -8.968
  153    HB2  RCY  21           HB2      RCY  21  64.672  -8.678  -8.262
  154    HA   RCY  21           HA       RCY  21  64.915  -7.095 -10.821
  155    HN1  RCY  21           HN1      RCY  21  62.685  -8.061  -9.280
  156    H    THR  22           HN       THR  22  65.226  -8.214 -12.750
  157    HA   THR  22           HA       THR  22  64.879 -10.949 -13.250
  158    HB   THR  22           HB       THR  22  66.941  -9.047 -14.390
  159    HG1  THR  22           HG1      THR  22  65.349  -8.426 -15.595
  160   HG21  THR  22          HG21      THR  22  66.871 -10.720 -16.324
  161   HG22  THR  22          HG22      THR  22  66.110 -11.839 -15.193
  162   HG23  THR  22          HG23      THR  22  67.738 -11.238 -14.879
  163    HA   PRO  23           HA       PRO  23  67.999 -12.420 -10.259
  164    HB2  PRO  23           HB2      PRO  23  67.238 -15.031 -11.485
  165    HB3  PRO  23           HB1      PRO  23  67.297 -14.562  -9.776
  166    HG2  PRO  23           HG2      PRO  23  64.985 -14.844 -11.078
  167    HG3  PRO  23           HG1      PRO  23  65.210 -13.606  -9.831
  168    HD2  PRO  23           HD2      PRO  23  65.115 -13.286 -12.807
  169    HD3  PRO  23           HD1      PRO  23  64.554 -12.179 -11.534
  170    H    ARG  24           HN       ARG  24  69.451 -11.302 -12.041
  171    HA   ARG  24           HA       ARG  24  71.453 -13.221 -12.836
  172    HE   ARG  24           HE       ARG  24  72.745 -15.199 -16.820
  173    HB2  ARG  24           HB2      ARG  24  69.603 -13.500 -14.600
  174    HB3  ARG  24           HB1      ARG  24  70.041 -11.884 -15.150
  175    HG2  ARG  24           HG2      ARG  24  71.301 -13.449 -16.481
  176    HG3  ARG  24           HG1      ARG  24  72.429 -12.702 -15.350
  177    HD2  ARG  24           HD2      ARG  24  72.694 -14.630 -14.123
  178    HD3  ARG  24           HD1      ARG  24  71.051 -15.185 -14.445
  179   HH11  ARG  24          HH21      ARG  24  71.732 -16.851 -13.969
  180   HH12  ARG  24          HH22      ARG  24  72.104 -18.425 -14.589
  181   HH21  ARG  24          HH11      ARG  24  73.236 -17.244 -17.646
  182   HH22  ARG  24          HH12      ARG  24  72.956 -18.648 -16.671
  183    H    LYS  25           HN       LYS  25  73.396 -12.163 -13.189
  184    HA   LYS  25           HA       LYS  25  73.431  -9.276 -12.700
  185    HB2  LYS  25           HB2      LYS  25  75.440 -11.476 -12.868
  186    HB3  LYS  25           HB1      LYS  25  76.017  -9.858 -13.258
  187    HG2  LYS  25           HG2      LYS  25  76.345 -10.111 -10.903
  188    HG3  LYS  25           HG1      LYS  25  74.917  -9.091 -11.079
  189    HD2  LYS  25           HD2      LYS  25  74.043 -10.610  -9.596
  190    HD3  LYS  25           HD1      LYS  25  73.716 -11.500 -11.083
  191    HE2  LYS  25           HE2      LYS  25  76.240 -11.821  -9.436
  192    HE3  LYS  25           HE1      LYS  25  74.841 -12.888  -9.319
  193    HZ1  LYS  25           HZ1      LYS  25  76.757 -12.566 -11.514
  194    HZ2  LYS  25           HZ2      LYS  25  75.160 -13.004 -11.891
  195    HZ3  LYS  25           HZ3      LYS  25  76.092 -13.983 -10.862
  196    H    GLY  26           HN       GLY  26  74.020  -7.686 -14.216
  197    HA2  GLY  26           HA2      GLY  26  74.929  -8.400 -16.889
  198    HA3  GLY  26           HA1      GLY  26  73.240  -7.893 -16.862
  199    HA   PRO  27           HA       PRO  27  73.900  -3.558 -16.635
  200    HB2  PRO  27           HB2      PRO  27  73.598  -3.570 -13.651
  201    HB3  PRO  27           HB1      PRO  27  72.821  -2.524 -14.857
  202    HG2  PRO  27           HG2      PRO  27  71.519  -4.554 -13.725
  203    HG3  PRO  27           HG1      PRO  27  71.257  -4.109 -15.419
  204    HD2  PRO  27           HD2      PRO  27  72.674  -6.471 -14.300
  205    HD3  PRO  27           HD1      PRO  27  71.871  -6.277 -15.874
  206    HA   PRO  28           HA       PRO  28  78.294  -3.032 -16.064
  207    HB2  PRO  28           HB2      PRO  28  77.460  -0.279 -15.209
  208    HB3  PRO  28           HB1      PRO  28  78.730  -0.766 -16.349
  209    HG2  PRO  28           HG2      PRO  28  76.344   0.143 -17.169
  210    HG3  PRO  28           HG1      PRO  28  77.254  -1.080 -18.068
  211    HD2  PRO  28           HD2      PRO  28  74.754  -1.388 -16.526
  212    HD3  PRO  28           HD1      PRO  28  75.438  -2.441 -17.783
  213    H    LYS  29           HN       LYS  29  79.834  -2.769 -14.321
  214    HA   LYS  29           HA       LYS  29  78.685  -3.290 -11.670
  215    HB2  LYS  29           HB2      LYS  29  80.785  -4.405 -12.670
  216    HB3  LYS  29           HB1      LYS  29  81.615  -2.893 -12.301
  217    HG2  LYS  29           HG2      LYS  29  81.085  -3.102  -9.947
  218    HG3  LYS  29           HG1      LYS  29  80.059  -4.503 -10.258
  219    HD2  LYS  29           HD2      LYS  29  81.974  -5.813 -10.980
  220    HD3  LYS  29           HD1      LYS  29  83.030  -4.405 -10.855
  221    HE2  LYS  29           HE2      LYS  29  81.496  -5.572  -8.516
  222    HE3  LYS  29           HE1      LYS  29  83.177  -5.963  -8.882
  223    HZ1  LYS  29           HZ1      LYS  29  83.267  -4.223  -7.344
  224    HZ2  LYS  29           HZ2      LYS  29  82.029  -3.348  -8.111
  225    HZ3  LYS  29           HZ3      LYS  29  83.559  -3.477  -8.839
  226    H1U  RCY  30           H1U      RCY  30  78.683   5.644  -9.942
  227    H1S  RCY  30           H1S      RCY  30  80.169   1.224  -9.076
  228    HB1  RCY  30           HB1      RCY  30  81.403   2.472 -12.032
  229    HB2  RCY  30           HB2      RCY  30  81.820   0.921 -12.761
  230    HA   RCY  30           HA       RCY  30  79.370   1.129 -11.032
  231    HN1  RCY  30           HN1      RCY  30  79.603  -0.561 -13.448
  232    H    LYS  31           HN       LYS  31  80.760   2.265 -14.025
  233    HA   LYS  31           HA       LYS  31  79.943   3.804 -15.593
  234    HB2  LYS  31           HB2      LYS  31  78.530   1.646 -15.989
  235    HB3  LYS  31           HB1      LYS  31  77.228   2.546 -15.214
  236    HG2  LYS  31           HG2      LYS  31  76.880   3.159 -17.423
  237    HG3  LYS  31           HG1      LYS  31  77.980   4.443 -16.918
  238    HD2  LYS  31           HD2      LYS  31  79.889   2.985 -17.728
  239    HD3  LYS  31           HD1      LYS  31  78.677   1.919 -18.438
  240    HE2  LYS  31           HE2      LYS  31  79.318   3.404 -20.191
  241    HE3  LYS  31           HE1      LYS  31  77.756   3.994 -19.621
  242    HZ1  LYS  31           HZ1      LYS  31  78.688   5.917 -19.105
  243    HZ2  LYS  31           HZ2      LYS  31  80.177   5.369 -19.713
  244    HZ3  LYS  31           HZ3      LYS  31  79.794   5.149 -18.072
  245    H    GLN  32           HN       GLN  32  76.809   4.310 -15.229
  246    HA   GLN  32           HA       GLN  32  76.922   6.066 -12.851
  247    HB2  GLN  32           HB2      GLN  32  77.772   7.311 -14.955
  248    HB3  GLN  32           HB1      GLN  32  76.099   7.239 -15.510
  249    HG2  GLN  32           HG2      GLN  32  76.146   9.287 -14.377
  250    HG3  GLN  32           HG1      GLN  32  75.546   8.192 -13.131
  251   HE21  GLN  32          HE21      GLN  32  77.326  10.746 -13.035
  252   HE22  GLN  32          HE22      GLN  32  78.643  10.270 -12.075
  253    H    ARG  33           HN       ARG  33  75.262   4.598 -12.095
  254    HA   ARG  33           HA       ARG  33  72.775   4.355 -13.633
  255    HE   ARG  33           HE       ARG  33  74.922  -0.669 -12.250
  256    HB2  ARG  33           HB2      ARG  33  73.163   3.607 -10.729
  257    HB3  ARG  33           HB1      ARG  33  72.030   2.916 -11.892
  258    HG2  ARG  33           HG2      ARG  33  74.054   2.146 -13.228
  259    HG3  ARG  33           HG1      ARG  33  75.040   2.601 -11.838
  260    HD2  ARG  33           HD2      ARG  33  73.481   1.122 -10.441
  261    HD3  ARG  33           HD1      ARG  33  72.877   0.494 -11.974
  262   HH11  ARG  33          HH21      ARG  33  75.071   1.713  -9.762
  263   HH12  ARG  33          HH22      ARG  33  76.621   1.202  -9.182
  264   HH21  ARG  33          HH11      ARG  33  76.945  -1.350 -11.507
  265   HH22  ARG  33          HH12      ARG  33  77.682  -0.532 -10.170
  266    H    GLN  34           HN       GLN  34  74.107   6.799 -11.859
  267    HA   GLN  34           HA       GLN  34  71.513   8.128 -11.559
  268    HB2  GLN  34           HB2      GLN  34  72.408   8.671  -9.048
  269    HB3  GLN  34           HB1      GLN  34  71.285   7.362  -9.408
  270    HG2  GLN  34           HG2      GLN  34  73.253   6.648  -8.013
  271    HG3  GLN  34           HG1      GLN  34  73.096   5.756  -9.527
  272   HE21  GLN  34          HE21      GLN  34  74.863   5.827 -10.960
  273   HE22  GLN  34          HE22      GLN  34  76.211   6.839 -10.762
  274    H    THR  35           HN       THR  35  74.118   9.125  -9.492
  275    HA   THR  35           HA       THR  35  75.045  11.088 -11.548
  276    HB   THR  35           HB       THR  35  74.617  11.868  -8.662
  277    HG1  THR  35           HG1      THR  35  72.785  11.592 -10.730
  278   HG21  THR  35          HG21      THR  35  74.462  13.642 -11.081
  279   HG22  THR  35          HG22      THR  35  76.037  13.148 -10.461
  280   HG23  THR  35          HG23      THR  35  74.928  14.050  -9.429
  281    H    ARG  36           HN       ARG  36  76.404  12.116  -8.814
  282    HA   ARG  36           HA       ARG  36  78.380  10.021  -8.347
  283    HE   ARG  36           HE       ARG  36  83.035   9.875  -9.432
  284    HB2  ARG  36           HB2      ARG  36  78.994  11.169 -10.589
  285    HB3  ARG  36           HB1      ARG  36  79.439  12.557  -9.596
  286    HG2  ARG  36           HG2      ARG  36  80.854  10.915  -8.218
  287    HG3  ARG  36           HG1      ARG  36  80.619   9.776  -9.544
  288    HD2  ARG  36           HD2      ARG  36  81.471  11.622 -11.095
  289    HD3  ARG  36           HD1      ARG  36  81.979  12.475  -9.637
  290   HH11  ARG  36          HH21      ARG  36  83.190  12.612 -11.523
  291   HH12  ARG  36          HH22      ARG  36  84.817  12.300 -12.030
  292   HH21  ARG  36          HH11      ARG  36  85.159   9.452 -10.081
  293   HH22  ARG  36          HH12      ARG  36  85.932  10.511 -11.213
  294    H    GLN  37           HN       GLN  37  76.897  13.023  -7.661
  295    HA   GLN  37           HA       GLN  37  78.831  13.733  -5.540
  296    HB2  GLN  37           HB2      GLN  37  76.189  15.037  -6.258
  297    HB3  GLN  37           HB1      GLN  37  77.446  15.712  -5.222
  298    HG2  GLN  37           HG2      GLN  37  79.019  15.707  -7.128
  299    HG3  GLN  37           HG1      GLN  37  77.753  15.049  -8.166
  300   HE21  GLN  37          HE21      GLN  37  75.575  16.653  -7.002
  301   HE22  GLN  37          HE22      GLN  37  75.828  18.255  -7.502
  302    H1U  RCY  38           H1U      RCY  38  79.947   5.229   0.968
  303    H1S  RCY  38           H1S      RCY  38  79.713   9.449  -0.138
  304    HB1  RCY  38           HB1      RCY  38  77.422  11.252  -0.519
  305    HB2  RCY  38           HB2      RCY  38  78.521  12.530  -1.037
  306    HA   RCY  38           HA       RCY  38  76.372  11.258  -2.763
  307    HN1  RCY  38           HN1      RCY  38  78.621  12.885  -3.525
  308    H    LYS  39           HN       LYS  39  76.621  14.560  -3.065
  309    HA   LYS  39           HA       LYS  39  75.459  16.378  -2.124
  310    HB2  LYS  39           HB2      LYS  39  73.730  14.603  -3.238
  311    HB3  LYS  39           HB1      LYS  39  73.108  14.635  -1.590
  312    HG2  LYS  39           HG2      LYS  39  71.963  16.367  -2.817
  313    HG3  LYS  39           HG1      LYS  39  73.108  17.162  -1.737
  314    HD2  LYS  39           HD2      LYS  39  74.432  17.888  -3.456
  315    HD3  LYS  39           HD1      LYS  39  74.146  16.441  -4.423
  316    HE2  LYS  39           HE2      LYS  39  73.123  18.630  -5.299
  317    HE3  LYS  39           HE1      LYS  39  72.044  17.239  -5.192
  318    HZ1  LYS  39           HZ1      LYS  39  72.267  18.979  -2.853
  319    HZ2  LYS  39           HZ2      LYS  39  70.927  18.116  -3.441
  320    HZ3  LYS  39           HZ3      LYS  39  71.400  19.567  -4.187
  321    H    SER  40           HN       SER  40  76.811  14.361  -0.214
  322    HA   SER  40           HA       SER  40  75.156  14.495   2.192
  323    HG   SER  40           HG       SER  40  78.674  12.763   1.441
  324    HB2  SER  40           HB2      SER  40  77.320  13.656   3.279
  325    HB3  SER  40           HB1      SER  40  76.601  12.610   2.059
  326    H    LYS  41           HN       LYS  41  75.264  16.039   3.782
  327    HA   LYS  41           HA       LYS  41  76.476  18.569   3.232
  328    HB2  LYS  41           HB2      LYS  41  75.174  17.308   5.629
  329    HB3  LYS  41           HB1      LYS  41  76.020  18.842   5.825
  330    HG2  LYS  41           HG2      LYS  41  74.638  19.888   4.128
  331    HG3  LYS  41           HG1      LYS  41  73.875  18.345   3.742
  332    HD2  LYS  41           HD2      LYS  41  73.109  18.262   6.172
  333    HD3  LYS  41           HD1      LYS  41  73.624  19.944   6.298
  334    HE2  LYS  41           HE2      LYS  41  72.138  20.489   4.357
  335    HE3  LYS  41           HE1      LYS  41  71.548  18.828   4.392
  336    HZ1  LYS  41           HZ1      LYS  41  70.763  19.158   6.627
  337    HZ2  LYS  41           HZ2      LYS  41  70.114  20.365   5.623
  338    HZ3  LYS  41           HZ3      LYS  41  71.403  20.728   6.669
  339    HA   PRO  42           HA       PRO  42  80.724  18.477   4.391
  340    HB2  PRO  42           HB2      PRO  42  79.894  20.234   6.686
  341    HB3  PRO  42           HB1      PRO  42  81.257  20.425   5.566
  342    HG2  PRO  42           HG2      PRO  42  78.967  21.808   5.305
  343    HG3  PRO  42           HG1      PRO  42  79.955  21.321   3.920
  344    HD2  PRO  42           HD2      PRO  42  77.299  20.350   4.719
  345    HD3  PRO  42           HD1      PRO  42  78.150  20.141   3.173
  346    HA   PRO  43           HA       PRO  43  81.091  15.388   7.550
  347    HB2  PRO  43           HB2      PRO  43  83.638  15.887   8.495
  348    HB3  PRO  43           HB1      PRO  43  83.291  15.051   6.970
  349    HG2  PRO  43           HG2      PRO  43  84.061  17.886   7.432
  350    HG3  PRO  43           HG1      PRO  43  84.555  16.775   6.143
  351    HD2  PRO  43           HD2      PRO  43  82.675  18.706   5.752
  352    HD3  PRO  43           HD1      PRO  43  82.629  17.148   4.896
  353    H    LYS  44           HN       LYS  44  80.371  15.282   9.642
  354    HA   LYS  44           HA       LYS  44  81.195  17.329  11.601
  355    HB2  LYS  44           HB2      LYS  44  79.086  18.128  10.337
  356    HB3  LYS  44           HB1      LYS  44  78.245  16.829  11.180
  357    HG2  LYS  44           HG2      LYS  44  77.938  18.560  12.694
  358    HG3  LYS  44           HG1      LYS  44  79.448  17.880  13.302
  359    HD2  LYS  44           HD2      LYS  44  80.736  19.540  12.042
  360    HD3  LYS  44           HD1      LYS  44  79.250  20.197  11.355
  361    HE2  LYS  44           HE2      LYS  44  78.467  20.825  13.595
  362    HE3  LYS  44           HE1      LYS  44  79.918  20.125  14.313
  363    HZ1  LYS  44           HZ1      LYS  44  80.758  21.854  12.313
  364    HZ2  LYS  44           HZ2      LYS  44  80.921  22.054  13.993
  365    HZ3  LYS  44           HZ3      LYS  44  79.566  22.686  13.188
  366    H    LYS  45           HN       LYS  45  81.694  14.504  11.379
  367    HA   LYS  45           HA       LYS  45  81.530  12.528  12.643
  368    HB2  LYS  45           HB2      LYS  45  80.786  14.573  14.757
  369    HB3  LYS  45           HB1      LYS  45  81.269  12.909  15.084
  370    HG2  LYS  45           HG2      LYS  45  83.479  13.304  14.581
  371    HG3  LYS  45           HG1      LYS  45  83.092  14.522  13.365
  372    HD2  LYS  45           HD2      LYS  45  84.080  15.711  15.189
  373    HD3  LYS  45           HD1      LYS  45  82.347  16.020  15.293
  374    HE2  LYS  45           HE2      LYS  45  83.806  13.867  16.852
  375    HE3  LYS  45           HE1      LYS  45  83.346  15.440  17.504
  376    HZ1  LYS  45           HZ1      LYS  45  81.526  14.261  18.098
  377    HZ2  LYS  45           HZ2      LYS  45  81.679  13.144  16.827
  378    HZ3  LYS  45           HZ3      LYS  45  81.024  14.684  16.534
  379    H    GLY  46           HN       GLY  46  79.655  11.765  11.440
  380    HA2  GLY  46           HA2      GLY  46  77.549  10.696  11.526
  381    HA3  GLY  46           HA1      GLY  46  77.337  11.328  13.160
  382    H    VAL  47           HN       VAL  47  75.077  11.653  12.094
  383    HA   VAL  47           HA       VAL  47  73.467  13.154  11.283
  384    HB   VAL  47           HB       VAL  47  75.555  15.292  11.709
  385   HG11  VAL  47          HG11      VAL  47  72.548  15.237  12.111
  386   HG12  VAL  47          HG12      VAL  47  73.362  15.912  10.700
  387   HG13  VAL  47          HG13      VAL  47  73.598  16.643  12.288
  388   HG21  VAL  47          HG21      VAL  47  74.702  15.343  14.079
  389   HG22  VAL  47          HG22      VAL  47  75.628  13.894  13.690
  390   HG23  VAL  47          HG23      VAL  47  73.867  13.823  13.757
  391    H    GLN  48           HN       GLN  48  74.390  11.925   9.237
  392    HA   GLN  48           HA       GLN  48  74.868  12.035   6.939
  393    HB2  GLN  48           HB2      GLN  48  74.061  14.941   7.265
  394    HB3  GLN  48           HB1      GLN  48  74.043  13.999   5.774
  395    HG2  GLN  48           HG2      GLN  48  72.412  13.298   8.230
  396    HG3  GLN  48           HG1      GLN  48  71.783  14.214   6.860
  397   HE21  GLN  48          HE21      GLN  48  70.591  11.740   7.460
  398   HE22  GLN  48          HE22      GLN  48  71.004  10.606   6.266
  399    H    GLY  49           HN       GLY  49  77.188  11.819   7.712
  400    HA2  GLY  49           HA2      GLY  49  78.985  13.309   6.244
  401    HA3  GLY  49           HA1      GLY  49  78.836  14.225   7.745
  402    H1U  RCY  50           H1U      RCY  50  81.583   3.464   3.233
  403    H1S  RCY  50           H1S      RCY  50  82.567   7.846   4.756
  404    HB1  RCY  50           HB1      RCY  50  82.790   9.075   7.189
  405    HB2  RCY  50           HB2      RCY  50  82.837  10.508   6.162
  406    HA   RCY  50           HA       RCY  50  80.988  10.005   8.510
  407    HN1  RCY  50           HN1      RCY  50  80.541  11.759   6.260
  408    H    GLY  51           HN       GLY  51  83.990  10.144   8.175
  409    HA2  GLY  51           HA2      GLY  51  84.966  12.686   9.005
  410    HA3  GLY  51           HA1      GLY  51  84.581  11.748  10.449
  411    H    ASP  52           HN       ASP  52  85.302   9.453   8.258
  412    HA   ASP  52           HA       ASP  52  87.697   8.591   9.414
  413    HB2  ASP  52           HB2      ASP  52  86.732   8.265   6.557
  414    HB3  ASP  52           HB1      ASP  52  88.099   7.382   7.238
  415    H    ASP  53           HN       ASP  53  87.592  10.138   6.183
  416    HA   ASP  53           HA       ASP  53  89.754  11.969   6.912
  417    HB2  ASP  53           HB2      ASP  53  90.236   9.620   5.065
  418    HB3  ASP  53           HB1      ASP  53  91.250  11.063   5.054
  419    H    ILE  54           HN       ILE  54  88.184  10.416   4.091
  420    HA   ILE  54           HA       ILE  54  88.161  13.034   2.708
  421    HB   ILE  54           HB       ILE  54  87.056  10.435   1.638
  422   HG12  ILE  54          HG12      ILE  54  89.292   9.896   2.390
  423   HG13  ILE  54          HG11      ILE  54  89.358  10.120   0.642
  424   HG21  ILE  54          HG21      ILE  54  88.280  12.906   0.372
  425   HG22  ILE  54          HG22      ILE  54  86.575  12.453   0.345
  426   HG23  ILE  54          HG23      ILE  54  87.761  11.474  -0.518
  427   HD11  ILE  54          HD11      ILE  54  89.979  12.563   1.144
  428   HD12  ILE  54          HD12      ILE  54  91.212  11.348   1.481
  429   HD13  ILE  54          HD13      ILE  54  90.261  12.030   2.801
  430    HA   PRO  55           HA       PRO  55  83.926  13.587   4.077
  431    HB2  PRO  55           HB2      PRO  55  83.309  15.795   2.608
  432    HB3  PRO  55           HB1      PRO  55  84.379  15.858   4.022
  433    HG2  PRO  55           HG2      PRO  55  85.082  15.826   1.130
  434    HG3  PRO  55           HG1      PRO  55  85.801  16.753   2.457
  435    HD2  PRO  55           HD2      PRO  55  86.925  14.458   1.429
  436    HD3  PRO  55           HD1      PRO  55  87.184  15.016   3.097
  437    H    GLY  56           HN       GLY  56  82.060  12.610   3.364
  438    HA2  GLY  56           HA2      GLY  56  81.791  11.210   0.979
  439    HA3  GLY  56           HA1      GLY  56  80.406  11.833   1.878
  440    H    MET  57           HN       MET  57  82.166  12.094  -1.014
  441    HA   MET  57           HA       MET  57  80.404  14.287  -1.902
  442    HB2  MET  57           HB2      MET  57  82.265  15.581  -1.096
  443    HB3  MET  57           HB1      MET  57  83.428  14.486  -1.839
  444    HG2  MET  57           HG2      MET  57  82.954  16.691  -3.086
  445    HG3  MET  57           HG1      MET  57  82.870  15.207  -4.035
  446    HE1  MET  57           HE1      MET  57  80.194  17.184  -5.756
  447    HE2  MET  57           HE2      MET  57  81.917  16.854  -5.592
  448    HE3  MET  57           HE3      MET  57  81.202  18.217  -4.735
  449    H    GLU  58           HN       GLU  58  81.739  11.353  -2.402
  450    HA   GLU  58           HA       GLU  58  81.479  11.597  -5.376
  451    HB2  GLU  58           HB2      GLU  58  83.880  11.281  -4.430
  452    HB3  GLU  58           HB1      GLU  58  83.360   9.639  -4.058
  453    HG2  GLU  58           HG2      GLU  58  84.249   9.387  -6.209
  454    HG3  GLU  58           HG1      GLU  58  82.533   9.618  -6.547
  455    H    GLY  59           HN       GLY  59  79.275  10.843  -5.134
  456    HA2  GLY  59           HA2      GLY  59  78.896   8.065  -5.441
  457    HA3  GLY  59           HA1      GLY  59  78.580   8.431  -3.745
  458    H1U  RCY  60           H1U      RCY  60  74.323   0.758  -5.309
  459    H1S  RCY  60           H1S      RCY  60  73.359   5.169  -4.676
  460    HB1  RCY  60           HB1      RCY  60  73.069   8.007  -5.879
  461    HB2  RCY  60           HB2      RCY  60  73.496   7.539  -4.233
  462    HA   RCY  60           HA       RCY  60  74.792   9.556  -6.033
  463    HN1  RCY  60           HN1      RCY  60  76.330   7.749  -4.290
  464    H    GLY  61           HN       GLY  61  73.971   8.414  -2.764
  465    HA2  GLY  61           HA2      GLY  61  73.870  11.176  -1.754
  466    HA3  GLY  61           HA1      GLY  61  72.309  10.365  -1.885
  467    H    THR  62           HN       THR  62  72.401  10.746   0.533
  468    HA   THR  62           HA       THR  62  73.082  10.110   2.739
  469    HB   THR  62           HB       THR  62  71.191   8.742   2.513
  470    HG1  THR  62           HG1      THR  62  73.398   7.010   2.926
  471   HG21  THR  62          HG21      THR  62  72.807   7.111   0.535
  472   HG22  THR  62          HG22      THR  62  71.465   8.190   0.154
  473   HG23  THR  62          HG23      THR  62  71.175   6.710   1.068
  474    H    ASP  63           HN       ASP  63  75.408  10.453   2.556
  475    HA   ASP  63           HA       ASP  63  77.164   8.355   1.631
  476    HB2  ASP  63           HB2      ASP  63  78.952   9.681   2.664
  477    HB3  ASP  63           HB1      ASP  63  77.863  10.729   1.756
  478    H    ILE  64           HN       ILE  64  75.568   9.011   4.679
  479    HA   ILE  64           HA       ILE  64  76.465   6.424   5.687
  480    HB   ILE  64           HB       ILE  64  78.369   7.996   6.217
  481   HG12  ILE  64          HG12      ILE  64  78.031   7.477   8.854
  482   HG13  ILE  64          HG11      ILE  64  76.801   6.406   8.181
  483   HG21  ILE  64          HG21      ILE  64  76.670   9.910   6.658
  484   HG22  ILE  64          HG22      ILE  64  78.074   9.791   7.719
  485   HG23  ILE  64          HG23      ILE  64  76.506   9.196   8.262
  486   HD11  ILE  64          HD11      ILE  64  78.668   5.020   8.114
  487   HD12  ILE  64          HD12      ILE  64  79.775   6.355   7.793
  488   HD13  ILE  64          HD13      ILE  64  78.734   5.744   6.507
  489    H    THR  65           HN       THR  65  74.721   9.408   6.149
  490    HA   THR  65           HA       THR  65  72.933   9.963   7.594
  491    HB   THR  65           HB       THR  65  71.886   8.773   5.667
  492    HG1  THR  65           HG1      THR  65  70.613   8.097   8.099
  493   HG21  THR  65          HG21      THR  65  72.866   6.581   5.901
  494   HG22  THR  65          HG22      THR  65  71.124   6.410   6.117
  495   HG23  THR  65          HG23      THR  65  72.192   6.398   7.520
  496    H    VAL  66           HN       VAL  66  75.101   8.524   8.948
  497    HA   VAL  66           HA       VAL  66  75.446   7.773  11.135
  498    HB   VAL  66           HB       VAL  66  72.470   7.557  11.548
  499   HG11  VAL  66          HG11      VAL  66  73.088   8.219  13.825
  500   HG12  VAL  66          HG12      VAL  66  74.764   8.444  13.325
  501   HG13  VAL  66          HG13      VAL  66  74.053   6.830  13.325
  502   HG21  VAL  66          HG21      VAL  66  72.388   9.711  10.744
  503   HG22  VAL  66          HG22      VAL  66  74.108   9.990  11.021
  504   HG23  VAL  66          HG23      VAL  66  72.972  10.078  12.368
  505    H    ILE  67           HN       ILE  67  73.544   6.042   8.829
  506    HA   ILE  67           HA       ILE  67  74.304   3.523  10.253
  507    HB   ILE  67           HB       ILE  67  71.678   3.829   8.793
  508   HG12  ILE  67          HG12      ILE  67  72.267   4.066  11.762
  509   HG13  ILE  67          HG11      ILE  67  71.672   5.355  10.715
  510   HG21  ILE  67          HG21      ILE  67  71.141   1.736   9.856
  511   HG22  ILE  67          HG22      ILE  67  72.586   1.813  10.864
  512   HG23  ILE  67          HG23      ILE  67  72.735   1.550   9.126
  513   HD11  ILE  67          HD11      ILE  67  70.240   2.833  11.563
  514   HD12  ILE  67          HD12      ILE  67  69.700   3.795  10.187
  515   HD13  ILE  67          HD13      ILE  67  69.734   4.506  11.801
  516    H1U  RCY  68           H1U      RCY  68  72.727   1.156   1.274
  517    H1S  RCY  68           H1S      RCY  68  76.004   1.852   3.559
  518    HB1  RCY  68           HB1      RCY  68  78.002   3.506   6.493
  519    HB2  RCY  68           HB2      RCY  68  76.719   4.702   6.592
  520    HA   RCY  68           HA       RCY  68  75.250   2.472   6.052
  521    HN1  RCY  68           HN1      RCY  68  76.024   3.310   8.813
  522    HA   PRO  69           HA       PRO  69  76.994  -1.537   6.686
  523    HB2  PRO  69           HB2      PRO  69  79.149  -0.671   4.774
  524    HB3  PRO  69           HB1      PRO  69  78.274  -2.214   4.850
  525    HG2  PRO  69           HG2      PRO  69  77.612  -0.321   3.093
  526    HG3  PRO  69           HG1      PRO  69  76.384  -1.335   3.866
  527    HD2  PRO  69           HD2      PRO  69  76.950   1.541   4.279
  528    HD3  PRO  69           HD1      PRO  69  75.476   0.619   4.650
  529    H    TRP  70           HN       TRP  70  78.862   1.326   7.181
  530    HA   TRP  70           HA       TRP  70  81.136  -0.033   8.408
  531    HD1  TRP  70           HD1      TRP  70  82.697   1.484  10.573
  532    HE1  TRP  70           HE1      TRP  70  85.219   1.496  10.043
  533    HE3  TRP  70           HE3      TRP  70  82.551   2.716   5.620
  534    HZ2  TRP  70           HZ2      TRP  70  86.950   1.967   7.810
  535    HZ3  TRP  70           HZ3      TRP  70  84.644   2.939   4.318
  536    HH2  TRP  70           HH2      TRP  70  86.841   2.567   5.402
  537    HB2  TRP  70           HB2      TRP  70  80.789   2.458   7.340
  538    HB3  TRP  70           HB1      TRP  70  80.649   2.822   9.059
  539    H    GLU  71           HN       GLU  71  77.977   0.883   9.440
  540    HA   GLU  71           HA       GLU  71  78.791   0.928  12.299
  541    HB2  GLU  71           HB2      GLU  71  76.179   1.510  10.883
  542    HB3  GLU  71           HB1      GLU  71  76.328   1.453  12.640
  543    HG2  GLU  71           HG2      GLU  71  78.124   3.190  10.940
  544    HG3  GLU  71           HG1      GLU  71  76.569   3.764  11.546
  545    H    ALA  72           HN       ALA  72  76.643  -0.881  10.093
  546    HA   ALA  72           HA       ALA  72  75.925  -2.813  12.152
  547    HB1  ALA  72           HB1      ALA  72  74.931  -4.065  10.203
  548    HB2  ALA  72           HB2      ALA  72  75.562  -2.804   9.144
  549    HB3  ALA  72           HB3      ALA  72  74.350  -2.407  10.363
  550    H1U  RCY  73           H1U      RCY  73  77.131  -5.834   4.132
  551    H1S  RCY  73           H1S      RCY  73  79.236  -3.562   7.853
  552    HB1  RCY  73           HB1      RCY  73  81.758  -3.563  10.341
  553    HB2  RCY  73           HB2      RCY  73  80.634  -2.513   9.481
  554    HA   RCY  73           HA       RCY  73  79.401  -5.073   9.681
  555    HN1  RCY  73           HN1      RCY  73  78.718  -2.361  10.316
  556    H    ASN  74           HN       ASN  74  79.959  -3.080  12.576
  557    HA   ASN  74           HA       ASN  74  81.543  -5.054  13.949
  558    HB2  ASN  74           HB2      ASN  74  81.192  -3.702  15.926
  559    HB3  ASN  74           HB1      ASN  74  81.418  -2.613  14.558
  560   HD21  ASN  74          HD21      ASN  74  78.721  -4.286  16.288
  561   HD22  ASN  74          HD22      ASN  74  77.631  -2.994  16.133
  562    H    HIS  75           HN       HIS  75  78.557  -5.507  12.843
  563    HA   HIS  75           HA       HIS  75  77.964  -7.554  14.838
  564    HD1  HIS  75           HD1      HIS  75  76.804  -8.475  16.392
  565    HD2  HIS  75           HD2      HIS  75  73.510  -6.125  15.377
  566    HE1  HIS  75           HE1      HIS  75  74.755  -9.725  17.204
  567    HE2  HIS  75           HE2      HIS  75  72.744  -8.305  16.592
  568    HB2  HIS  75           HB2      HIS  75  77.026  -5.493  15.896
  569    HB3  HIS  75           HB1      HIS  75  75.994  -5.276  14.482
  570    H1U  RCY  76           H1U      RCY  76  74.115  -5.879   3.603
  571    H1S  RCY  76           H1S      RCY  76  76.812  -6.368   7.189
  572    HB1  RCY  76           HB1      RCY  76  77.293  -8.682   8.884
  573    HB2  RCY  76           HB2      RCY  76  78.318  -7.608   9.834
  574    HA   RCY  76           HA       RCY  76  75.790  -8.614  11.083
  575    HN1  RCY  76           HN1      RCY  76  78.484  -8.108  12.289
  576    H    GLU  77           HN       GLU  77  78.342  -9.901   9.289
  577    HA   GLU  77           HA       GLU  77  77.610 -12.613  10.001
  578    HB2  GLU  77           HB2      GLU  77  78.517 -11.669   7.734
  579    HB3  GLU  77           HB1      GLU  77  80.104 -11.904   8.466
  580    HG2  GLU  77           HG2      GLU  77  79.614 -13.928   7.285
  581    HG3  GLU  77           HG1      GLU  77  79.368 -14.287   8.995
  582    H    LEU  78           HN       LEU  78  80.676 -13.231   9.655
  583    HA   LEU  78           HA       LEU  78  81.243 -13.128  12.582
  584    HG   LEU  78           HG       LEU  78  82.915 -16.297  12.588
  585    HB2  LEU  78           HB2      LEU  78  81.264 -15.291  10.978
  586    HB3  LEU  78           HB1      LEU  78  82.919 -14.753  10.714
  587   HD11  LEU  78          HD11      LEU  78  83.035 -13.576  13.878
  588   HD12  LEU  78          HD12      LEU  78  84.218 -14.043  12.656
  589   HD13  LEU  78          HD13      LEU  78  84.077 -14.972  14.148
  590   HD21  LEU  78          HD21      LEU  78  81.205 -14.551  14.283
  591   HD22  LEU  78          HD22      LEU  78  81.341 -16.310  14.259
  592   HD23  LEU  78          HD23      LEU  78  80.371 -15.484  13.039
  593    H    HIS  79           HN       HIS  79  82.796 -12.623   9.413
  594    HA   HIS  79           HA       HIS  79  85.059 -11.212  10.701
  595    HD1  HIS  79           HD1      HIS  79  85.508 -14.507   8.081
  596    HD2  HIS  79           HD2      HIS  79  87.598 -11.717  10.371
  597    HE1  HIS  79           HE1      HIS  79  87.475 -15.742   9.091
  598    HE2  HIS  79           HE2      HIS  79  88.756 -14.055  10.488
  599    HB2  HIS  79           HB2      HIS  79  84.438 -12.269   7.976
  600    HB3  HIS  79           HB1      HIS  79  85.612 -10.960   8.110
  601    H    GLU  80           HN       GLU  80  85.633  -8.995   9.721
  602    HA   GLU  80           HA       GLU  80  83.119  -7.415   9.533
  603    HB2  GLU  80           HB2      GLU  80  85.173  -6.909  11.100
  604    HB3  GLU  80           HB1      GLU  80  85.883  -6.225   9.641
  605    HG2  GLU  80           HG2      GLU  80  84.789  -4.363  10.517
  606    HG3  GLU  80           HG1      GLU  80  83.555  -5.004   9.432
  607    H    LEU  81           HN       LEU  81  86.276  -7.661   7.912
  608    HA   LEU  81           HA       LEU  81  85.084  -6.434   5.476
  609    HG   LEU  81           HG       LEU  81  87.314  -6.266   7.921
  610    HB2  LEU  81           HB2      LEU  81  87.797  -6.799   4.980
  611    HB3  LEU  81           HB1      LEU  81  87.058  -5.312   5.565
  612   HD11  LEU  81          HD11      LEU  81  88.708  -8.336   6.270
  613   HD12  LEU  81          HD12      LEU  81  87.736  -8.535   7.728
  614   HD13  LEU  81          HD13      LEU  81  89.389  -7.931   7.845
  615   HD21  LEU  81          HD21      LEU  81  88.796  -4.512   7.100
  616   HD22  LEU  81          HD22      LEU  81  89.774  -5.699   6.236
  617   HD23  LEU  81          HD23      LEU  81  89.752  -5.690   8.000
  618    H    ALA  82           HN       ALA  82  87.194  -9.160   6.384
  619    HA   ALA  82           HA       ALA  82  87.006 -10.480   3.837
  620    HB1  ALA  82           HB1      ALA  82  87.910 -11.279   6.597
  621    HB2  ALA  82           HB2      ALA  82  88.871 -11.095   5.131
  622    HB3  ALA  82           HB3      ALA  82  87.801 -12.485   5.313
  623    H    GLN  83           HN       GLN  83  84.968 -11.029   3.142
  624    HA   GLN  83           HA       GLN  83  83.528 -13.026   4.798
  625    HB2  GLN  83           HB2      GLN  83  82.606 -10.491   4.840
  626    HB3  GLN  83           HB1      GLN  83  81.831 -11.038   3.356
  627    HG2  GLN  83           HG2      GLN  83  80.347 -11.468   5.250
  628    HG3  GLN  83           HG1      GLN  83  80.918 -13.001   4.592
  629   HE21  GLN  83          HE21      GLN  83  81.665 -14.428   6.160
  630   HE22  GLN  83          HE22      GLN  83  82.307 -13.978   7.665
  631    H    TYR  84           HN       TYR  84  85.233 -12.949   2.356
  632    HA   TYR  84           HA       TYR  84  85.194 -13.649   0.101
  633    HD1  TYR  84           HD2      TYR  84  84.756 -15.315   3.558
  634    HD2  TYR  84           HD1      TYR  84  81.758 -16.354   0.663
  635    HE1  TYR  84           HE2      TYR  84  83.191 -15.903   5.390
  636    HE2  TYR  84           HE1      TYR  84  80.193 -16.941   2.495
  637    HH   TYR  84           HH       TYR  84  80.213 -17.554   4.802
  638    HB2  TYR  84           HB2      TYR  84  83.996 -15.918  -0.038
  639    HB3  TYR  84           HB1      TYR  84  85.307 -15.771   1.131
  640    H    GLY  85           HN       GLY  85  83.968 -11.886  -0.820
  641    HA2  GLY  85           HA2      GLY  85  82.272 -11.184  -2.285
  642    HA3  GLY  85           HA1      GLY  85  81.564 -12.793  -2.153
  643    H    ILE  86           HN       ILE  86  82.202 -10.347   0.385
  644    HA   ILE  86           HA       ILE  86  80.034 -10.718   2.009
  645    HB   ILE  86           HB       ILE  86  81.646  -8.913   2.410
  646   HG12  ILE  86          HG12      ILE  86  80.028  -7.112   3.055
  647   HG13  ILE  86          HG11      ILE  86  78.779  -7.956   2.138
  648   HG21  ILE  86          HG21      ILE  86  80.242  -7.510   0.114
  649   HG22  ILE  86          HG22      ILE  86  81.871  -8.185   0.053
  650   HG23  ILE  86          HG23      ILE  86  81.520  -6.822   1.116
  651   HD11  ILE  86          HD11      ILE  86  78.723  -9.762   3.620
  652   HD12  ILE  86          HD12      ILE  86  79.001  -8.406   4.713
  653   HD13  ILE  86          HD13      ILE  86  80.346  -9.439   4.230
  654    H1U  RCY  87           H1U      RCY  87  77.629  -6.012   2.262
  655    H1S  RCY  87           H1S      RCY  87  77.185  -5.699  -2.466
  656    HB1  RCY  87           HB1      RCY  87  77.684  -9.904  -3.667
  657    HB2  RCY  87           HB2      RCY  87  79.236  -9.200  -3.225
  658    HA   RCY  87           HA       RCY  87  77.349  -8.302  -1.295
  659    HN1  RCY  87           HN1      RCY  87  79.903  -9.508  -1.268
  Start of MODEL   76
    1    HA   MET   1           HA       MET   1  58.894  -9.341  27.217
    2    HB2  MET   1           HB2      MET   1  60.947  -7.410  26.105
    3    HB3  MET   1           HB1      MET   1  59.346  -6.905  26.647
    4    HG2  MET   1           HG2      MET   1  59.781  -7.494  28.884
    5    HG3  MET   1           HG1      MET   1  61.127  -8.545  28.442
    6    HE1  MET   1           HE1      MET   1  60.725  -4.969  26.698
    7    HE2  MET   1           HE2      MET   1  61.049  -3.974  28.116
    8    HE3  MET   1           HE3      MET   1  59.690  -5.096  28.126
    9    H    ASN   2           HN       ASN   2  59.296 -10.866  24.692
   10    HA   ASN   2           HA       ASN   2  58.523 -10.909  22.460
   11    HB2  ASN   2           HB2      ASN   2  56.121 -10.157  22.315
   12    HB3  ASN   2           HB1      ASN   2  56.447 -11.272  23.642
   13   HD21  ASN   2          HD21      ASN   2  55.348  -8.064  22.859
   14   HD22  ASN   2          HD22      ASN   2  55.156  -7.517  24.454
   15    H    LEU   3           HN       LEU   3  59.797  -9.609  21.171
   16    HA   LEU   3           HA       LEU   3  60.387  -6.986  21.114
   17    HG   LEU   3           HG       LEU   3  58.234  -7.745  18.233
   18    HB2  LEU   3           HB2      LEU   3  60.544  -7.045  18.716
   19    HB3  LEU   3           HB1      LEU   3  60.922  -8.663  19.302
   20   HD11  LEU   3          HD11      LEU   3  60.106  -8.110  16.563
   21   HD12  LEU   3          HD12      LEU   3  58.704  -9.156  16.340
   22   HD13  LEU   3          HD13      LEU   3  60.163  -9.789  17.102
   23   HD21  LEU   3          HD21      LEU   3  57.698  -9.386  19.820
   24   HD22  LEU   3          HD22      LEU   3  59.199 -10.273  19.551
   25   HD23  LEU   3          HD23      LEU   3  57.906 -10.345  18.354
   26    H    GLU   4           HN       GLU   4  59.419  -5.008  20.788
   27    HA   GLU   4           HA       GLU   4  56.712  -4.606  21.334
   28    HB2  GLU   4           HB2      GLU   4  58.758  -2.933  21.055
   29    HB3  GLU   4           HB1      GLU   4  58.090  -2.725  19.439
   30    HG2  GLU   4           HG2      GLU   4  56.292  -2.559  21.849
   31    HG3  GLU   4           HG1      GLU   4  57.244  -1.159  21.354
   32    HA   PRO   5           HA       PRO   5  54.446  -6.290  17.880
   33    HB2  PRO   5           HB2      PRO   5  52.967  -3.689  18.168
   34    HB3  PRO   5           HB1      PRO   5  52.322  -5.330  17.965
   35    HG2  PRO   5           HG2      PRO   5  52.410  -4.118  20.353
   36    HG3  PRO   5           HG1      PRO   5  52.627  -5.866  20.172
   37    HD2  PRO   5           HD2      PRO   5  54.618  -3.817  20.915
   38    HD3  PRO   5           HD1      PRO   5  54.679  -5.579  21.141
   39    HA   PRO   6           HA       PRO   6  56.180  -4.224  14.347
   40    HB2  PRO   6           HB2      PRO   6  54.495  -5.070  12.366
   41    HB3  PRO   6           HB1      PRO   6  55.690  -6.131  13.138
   42    HG2  PRO   6           HG2      PRO   6  52.763  -5.913  13.635
   43    HG3  PRO   6           HG1      PRO   6  53.794  -7.353  13.564
   44    HD2  PRO   6           HD2      PRO   6  52.971  -6.223  15.923
   45    HD3  PRO   6           HD1      PRO   6  54.494  -7.125  15.759
   46    H    LYS   7           HN       LYS   7  55.762  -2.496  12.783
   47    HA   LYS   7           HA       LYS   7  53.990  -0.468  13.723
   48    HB2  LYS   7           HB2      LYS   7  55.452  -0.867  11.108
   49    HB3  LYS   7           HB1      LYS   7  54.432   0.542  11.395
   50    HG2  LYS   7           HG2      LYS   7  55.766   1.193  13.312
   51    HG3  LYS   7           HG1      LYS   7  56.709  -0.295  13.212
   52    HD2  LYS   7           HD2      LYS   7  56.615   1.353  10.744
   53    HD3  LYS   7           HD1      LYS   7  57.518   2.035  12.098
   54    HE2  LYS   7           HE2      LYS   7  58.813   0.508  10.468
   55    HE3  LYS   7           HE1      LYS   7  58.996   0.187  12.192
   56    HZ1  LYS   7           HZ1      LYS   7  57.422  -1.299  10.191
   57    HZ2  LYS   7           HZ2      LYS   7  57.019  -1.387  11.839
   58    HZ3  LYS   7           HZ3      LYS   7  58.554  -1.887  11.309
   59    H    ALA   8           HN       ALA   8  53.392  -3.266  11.861
   60    HA   ALA   8           HA       ALA   8  51.520  -3.979  10.628
   61    HB1  ALA   8           HB1      ALA   8  50.125  -2.049  12.508
   62    HB2  ALA   8           HB2      ALA   8  50.551  -3.713  12.908
   63    HB3  ALA   8           HB3      ALA   8  49.371  -3.386  11.639
   64    H    GLU   9           HN       GLU   9  52.979  -1.652   9.579
   65    HA   GLU   9           HA       GLU   9  50.793  -0.573   7.874
   66    HB2  GLU   9           HB2      GLU   9  52.757   1.053   9.497
   67    HB3  GLU   9           HB1      GLU   9  51.997   1.706   8.045
   68    HG2  GLU   9           HG2      GLU   9  50.425   0.507  10.340
   69    HG3  GLU   9           HG1      GLU   9  50.779   2.231  10.208
   70    H1U  RCY  10           H1U      RCY  10  57.072  -4.894  11.010
   71    H1S  RCY  10           H1S      RCY  10  57.954  -1.848   7.336
   72    HB1  RCY  10           HB1      RCY  10  55.683  -2.972   5.282
   73    HB2  RCY  10           HB2      RCY  10  54.966  -2.976   6.893
   74    HA   RCY  10           HA       RCY  10  53.923  -1.046   4.845
   75    HN1  RCY  10           HN1      RCY  10  52.170  -2.426   6.746
   76    H    ARG  11           HN       ARG  11  51.540  -2.128   4.202
   77    HA   ARG  11           HA       ARG  11  51.345  -4.871   3.635
   78    HE   ARG  11           HE       ARG  11  49.476  -2.874  -0.766
   79    HB2  ARG  11           HB2      ARG  11  49.599  -3.035   3.215
   80    HB3  ARG  11           HB1      ARG  11  50.440  -2.735   1.693
   81    HG2  ARG  11           HG2      ARG  11  50.206  -5.335   1.376
   82    HG3  ARG  11           HG1      ARG  11  48.908  -5.171   2.558
   83    HD2  ARG  11           HD2      ARG  11  47.824  -4.901   0.471
   84    HD3  ARG  11           HD1      ARG  11  48.042  -3.253   1.060
   85   HH11  ARG  11          HH21      ARG  11  49.160  -6.233  -0.059
   86   HH12  ARG  11          HH22      ARG  11  50.093  -6.745  -1.426
   87   HH21  ARG  11          HH11      ARG  11  50.696  -3.522  -2.555
   88   HH22  ARG  11          HH12      ARG  11  50.962  -5.210  -2.839
   89    H    SER  12           HN       SER  12  52.490  -6.206   2.300
   90    HA   SER  12           HA       SER  12  53.849  -5.064  -0.074
   91    HG   SER  12           HG       SER  12  54.344  -6.899   2.668
   92    HB2  SER  12           HB2      SER  12  55.938  -6.430   0.663
   93    HB3  SER  12           HB1      SER  12  55.657  -4.863   1.416
   94    H    ALA  13           HN       ALA  13  53.973  -6.536  -1.743
   95    HA   ALA  13           HA       ALA  13  53.927  -9.387  -1.411
   96    HB1  ALA  13           HB1      ALA  13  51.629  -9.791  -2.302
   97    HB2  ALA  13           HB2      ALA  13  51.299  -8.065  -2.158
   98    HB3  ALA  13           HB3      ALA  13  51.611  -9.026  -0.713
   99    H    THR  14           HN       THR  14  51.950  -9.128  -3.943
  100    HA   THR  14           HA       THR  14  53.975  -9.411  -5.921
  101    HB   THR  14           HB       THR  14  51.762 -10.234  -6.394
  102    HG1  THR  14           HG1      THR  14  52.707  -9.529  -8.244
  103   HG21  THR  14          HG21      THR  14  49.838  -8.661  -6.608
  104   HG22  THR  14          HG22      THR  14  50.874  -7.361  -6.021
  105   HG23  THR  14          HG23      THR  14  50.486  -8.723  -4.969
  106    H    ARG  15           HN       ARG  15  53.056  -6.669  -4.233
  107    HA   ARG  15           HA       ARG  15  53.028  -4.576  -6.095
  108    HE   ARG  15           HE       ARG  15  55.184  -0.407  -3.988
  109    HB2  ARG  15           HB2      ARG  15  52.686  -4.225  -3.686
  110    HB3  ARG  15           HB1      ARG  15  54.375  -4.625  -3.377
  111    HG2  ARG  15           HG2      ARG  15  55.103  -2.705  -4.716
  112    HG3  ARG  15           HG1      ARG  15  53.426  -2.319  -5.104
  113    HD2  ARG  15           HD2      ARG  15  52.957  -1.570  -2.956
  114    HD3  ARG  15           HD1      ARG  15  54.222  -2.556  -2.224
  115   HH11  ARG  15          HH21      ARG  15  54.352  -1.501  -0.826
  116   HH12  ARG  15          HH22      ARG  15  55.322  -0.316  -0.016
  117   HH21  ARG  15          HH11      ARG  15  56.455   1.147  -2.949
  118   HH22  ARG  15          HH12      ARG  15  56.513   1.183  -1.218
  119    H    VAL  16           HN       VAL  16  55.849  -6.260  -4.712
  120    HA   VAL  16           HA       VAL  16  57.440  -5.328  -7.033
  121    HB   VAL  16           HB       VAL  16  57.777  -3.659  -5.192
  122   HG11  VAL  16          HG11      VAL  16  58.811  -4.306  -3.133
  123   HG12  VAL  16          HG12      VAL  16  59.127  -5.937  -3.726
  124   HG13  VAL  16          HG13      VAL  16  57.474  -5.430  -3.377
  125   HG21  VAL  16          HG21      VAL  16  60.283  -5.305  -5.550
  126   HG22  VAL  16          HG22      VAL  16  60.125  -3.550  -5.476
  127   HG23  VAL  16          HG23      VAL  16  59.567  -4.426  -6.901
  128    H    MET  17           HN       MET  17  56.496  -7.769  -4.984
  129    HA   MET  17           HA       MET  17  58.830  -9.294  -4.524
  130    HB2  MET  17           HB2      MET  17  56.479  -9.817  -3.716
  131    HB3  MET  17           HB1      MET  17  56.148 -10.450  -5.329
  132    HG2  MET  17           HG2      MET  17  58.190 -11.942  -5.029
  133    HG3  MET  17           HG1      MET  17  58.189 -11.454  -3.334
  134    HE1  MET  17           HE1      MET  17  55.834 -13.597  -1.637
  135    HE2  MET  17           HE2      MET  17  56.319 -11.903  -1.645
  136    HE3  MET  17           HE3      MET  17  57.536 -13.162  -1.837
  137    H    GLY  18           HN       GLY  18  60.152  -8.907  -6.441
  138    HA2  GLY  18           HA2      GLY  18  61.020  -9.508  -8.536
  139    HA3  GLY  18           HA1      GLY  18  60.130 -11.018  -8.330
  140    H    GLY  19           HN       GLY  19  59.575 -11.000 -10.600
  141    HA2  GLY  19           HA2      GLY  19  57.873 -10.699 -12.217
  142    HA3  GLY  19           HA1      GLY  19  57.104  -9.531 -11.141
  143    HA   PRO  20           HA       PRO  20  59.110  -7.506 -14.989
  144    HB2  PRO  20           HB2      PRO  20  56.562  -5.986 -14.557
  145    HB3  PRO  20           HB1      PRO  20  57.337  -6.479 -16.076
  146    HG2  PRO  20           HG2      PRO  20  55.215  -7.768 -15.107
  147    HG3  PRO  20           HG1      PRO  20  56.516  -8.619 -15.956
  148    HD2  PRO  20           HD2      PRO  20  55.861  -8.613 -13.054
  149    HD3  PRO  20           HD1      PRO  20  56.679  -9.857 -14.024
  150    H1U  RCY  21           H1U      RCY  21  62.279  -5.578  -5.329
  151    H1S  RCY  21           H1S      RCY  21  62.495  -6.218  -9.472
  152    HB1  RCY  21           HB1      RCY  21  61.338  -6.250 -11.243
  153    HB2  RCY  21           HB2      RCY  21  60.424  -4.936 -10.506
  154    HA   RCY  21           HA       RCY  21  60.027  -3.916 -12.515
  155    HN1  RCY  21           HN1      RCY  21  60.773  -6.511 -13.779
  156    H    THR  22           HN       THR  22  61.071  -2.427 -13.738
  157    HA   THR  22           HA       THR  22  63.828  -3.081 -14.721
  158    HB   THR  22           HB       THR  22  62.586  -2.736 -16.669
  159    HG1  THR  22           HG1      THR  22  62.911  -0.305 -17.049
  160   HG21  THR  22          HG21      THR  22  60.451  -2.189 -15.766
  161   HG22  THR  22          HG22      THR  22  60.890  -0.823 -16.792
  162   HG23  THR  22          HG23      THR  22  61.058  -0.701 -15.040
  163    HA   PRO  23           HA       PRO  23  64.521   0.107 -11.469
  164    HB2  PRO  23           HB2      PRO  23  67.326  -0.605 -12.203
  165    HB3  PRO  23           HB1      PRO  23  66.575  -0.484 -10.600
  166    HG2  PRO  23           HG2      PRO  23  67.128  -2.843 -11.711
  167    HG3  PRO  23           HG1      PRO  23  65.685  -2.600 -10.711
  168    HD2  PRO  23           HD2      PRO  23  65.895  -2.853 -13.686
  169    HD3  PRO  23           HD1      PRO  23  64.587  -3.370 -12.598
  170    H    ARG  24           HN       ARG  24  66.102   2.081 -11.541
  171    HA   ARG  24           HA       ARG  24  65.665   3.468 -14.050
  172    HE   ARG  24           HE       ARG  24  64.249   6.673 -12.816
  173    HB2  ARG  24           HB2      ARG  24  67.423   4.273 -11.711
  174    HB3  ARG  24           HB1      ARG  24  66.824   5.337 -12.984
  175    HG2  ARG  24           HG2      ARG  24  64.466   4.558 -12.251
  176    HG3  ARG  24           HG1      ARG  24  65.263   3.977 -10.789
  177    HD2  ARG  24           HD2      ARG  24  64.768   6.121 -10.099
  178    HD3  ARG  24           HD1      ARG  24  66.330   6.429 -10.856
  179   HH11  ARG  24          HH21      ARG  24  65.626   8.171 -10.032
  180   HH12  ARG  24          HH22      ARG  24  65.171   9.774 -10.505
  181   HH21  ARG  24          HH11      ARG  24  63.646   8.757 -13.449
  182   HH22  ARG  24          HH12      ARG  24  64.050  10.106 -12.440
  183    H    LYS  25           HN       LYS  25  67.225   1.073 -14.367
  184    HA   LYS  25           HA       LYS  25  69.195   0.323 -15.391
  185    HB2  LYS  25           HB2      LYS  25  69.196   3.205 -16.339
  186    HB3  LYS  25           HB1      LYS  25  70.204   1.925 -17.012
  187    HG2  LYS  25           HG2      LYS  25  67.246   1.479 -16.831
  188    HG3  LYS  25           HG1      LYS  25  67.870   2.509 -18.120
  189    HD2  LYS  25           HD2      LYS  25  69.316   0.731 -18.918
  190    HD3  LYS  25           HD1      LYS  25  68.877  -0.293 -17.550
  191    HE2  LYS  25           HE2      LYS  25  66.643  -0.558 -18.332
  192    HE3  LYS  25           HE1      LYS  25  66.814   0.759 -19.493
  193    HZ1  LYS  25           HZ1      LYS  25  68.640  -0.660 -20.508
  194    HZ2  LYS  25           HZ2      LYS  25  67.038  -1.175 -20.747
  195    HZ3  LYS  25           HZ3      LYS  25  68.015  -1.940 -19.587
  196    H    GLY  26           HN       GLY  26  70.430   3.612 -15.019
  197    HA2  GLY  26           HA2      GLY  26  71.897   3.025 -12.579
  198    HA3  GLY  26           HA1      GLY  26  72.926   2.942 -14.010
  199    HA   PRO  27           HA       PRO  27  71.046   7.482 -13.471
  200    HB2  PRO  27           HB2      PRO  27  71.140   7.470 -10.493
  201    HB3  PRO  27           HB1      PRO  27  69.928   8.176 -11.581
  202    HG2  PRO  27           HG2      PRO  27  69.433   5.958 -10.202
  203    HG3  PRO  27           HG1      PRO  27  68.820   6.177 -11.852
  204    HD2  PRO  27           HD2      PRO  27  71.125   4.504 -10.905
  205    HD3  PRO  27           HD1      PRO  27  69.947   4.175 -12.197
  206    HA   PRO  28           HA       PRO  28  75.490   8.339 -13.364
  207    HB2  PRO  28           HB2      PRO  28  74.389  11.130 -13.377
  208    HB3  PRO  28           HB1      PRO  28  75.693  10.429 -14.357
  209    HG2  PRO  28           HG2      PRO  28  73.247  10.818 -15.351
  210    HG3  PRO  28           HG1      PRO  28  74.232   9.423 -15.818
  211    HD2  PRO  28           HD2      PRO  28  71.808   9.512 -14.102
  212    HD3  PRO  28           HD1      PRO  28  72.470   8.163 -15.051
  213    H    LYS  29           HN       LYS  29  76.987   9.529 -11.920
  214    HA   LYS  29           HA       LYS  29  76.495   9.220  -9.189
  215    HB2  LYS  29           HB2      LYS  29  78.265  11.193  -9.023
  216    HB3  LYS  29           HB1      LYS  29  78.740   9.616  -9.652
  217    HG2  LYS  29           HG2      LYS  29  78.500  10.373 -11.931
  218    HG3  LYS  29           HG1      LYS  29  77.781  11.895 -11.403
  219    HD2  LYS  29           HD2      LYS  29  79.983  12.553 -11.761
  220    HD3  LYS  29           HD1      LYS  29  80.033  12.137 -10.048
  221    HE2  LYS  29           HE2      LYS  29  81.926  11.066 -11.064
  222    HE3  LYS  29           HE1      LYS  29  80.739   9.799 -10.751
  223    HZ1  LYS  29           HZ1      LYS  29  81.657  10.901 -13.279
  224    HZ2  LYS  29           HZ2      LYS  29  79.995  10.560 -13.177
  225    HZ3  LYS  29           HZ3      LYS  29  81.136   9.331 -12.903
  226    H1U  RCY  30           H1U      RCY  30  75.169  15.975 -10.614
  227    H1S  RCY  30           H1S      RCY  30  72.103  14.339  -8.014
  228    HB1  RCY  30           HB1      RCY  30  74.074  11.524  -5.954
  229    HB2  RCY  30           HB2      RCY  30  72.727  10.833  -6.857
  230    HA   RCY  30           HA       RCY  30  73.249  12.307  -8.766
  231    HN1  RCY  30           HN1      RCY  30  74.818  10.121  -8.065
  232    H    LYS  31           HN       LYS  31  75.793  12.551  -6.279
  233    HA   LYS  31           HA       LYS  31  77.050  14.824  -7.465
  234    HB2  LYS  31           HB2      LYS  31  74.947  15.943  -6.810
  235    HB3  LYS  31           HB1      LYS  31  75.148  15.372  -5.158
  236    HG2  LYS  31           HG2      LYS  31  75.920  17.793  -5.696
  237    HG3  LYS  31           HG1      LYS  31  77.019  16.768  -4.772
  238    HD2  LYS  31           HD2      LYS  31  78.318  16.261  -6.742
  239    HD3  LYS  31           HD1      LYS  31  77.138  17.056  -7.786
  240    HE2  LYS  31           HE2      LYS  31  77.605  19.200  -6.538
  241    HE3  LYS  31           HE1      LYS  31  78.925  18.365  -5.719
  242    HZ1  LYS  31           HZ1      LYS  31  79.845  19.465  -7.580
  243    HZ2  LYS  31           HZ2      LYS  31  78.637  18.883  -8.623
  244    HZ3  LYS  31           HZ3      LYS  31  79.794  17.818  -7.981
  245    H    GLN  32           HN       GLN  32  77.965  12.418  -6.378
  246    HA   GLN  32           HA       GLN  32  78.714  12.316  -3.698
  247    HB2  GLN  32           HB2      GLN  32  80.734  11.680  -5.843
  248    HB3  GLN  32           HB1      GLN  32  80.429  10.833  -4.327
  249    HG2  GLN  32           HG2      GLN  32  78.681  10.865  -6.799
  250    HG3  GLN  32           HG1      GLN  32  79.491   9.475  -6.076
  251   HE21  GLN  32          HE21      GLN  32  78.084   8.203  -4.874
  252   HE22  GLN  32          HE22      GLN  32  76.730   8.774  -4.024
  253    H    ARG  33           HN       ARG  33  80.912  12.838  -2.750
  254    HA   ARG  33           HA       ARG  33  81.905  15.472  -3.779
  255    HE   ARG  33           HE       ARG  33  83.649  18.712  -0.676
  256    HB2  ARG  33           HB2      ARG  33  80.594  15.688  -1.678
  257    HB3  ARG  33           HB1      ARG  33  81.697  14.561  -0.893
  258    HG2  ARG  33           HG2      ARG  33  83.114  16.253  -0.443
  259    HG3  ARG  33           HG1      ARG  33  83.270  16.581  -2.170
  260    HD2  ARG  33           HD2      ARG  33  81.208  17.960  -2.077
  261    HD3  ARG  33           HD1      ARG  33  81.110  17.670  -0.340
  262   HH11  ARG  33          HH21      ARG  33  80.449  19.612  -1.593
  263   HH12  ARG  33          HH22      ARG  33  80.769  21.314  -1.538
  264   HH21  ARG  33          HH11      ARG  33  84.085  20.929  -0.599
  265   HH22  ARG  33          HH12      ARG  33  82.828  22.059  -0.975
  266    H    GLN  34           HN       GLN  34  83.218  13.746  -1.042
  267    HA   GLN  34           HA       GLN  34  85.174  12.119  -2.173
  268    HB2  GLN  34           HB2      GLN  34  85.728  14.962  -2.615
  269    HB3  GLN  34           HB1      GLN  34  87.023  14.188  -1.711
  270    HG2  GLN  34           HG2      GLN  34  85.888  12.846  -4.154
  271    HG3  GLN  34           HG1      GLN  34  87.096  14.121  -4.325
  272   HE21  GLN  34          HE21      GLN  34  88.012  11.734  -5.199
  273   HE22  GLN  34          HE22      GLN  34  89.040  10.993  -4.070
  274    H    THR  35           HN       THR  35  84.099  11.536   0.025
  275    HA   THR  35           HA       THR  35  85.664  12.675   2.298
  276    HB   THR  35           HB       THR  35  83.371  12.853   2.825
  277    HG1  THR  35           HG1      THR  35  83.414  11.716   4.593
  278   HG21  THR  35          HG21      THR  35  82.209  11.729   1.158
  279   HG22  THR  35          HG22      THR  35  81.941  10.652   2.529
  280   HG23  THR  35          HG23      THR  35  83.175  10.263   1.330
  281    H    ARG  36           HN       ARG  36  86.037  10.933   4.060
  282    HA   ARG  36           HA       ARG  36  86.633   8.262   2.907
  283    HE   ARG  36           HE       ARG  36  89.984   8.356   1.167
  284    HB2  ARG  36           HB2      ARG  36  88.727   9.678   4.553
  285    HB3  ARG  36           HB1      ARG  36  88.919   8.300   3.468
  286    HG2  ARG  36           HG2      ARG  36  88.268   9.859   1.565
  287    HG3  ARG  36           HG1      ARG  36  88.431  11.189   2.713
  288    HD2  ARG  36           HD2      ARG  36  90.560  11.090   1.718
  289    HD3  ARG  36           HD1      ARG  36  90.776  10.170   3.207
  290   HH11  ARG  36          HH21      ARG  36  92.564  10.462   2.055
  291   HH12  ARG  36          HH22      ARG  36  93.786   9.511   1.279
  292   HH21  ARG  36          HH11      ARG  36  91.564   7.101   0.148
  293   HH22  ARG  36          HH12      ARG  36  93.219   7.608   0.199
  294    H    GLN  37           HN       GLN  37  84.613   9.171   4.748
  295    HA   GLN  37           HA       GLN  37  85.461   8.607   7.467
  296    HB2  GLN  37           HB2      GLN  37  83.359   9.930   6.564
  297    HB3  GLN  37           HB1      GLN  37  82.601   8.338   6.582
  298    HG2  GLN  37           HG2      GLN  37  82.137   9.202   8.731
  299    HG3  GLN  37           HG1      GLN  37  83.526   8.147   8.995
  300   HE21  GLN  37          HE21      GLN  37  84.863   9.182  10.490
  301   HE22  GLN  37          HE22      GLN  37  85.302  10.821  10.427
  302    H1U  RCY  38           H1U      RCY  38  84.033   5.612  -0.540
  303    H1S  RCY  38           H1S      RCY  38  85.079   3.955   2.327
  304    HB1  RCY  38           HB1      RCY  38  84.755   3.109   4.603
  305    HB2  RCY  38           HB2      RCY  38  86.143   4.066   4.083
  306    HA   RCY  38           HA       RCY  38  84.564   4.256   6.639
  307    HN1  RCY  38           HN1      RCY  38  86.151   6.536   5.518
  308    H    LYS  39           HN       LYS  39  87.501   5.822   6.730
  309    HA   LYS  39           HA       LYS  39  89.613   5.230   7.538
  310    HB2  LYS  39           HB2      LYS  39  88.134   2.841   8.674
  311    HB3  LYS  39           HB1      LYS  39  89.667   3.497   9.242
  312    HG2  LYS  39           HG2      LYS  39  87.243   5.271   9.119
  313    HG3  LYS  39           HG1      LYS  39  87.454   4.170  10.481
  314    HD2  LYS  39           HD2      LYS  39  89.823   5.793   9.700
  315    HD3  LYS  39           HD1      LYS  39  88.489   6.657  10.465
  316    HE2  LYS  39           HE2      LYS  39  90.027   5.886  12.192
  317    HE3  LYS  39           HE1      LYS  39  88.520   4.978  12.316
  318    HZ1  LYS  39           HZ1      LYS  39  89.517   3.165  11.119
  319    HZ2  LYS  39           HZ2      LYS  39  90.499   3.559  12.448
  320    HZ3  LYS  39           HZ3      LYS  39  90.948   4.045  10.883
  321    H    SER  40           HN       SER  40  87.960   3.273   5.338
  322    HA   SER  40           HA       SER  40  88.650   1.517   3.925
  323    HG   SER  40           HG       SER  40  90.743   4.142   4.803
  324    HB2  SER  40           HB2      SER  40  91.034   1.919   3.072
  325    HB3  SER  40           HB1      SER  40  89.895   3.246   2.865
  326    H    LYS  41           HN       LYS  41  89.201   1.276   6.969
  327    HA   LYS  41           HA       LYS  41  91.596  -0.175   7.391
  328    HB2  LYS  41           HB2      LYS  41  90.309  -1.246   9.300
  329    HB3  LYS  41           HB1      LYS  41  90.286   0.515   9.291
  330    HG2  LYS  41           HG2      LYS  41  88.043   0.558   9.050
  331    HG3  LYS  41           HG1      LYS  41  88.114  -0.558   7.686
  332    HD2  LYS  41           HD2      LYS  41  86.836  -1.647   9.407
  333    HD3  LYS  41           HD1      LYS  41  88.415  -2.432   9.370
  334    HE2  LYS  41           HE2      LYS  41  89.066  -0.664  11.177
  335    HE3  LYS  41           HE1      LYS  41  87.325  -0.484  11.390
  336    HZ1  LYS  41           HZ1      LYS  41  87.097  -2.646  12.102
  337    HZ2  LYS  41           HZ2      LYS  41  88.597  -2.225  12.780
  338    HZ3  LYS  41           HZ3      LYS  41  88.534  -3.167  11.367
  339    HA   PRO  42           HA       PRO  42  91.024  -3.958   5.185
  340    HB2  PRO  42           HB2      PRO  42  92.057  -5.778   7.033
  341    HB3  PRO  42           HB1      PRO  42  93.023  -4.815   5.900
  342    HG2  PRO  42           HG2      PRO  42  92.479  -4.356   8.781
  343    HG3  PRO  42           HG1      PRO  42  93.947  -4.042   7.840
  344    HD2  PRO  42           HD2      PRO  42  92.248  -2.048   8.574
  345    HD3  PRO  42           HD1      PRO  42  93.169  -1.995   7.053
  346    HA   PRO  43           HA       PRO  43  87.295  -5.873   6.580
  347    HB2  PRO  43           HB2      PRO  43  87.521  -8.411   5.567
  348    HB3  PRO  43           HB1      PRO  43  87.187  -6.985   4.564
  349    HG2  PRO  43           HG2      PRO  43  89.751  -8.430   4.996
  350    HG3  PRO  43           HG1      PRO  43  89.092  -7.715   3.516
  351    HD2  PRO  43           HD2      PRO  43  91.030  -6.497   5.023
  352    HD3  PRO  43           HD1      PRO  43  89.858  -5.595   4.037
  353    H    LYS  44           HN       LYS  44  86.765  -6.562   8.598
  354    HA   LYS  44           HA       LYS  44  88.108  -8.936   9.738
  355    HB2  LYS  44           HB2      LYS  44  89.385  -6.807  10.412
  356    HB3  LYS  44           HB1      LYS  44  87.961  -6.384  11.359
  357    HG2  LYS  44           HG2      LYS  44  89.182  -7.551  12.951
  358    HG3  LYS  44           HG1      LYS  44  88.228  -8.864  12.261
  359    HD2  LYS  44           HD2      LYS  44  90.347  -9.795  12.138
  360    HD3  LYS  44           HD1      LYS  44  90.263  -9.003  10.564
  361    HE2  LYS  44           HE2      LYS  44  91.428  -7.037  11.475
  362    HE3  LYS  44           HE1      LYS  44  91.492  -7.801  13.063
  363    HZ1  LYS  44           HZ1      LYS  44  92.500  -9.596  11.162
  364    HZ2  LYS  44           HZ2      LYS  44  93.319  -8.857  12.454
  365    HZ3  LYS  44           HZ3      LYS  44  93.272  -8.103  10.932
  366    H    LYS  45           HN       LYS  45  86.658  -7.091  12.147
  367    HA   LYS  45           HA       LYS  45  83.879  -7.688  11.581
  368    HB2  LYS  45           HB2      LYS  45  83.566  -9.386  13.350
  369    HB3  LYS  45           HB1      LYS  45  84.655  -9.970  12.092
  370    HG2  LYS  45           HG2      LYS  45  86.456  -8.806  13.746
  371    HG3  LYS  45           HG1      LYS  45  85.234  -9.285  14.925
  372    HD2  LYS  45           HD2      LYS  45  85.278 -11.595  13.912
  373    HD3  LYS  45           HD1      LYS  45  86.655 -11.078  12.939
  374    HE2  LYS  45           HE2      LYS  45  87.609 -12.118  14.854
  375    HE3  LYS  45           HE1      LYS  45  87.757 -10.386  15.151
  376    HZ1  LYS  45           HZ1      LYS  45  85.625 -12.167  16.201
  377    HZ2  LYS  45           HZ2      LYS  45  85.706 -10.488  16.448
  378    HZ3  LYS  45           HZ3      LYS  45  86.904 -11.504  17.096
  379    H    GLY  46           HN       GLY  46  83.437  -5.591  12.266
  380    HA2  GLY  46           HA2      GLY  46  82.601  -4.802  14.649
  381    HA3  GLY  46           HA1      GLY  46  84.334  -4.788  14.988
  382    H    VAL  47           HN       VAL  47  81.973  -2.712  14.354
  383    HA   VAL  47           HA       VAL  47  83.819  -0.815  13.002
  384    HB   VAL  47           HB       VAL  47  81.832  -0.047  11.588
  385   HG11  VAL  47          HG11      VAL  47  83.750  -1.367  10.701
  386   HG12  VAL  47          HG12      VAL  47  82.239  -1.751   9.878
  387   HG13  VAL  47          HG13      VAL  47  82.884  -2.851  11.097
  388   HG21  VAL  47          HG21      VAL  47  80.805  -2.808  12.313
  389   HG22  VAL  47          HG22      VAL  47  80.034  -1.643  11.237
  390   HG23  VAL  47          HG23      VAL  47  80.145  -1.308  12.964
  391    H    GLN  48           HN       GLN  48  83.432  -0.623  15.631
  392    HA   GLN  48           HA       GLN  48  81.067   0.954  16.307
  393    HB2  GLN  48           HB2      GLN  48  82.499   1.323  18.469
  394    HB3  GLN  48           HB1      GLN  48  81.859  -0.286  18.133
  395    HG2  GLN  48           HG2      GLN  48  83.954  -1.062  17.308
  396    HG3  GLN  48           HG1      GLN  48  84.602   0.575  17.200
  397   HE21  GLN  48          HE21      GLN  48  85.316  -1.981  18.904
  398   HE22  GLN  48          HE22      GLN  48  85.504  -1.344  20.466
  399    H    GLY  49           HN       GLY  49  81.568   2.553  14.503
  400    HA2  GLY  49           HA2      GLY  49  82.871   4.894  15.677
  401    HA3  GLY  49           HA1      GLY  49  83.704   4.260  14.256
  402    H1U  RCY  50           H1U      RCY  50  79.545   3.798   5.079
  403    H1S  RCY  50           H1S      RCY  50  78.613   6.171   8.511
  404    HB1  RCY  50           HB1      RCY  50  79.089   3.726  11.894
  405    HB2  RCY  50           HB2      RCY  50  80.418   4.747  11.343
  406    HA   RCY  50           HA       RCY  50  79.725   6.472  13.015
  407    HN1  RCY  50           HN1      RCY  50  80.210   4.117  14.679
  408    H    GLY  51           HN       GLY  51  78.812   4.191  15.271
  409    HA2  GLY  51           HA2      GLY  51  76.054   3.839  15.015
  410    HA3  GLY  51           HA1      GLY  51  76.860   4.026  16.572
  411    H    ASP  52           HN       ASP  52  77.787   6.793  15.620
  412    HA   ASP  52           HA       ASP  52  75.349   8.344  15.306
  413    HB2  ASP  52           HB2      ASP  52  75.195   7.658  17.707
  414    HB3  ASP  52           HB1      ASP  52  76.737   8.463  18.000
  415    H    ASP  53           HN       ASP  53  77.909   8.214  13.996
  416    HA   ASP  53           HA       ASP  53  79.415  10.587  14.881
  417    HB2  ASP  53           HB2      ASP  53  79.740   8.752  12.485
  418    HB3  ASP  53           HB1      ASP  53  80.832  10.079  12.881
  419    H    ILE  54           HN       ILE  54  79.687  10.739  11.653
  420    HA   ILE  54           HA       ILE  54  77.221  12.314  11.158
  421    HB   ILE  54           HB       ILE  54  79.850  13.569  10.426
  422   HG12  ILE  54          HG12      ILE  54  78.524  13.686  13.153
  423   HG13  ILE  54          HG11      ILE  54  80.136  13.066  12.795
  424   HG21  ILE  54          HG21      ILE  54  77.472  14.347   9.743
  425   HG22  ILE  54          HG22      ILE  54  78.581  15.559  10.384
  426   HG23  ILE  54          HG23      ILE  54  77.322  14.882  11.417
  427   HD11  ILE  54          HD11      ILE  54  80.486  15.279  13.604
  428   HD12  ILE  54          HD12      ILE  54  79.162  15.923  12.633
  429   HD13  ILE  54          HD13      ILE  54  80.653  15.395  11.852
  430    HA   PRO  55           HA       PRO  55  78.672   9.966   7.464
  431    HB2  PRO  55           HB2      PRO  55  76.512   8.372   7.151
  432    HB3  PRO  55           HB1      PRO  55  77.788   8.004   8.328
  433    HG2  PRO  55           HG2      PRO  55  75.073   9.096   8.768
  434    HG3  PRO  55           HG1      PRO  55  76.054   8.048   9.803
  435    HD2  PRO  55           HD2      PRO  55  75.731  10.844  10.087
  436    HD3  PRO  55           HD1      PRO  55  76.929   9.833  10.922
  437    H    GLY  56           HN       GLY  56  75.133  10.489   7.681
  438    HA2  GLY  56           HA2      GLY  56  74.982  11.374   4.930
  439    HA3  GLY  56           HA1      GLY  56  73.669  11.440   6.105
  440    H    MET  57           HN       MET  57  76.811  13.063   5.488
  441    HA   MET  57           HA       MET  57  75.497  15.672   5.570
  442    HB2  MET  57           HB2      MET  57  75.986  14.844   8.023
  443    HB3  MET  57           HB1      MET  57  77.647  15.294   7.638
  444    HG2  MET  57           HG2      MET  57  76.631  17.234   8.618
  445    HG3  MET  57           HG1      MET  57  76.741  17.549   6.886
  446    HE1  MET  57           HE1      MET  57  73.357  18.924   8.754
  447    HE2  MET  57           HE2      MET  57  75.006  19.377   8.331
  448    HE3  MET  57           HE3      MET  57  74.719  18.279   9.679
  449    H    GLU  58           HN       GLU  58  78.301  13.653   5.170
  450    HA   GLU  58           HA       GLU  58  79.969  15.890   4.205
  451    HB2  GLU  58           HB2      GLU  58  81.669  14.119   3.825
  452    HB3  GLU  58           HB1      GLU  58  81.048  14.088   5.475
  453    HG2  GLU  58           HG2      GLU  58  79.361  12.346   4.650
  454    HG3  GLU  58           HG1      GLU  58  80.347  12.235   3.191
  455    H    GLY  59           HN       GLY  59  78.387  12.981   2.884
  456    HA2  GLY  59           HA2      GLY  59  77.342  13.725   0.564
  457    HA3  GLY  59           HA1      GLY  59  79.045  13.897   0.136
  458    H1U  RCY  60           H1U      RCY  60  72.687   5.056  -2.512
  459    H1S  RCY  60           H1S      RCY  60  75.953   7.643  -0.665
  460    HB1  RCY  60           HB1      RCY  60  78.306   9.846  -2.472
  461    HB2  RCY  60           HB2      RCY  60  77.356   9.998  -0.995
  462    HA   RCY  60           HA       RCY  60  79.583   9.459   0.232
  463    HN1  RCY  60           HN1      RCY  60  79.948  12.124  -0.775
  464    H    GLY  61           HN       GLY  61  81.898  10.724  -0.251
  465    HA2  GLY  61           HA2      GLY  61  83.065  10.737  -2.783
  466    HA3  GLY  61           HA1      GLY  61  83.960  10.325  -1.319
  467    H    THR  62           HN       THR  62  82.199   9.021  -4.059
  468    HA   THR  62           HA       THR  62  83.027   6.259  -3.262
  469    HB   THR  62           HB       THR  62  81.335   5.488  -4.875
  470    HG1  THR  62           HG1      THR  62  79.939   7.240  -5.689
  471   HG21  THR  62          HG21      THR  62  80.853   6.886  -2.452
  472   HG22  THR  62          HG22      THR  62  79.852   5.639  -3.195
  473   HG23  THR  62          HG23      THR  62  79.567   7.339  -3.571
  474    H    ASP  63           HN       ASP  63  85.224   6.441  -4.034
  475    HA   ASP  63           HA       ASP  63  86.066   7.414  -6.534
  476    HB2  ASP  63           HB2      ASP  63  87.686   6.606  -4.895
  477    HB3  ASP  63           HB1      ASP  63  87.044   4.967  -5.021
  478    H    ILE  64           HN       ILE  64  84.015   4.821  -5.771
  479    HA   ILE  64           HA       ILE  64  84.366   3.123  -8.064
  480    HB   ILE  64           HB       ILE  64  82.097   3.607  -6.145
  481   HG12  ILE  64          HG12      ILE  64  82.784   1.536  -5.181
  482   HG13  ILE  64          HG11      ILE  64  83.798   1.142  -6.569
  483   HG21  ILE  64          HG21      ILE  64  81.401   2.874  -8.521
  484   HG22  ILE  64          HG22      ILE  64  80.854   1.872  -7.176
  485   HG23  ILE  64          HG23      ILE  64  82.227   1.359  -8.156
  486   HD11  ILE  64          HD11      ILE  64  85.062   1.975  -4.535
  487   HD12  ILE  64          HD12      ILE  64  84.290   3.541  -4.788
  488   HD13  ILE  64          HD13      ILE  64  85.367   2.880  -6.018
  489    H    THR  65           HN       THR  65  81.369   4.867  -7.480
  490    HA   THR  65           HA       THR  65  80.984   6.902  -9.050
  491    HB   THR  65           HB       THR  65  81.532   4.691 -11.056
  492    HG1  THR  65           HG1      THR  65  83.374   5.655 -11.279
  493   HG21  THR  65          HG21      THR  65  80.951   6.348 -12.760
  494   HG22  THR  65          HG22      THR  65  80.594   7.538 -11.508
  495   HG23  THR  65          HG23      THR  65  79.583   6.102 -11.675
  496    H    VAL  66           HN       VAL  66  79.927   3.614 -10.078
  497    HA   VAL  66           HA       VAL  66  77.159   4.449  -9.294
  498    HB   VAL  66           HB       VAL  66  76.544   2.823 -11.293
  499   HG11  VAL  66          HG11      VAL  66  75.761   5.026 -11.437
  500   HG12  VAL  66          HG12      VAL  66  76.835   4.924 -12.833
  501   HG13  VAL  66          HG13      VAL  66  77.384   5.711 -11.353
  502   HG21  VAL  66          HG21      VAL  66  78.152   2.853 -13.091
  503   HG22  VAL  66          HG22      VAL  66  78.997   2.284 -11.651
  504   HG23  VAL  66          HG23      VAL  66  79.210   3.947 -12.199
  505    H    ILE  67           HN       ILE  67  79.235   1.579  -9.975
  506    HA   ILE  67           HA       ILE  67  77.580   0.163  -7.918
  507    HB   ILE  67           HB       ILE  67  78.689  -0.965 -10.497
  508   HG12  ILE  67          HG12      ILE  67  76.477   0.463 -10.335
  509   HG13  ILE  67          HG11      ILE  67  76.480  -1.043 -11.253
  510   HG21  ILE  67          HG21      ILE  67  78.903  -2.748  -8.996
  511   HG22  ILE  67          HG22      ILE  67  77.267  -2.983  -9.613
  512   HG23  ILE  67          HG23      ILE  67  77.516  -2.234  -8.036
  513   HD11  ILE  67          HD11      ILE  67  75.800  -1.063  -8.322
  514   HD12  ILE  67          HD12      ILE  67  75.346  -2.221  -9.573
  515   HD13  ILE  67          HD13      ILE  67  74.572  -0.637  -9.515
  516    H1U  RCY  68           H1U      RCY  68  75.649  -2.851  -4.550
  517    H1S  RCY  68           H1S      RCY  68  77.658   1.472  -4.243
  518    HB1  RCY  68           HB1      RCY  68  81.935   0.487  -4.254
  519    HB2  RCY  68           HB2      RCY  68  80.540  -0.512  -3.869
  520    HA   RCY  68           HA       RCY  68  81.894  -0.106  -6.475
  521    HN1  RCY  68           HN1      RCY  68  79.111   0.531  -6.296
  522    HA   PRO  69           HA       PRO  69  82.007  -4.517  -6.400
  523    HB2  PRO  69           HB2      PRO  69  83.785  -4.954  -4.263
  524    HB3  PRO  69           HB1      PRO  69  84.243  -4.681  -5.953
  525    HG2  PRO  69           HG2      PRO  69  84.207  -2.783  -3.679
  526    HG3  PRO  69           HG1      PRO  69  85.308  -2.875  -5.064
  527    HD2  PRO  69           HD2      PRO  69  83.367  -0.989  -4.912
  528    HD3  PRO  69           HD1      PRO  69  83.862  -1.699  -6.467
  529    H    TRP  70           HN       TRP  70  81.355  -2.792  -3.428
  530    HA   TRP  70           HA       TRP  70  80.305  -5.139  -2.027
  531    HD1  TRP  70           HD1      TRP  70  81.189  -5.669   0.007
  532    HE1  TRP  70           HE1      TRP  70  83.515  -5.539   1.107
  533    HE3  TRP  70           HE3      TRP  70  82.271  -0.746  -0.804
  534    HZ2  TRP  70           HZ2      TRP  70  85.569  -3.599   1.581
  535    HZ3  TRP  70           HZ3      TRP  70  84.413   0.216  -0.020
  536    HH2  TRP  70           HH2      TRP  70  86.062  -1.200   1.170
  537    HB2  TRP  70           HB2      TRP  70  80.351  -2.174  -1.449
  538    HB3  TRP  70           HB1      TRP  70  79.443  -3.295  -0.436
  539    H    GLU  71           HN       GLU  71  79.029  -4.950  -4.502
  540    HA   GLU  71           HA       GLU  71  76.246  -4.419  -3.622
  541    HB2  GLU  71           HB2      GLU  71  77.727  -2.760  -5.511
  542    HB3  GLU  71           HB1      GLU  71  76.288  -3.449  -6.256
  543    HG2  GLU  71           HG2      GLU  71  74.918  -2.620  -4.372
  544    HG3  GLU  71           HG1      GLU  71  76.360  -1.914  -3.640
  545    H    ALA  72           HN       ALA  72  78.395  -6.500  -4.941
  546    HA   ALA  72           HA       ALA  72  76.919  -7.546  -7.187
  547    HB1  ALA  72           HB1      ALA  72  78.908  -8.963  -5.392
  548    HB2  ALA  72           HB2      ALA  72  79.330  -8.006  -6.812
  549    HB3  ALA  72           HB3      ALA  72  78.396  -9.490  -6.994
  550    H1U  RCY  73           H1U      RCY  73  79.447  -6.979  -3.194
  551    H1S  RCY  73           H1S      RCY  73  75.387  -7.738  -3.941
  552    HB1  RCY  73           HB1      RCY  73  72.354  -8.467  -3.399
  553    HB2  RCY  73           HB2      RCY  73  72.110  -7.943  -5.065
  554    HA   RCY  73           HA       RCY  73  74.366  -9.511  -3.879
  555    HN1  RCY  73           HN1      RCY  73  74.827  -7.311  -5.751
  556    H    ASN  74           HN       ASN  74  73.087  -8.618  -7.095
  557    HA   ASN  74           HA       ASN  74  73.247 -11.054  -8.380
  558    HB2  ASN  74           HB2      ASN  74  72.025 -12.301  -6.808
  559    HB3  ASN  74           HB1      ASN  74  70.913 -10.974  -6.476
  560   HD21  ASN  74          HD21      ASN  74  71.810 -13.319  -9.046
  561   HD22  ASN  74          HD22      ASN  74  70.281 -13.331  -9.783
  562    H    HIS  75           HN       HIS  75  70.140  -9.404  -7.784
  563    HA   HIS  75           HA       HIS  75  69.882  -8.835 -10.647
  564    HD1  HIS  75           HD1      HIS  75  69.111 -10.585 -10.890
  565    HD2  HIS  75           HD2      HIS  75  65.942 -10.036  -8.233
  566    HE1  HIS  75           HE1      HIS  75  67.811 -12.759 -10.866
  567    HE2  HIS  75           HE2      HIS  75  65.880 -12.438  -9.253
  568    HB2  HIS  75           HB2      HIS  75  68.148  -8.146  -8.257
  569    HB3  HIS  75           HB1      HIS  75  67.728  -7.743  -9.922
  570    H1U  RCY  76           H1U      RCY  76  75.105  -1.285  -3.326
  571    H1S  RCY  76           H1S      RCY  76  72.332  -1.690  -6.214
  572    HB1  RCY  76           HB1      RCY  76  72.168  -5.309  -7.218
  573    HB2  RCY  76           HB2      RCY  76  70.652  -4.747  -7.923
  574    HA   RCY  76           HA       RCY  76  71.700  -4.841 -10.181
  575    HN1  RCY  76           HN1      RCY  76  72.107  -7.570  -9.240
  576    H    GLU  77           HN       GLU  77  73.544  -7.471  -9.738
  577    HA   GLU  77           HA       GLU  77  76.096  -6.329  -8.994
  578    HB2  GLU  77           HB2      GLU  77  75.665  -8.724  -8.731
  579    HB3  GLU  77           HB1      GLU  77  75.410  -8.889 -10.468
  580    HG2  GLU  77           HG2      GLU  77  77.703  -8.343 -10.941
  581    HG3  GLU  77           HG1      GLU  77  77.994  -7.862  -9.269
  582    H    LEU  78           HN       LEU  78  77.938  -6.090 -10.449
  583    HA   LEU  78           HA       LEU  78  77.218  -5.627 -13.309
  584    HG   LEU  78           HG       LEU  78  78.513  -2.255 -13.642
  585    HB2  LEU  78           HB2      LEU  78  77.369  -3.495 -11.817
  586    HB3  LEU  78           HB1      LEU  78  79.103  -3.795 -11.819
  587   HD11  LEU  78          HD11      LEU  78  79.061  -4.919 -14.942
  588   HD12  LEU  78          HD12      LEU  78  80.254  -4.175 -13.877
  589   HD13  LEU  78          HD13      LEU  78  79.734  -3.338 -15.340
  590   HD21  LEU  78          HD21      LEU  78  77.025  -4.366 -15.119
  591   HD22  LEU  78          HD22      LEU  78  76.791  -2.618 -15.117
  592   HD23  LEU  78          HD23      LEU  78  76.167  -3.593 -13.786
  593    H    HIS  79           HN       HIS  79  80.212  -5.147 -11.429
  594    HA   HIS  79           HA       HIS  79  81.597  -7.474 -11.770
  595    HD1  HIS  79           HD1      HIS  79  83.360  -6.137 -16.044
  596    HD2  HIS  79           HD2      HIS  79  84.222  -7.881 -12.354
  597    HE1  HIS  79           HE1      HIS  79  85.855  -6.570 -16.023
  598    HE2  HIS  79           HE2      HIS  79  86.393  -7.631 -13.782
  599    HB2  HIS  79           HB2      HIS  79  81.305  -7.761 -14.073
  600    HB3  HIS  79           HB1      HIS  79  81.393  -6.031 -14.402
  601    H    GLU  80           HN       GLU  80  82.660  -6.468 -10.003
  602    HA   GLU  80           HA       GLU  80  84.797  -4.559 -10.822
  603    HB2  GLU  80           HB2      GLU  80  82.909  -4.243  -8.473
  604    HB3  GLU  80           HB1      GLU  80  84.416  -3.343  -8.632
  605    HG2  GLU  80           HG2      GLU  80  82.250  -3.351 -10.748
  606    HG3  GLU  80           HG1      GLU  80  82.375  -2.121  -9.490
  607    H    LEU  81           HN       LEU  81  85.106  -4.543  -7.652
  608    HA   LEU  81           HA       LEU  81  86.871  -6.938  -7.647
  609    HG   LEU  81           HG       LEU  81  88.813  -3.926  -6.704
  610    HB2  LEU  81           HB2      LEU  81  86.667  -4.718  -5.588
  611    HB3  LEU  81           HB1      LEU  81  87.936  -5.932  -5.709
  612   HD11  LEU  81          HD11      LEU  81  89.416  -4.730  -8.837
  613   HD12  LEU  81          HD12      LEU  81  87.847  -5.495  -9.090
  614   HD13  LEU  81          HD13      LEU  81  88.997  -6.197  -7.952
  615   HD21  LEU  81          HD21      LEU  81  86.220  -3.253  -7.179
  616   HD22  LEU  81          HD22      LEU  81  86.726  -3.722  -8.802
  617   HD23  LEU  81          HD23      LEU  81  87.587  -2.444  -7.944
  618    H    ALA  82           HN       ALA  82  83.777  -6.611  -7.135
  619    HA   ALA  82           HA       ALA  82  83.196  -7.292  -4.463
  620    HB1  ALA  82           HB1      ALA  82  81.773  -8.481  -6.853
  621    HB2  ALA  82           HB2      ALA  82  81.553  -6.803  -6.358
  622    HB3  ALA  82           HB3      ALA  82  81.098  -8.112  -5.265
  623    H    GLN  83           HN       GLN  83  84.716  -8.769  -3.598
  624    HA   GLN  83           HA       GLN  83  85.569 -11.185  -4.833
  625    HB2  GLN  83           HB2      GLN  83  85.216 -10.538  -1.886
  626    HB3  GLN  83           HB1      GLN  83  86.083 -11.941  -2.504
  627    HG2  GLN  83           HG2      GLN  83  87.875 -10.512  -2.329
  628    HG3  GLN  83           HG1      GLN  83  87.322 -10.021  -3.931
  629   HE21  GLN  83          HE21      GLN  83  88.356  -8.666  -1.132
  630   HE22  GLN  83          HE22      GLN  83  87.437  -7.238  -1.126
  631    H    TYR  84           HN       TYR  84  82.971 -10.661  -2.441
  632    HA   TYR  84           HA       TYR  84  81.308 -12.703  -3.715
  633    HD1  TYR  84           HD1      TYR  84  81.481 -15.310  -3.836
  634    HD2  TYR  84           HD2      TYR  84  84.715 -13.741  -1.486
  635    HE1  TYR  84           HE1      TYR  84  83.067 -16.802  -5.023
  636    HE2  TYR  84           HE2      TYR  84  86.301 -15.234  -2.672
  637    HH   TYR  84           HH       TYR  84  85.802 -17.726  -4.043
  638    HB2  TYR  84           HB2      TYR  84  82.488 -13.152  -0.954
  639    HB3  TYR  84           HB1      TYR  84  81.135 -14.070  -1.613
  640    H    GLY  85           HN       GLY  85  81.864 -10.096  -1.582
  641    HA2  GLY  85           HA2      GLY  85  80.138  -8.497  -1.019
  642    HA3  GLY  85           HA1      GLY  85  78.932  -9.776  -1.205
  643    H    ILE  86           HN       ILE  86  81.575  -8.658   0.868
  644    HA   ILE  86           HA       ILE  86  81.459 -10.521   2.937
  645    HB   ILE  86           HB       ILE  86  82.926  -8.365   2.654
  646   HG12  ILE  86          HG12      ILE  86  83.035  -8.288   5.305
  647   HG13  ILE  86          HG11      ILE  86  81.964  -9.683   5.170
  648   HG21  ILE  86          HG21      ILE  86  82.182  -6.400   3.683
  649   HG22  ILE  86          HG22      ILE  86  80.962  -7.244   4.636
  650   HG23  ILE  86          HG23      ILE  86  80.708  -6.985   2.910
  651   HD11  ILE  86          HD11      ILE  86  83.598 -10.790   3.681
  652   HD12  ILE  86          HD12      ILE  86  84.319 -10.403   5.243
  653   HD13  ILE  86          HD13      ILE  86  84.674  -9.402   3.836
  654    H1U  RCY  87           H1U      RCY  87  78.050  -2.056   3.349
  655    H1S  RCY  87           H1S      RCY  87  77.490  -6.118   3.188
  656    HB1  RCY  87           HB1      RCY  87  75.582  -7.786   2.812
  657    HB2  RCY  87           HB2      RCY  87  76.055  -9.148   1.795
  658    HA   RCY  87           HA       RCY  87  77.473  -7.985   4.183
  659    HN1  RCY  87           HN1      RCY  87  78.885  -8.699   1.835
  Start of MODEL   77
    1    HA   MET   1           HA       MET   1  82.645 -16.650  21.550
    2    HB2  MET   1           HB2      MET   1  83.756 -14.697  22.690
    3    HB3  MET   1           HB1      MET   1  83.225 -13.679  21.353
    4    HG2  MET   1           HG2      MET   1  80.857 -14.612  21.855
    5    HG3  MET   1           HG1      MET   1  81.541 -15.115  23.400
    6    HE1  MET   1           HE1      MET   1  81.534 -13.399  25.513
    7    HE2  MET   1           HE2      MET   1  82.626 -12.054  25.189
    8    HE3  MET   1           HE3      MET   1  83.073 -13.684  24.689
    9    H    ASN   2           HN       ASN   2  82.035 -13.578  20.159
   10    HA   ASN   2           HA       ASN   2  80.617 -12.913  18.426
   11    HB2  ASN   2           HB2      ASN   2  81.200 -13.677  16.330
   12    HB3  ASN   2           HB1      ASN   2  82.578 -14.301  17.234
   13   HD21  ASN   2          HD21      ASN   2  82.948 -16.511  16.984
   14   HD22  ASN   2          HD22      ASN   2  81.786 -17.644  16.486
   15    H    LEU   3           HN       LEU   3  78.479 -13.274  17.695
   16    HA   LEU   3           HA       LEU   3  77.192 -15.756  18.779
   17    HG   LEU   3           HG       LEU   3  74.823 -15.627  18.794
   18    HB2  LEU   3           HB2      LEU   3  76.577 -13.503  19.828
   19    HB3  LEU   3           HB1      LEU   3  75.825 -13.103  18.285
   20   HD11  LEU   3          HD11      LEU   3  74.941 -14.075  21.399
   21   HD12  LEU   3          HD12      LEU   3  75.778 -15.591  21.067
   22   HD13  LEU   3          HD13      LEU   3  74.016 -15.552  21.129
   23   HD21  LEU   3          HD21      LEU   3  73.641 -12.945  19.588
   24   HD22  LEU   3          HD22      LEU   3  72.726 -14.428  19.312
   25   HD23  LEU   3          HD23      LEU   3  73.577 -13.654  17.975
   26    H    GLU   4           HN       GLU   4  75.589 -16.750  17.453
   27    HA   GLU   4           HA       GLU   4  76.051 -16.891  14.708
   28    HB2  GLU   4           HB2      GLU   4  74.590 -18.426  16.105
   29    HB3  GLU   4           HB1      GLU   4  73.316 -17.215  15.966
   30    HG2  GLU   4           HG2      GLU   4  74.716 -18.356  13.542
   31    HG3  GLU   4           HG1      GLU   4  73.276 -19.105  14.233
   32    HA   PRO   5           HA       PRO   5  74.938 -12.810  13.189
   33    HB2  PRO   5           HB2      PRO   5  73.971 -14.507  10.903
   34    HB3  PRO   5           HB1      PRO   5  74.929 -13.013  10.863
   35    HG2  PRO   5           HG2      PRO   5  76.052 -15.415  10.542
   36    HG3  PRO   5           HG1      PRO   5  76.885 -14.097  11.382
   37    HD2  PRO   5           HD2      PRO   5  75.745 -16.590  12.500
   38    HD3  PRO   5           HD1      PRO   5  76.986 -15.515  13.179
   39    HA   PRO   6           HA       PRO   6  70.604 -12.541  14.083
   40    HB2  PRO   6           HB2      PRO   6  69.870 -10.360  12.577
   41    HB3  PRO   6           HB1      PRO   6  70.787 -10.245  14.091
   42    HG2  PRO   6           HG2      PRO   6  71.757 -10.107  11.283
   43    HG3  PRO   6           HG1      PRO   6  72.271  -9.182  12.704
   44    HD2  PRO   6           HD2      PRO   6  73.703 -11.294  11.717
   45    HD3  PRO   6           HD1      PRO   6  73.706 -10.846  13.438
   46    H    LYS   7           HN       LYS   7  68.897 -13.693  13.323
   47    HA   LYS   7           HA       LYS   7  67.780 -13.492  10.711
   48    HB2  LYS   7           HB2      LYS   7  70.003 -14.729  10.240
   49    HB3  LYS   7           HB1      LYS   7  69.283 -16.089  11.093
   50    HG2  LYS   7           HG2      LYS   7  68.412 -16.656   9.074
   51    HG3  LYS   7           HG1      LYS   7  67.261 -15.353   9.369
   52    HD2  LYS   7           HD2      LYS   7  69.943 -14.917   8.035
   53    HD3  LYS   7           HD1      LYS   7  68.459 -15.231   7.135
   54    HE2  LYS   7           HE2      LYS   7  67.440 -13.270   8.442
   55    HE3  LYS   7           HE1      LYS   7  69.092 -12.875   8.917
   56    HZ1  LYS   7           HZ1      LYS   7  67.836 -12.159   6.581
   57    HZ2  LYS   7           HZ2      LYS   7  68.916 -13.390   6.128
   58    HZ3  LYS   7           HZ3      LYS   7  69.489 -12.007   6.932
   59    H    ALA   8           HN       ALA   8  65.932 -14.958  10.485
   60    HA   ALA   8           HA       ALA   8  65.346 -16.756  12.747
   61    HB1  ALA   8           HB1      ALA   8  64.596 -14.499  13.514
   62    HB2  ALA   8           HB2      ALA   8  63.260 -15.638  13.345
   63    HB3  ALA   8           HB3      ALA   8  63.533 -14.409  12.110
   64    H    GLU   9           HN       GLU   9  63.395 -15.072  10.270
   65    HA   GLU   9           HA       GLU   9  63.247 -17.075   8.334
   66    HB2  GLU   9           HB2      GLU   9  62.381 -18.737   9.739
   67    HB3  GLU   9           HB1      GLU   9  61.454 -17.583  10.697
   68    HG2  GLU   9           HG2      GLU   9  59.793 -17.353   9.025
   69    HG3  GLU   9           HG1      GLU   9  60.823 -18.069   7.785
   70    H1U  RCY  10           H1U      RCY  10  59.343  -9.501   4.281
   71    H1S  RCY  10           H1S      RCY  10  59.058 -12.320   7.284
   72    HB1  RCY  10           HB1      RCY  10  58.259 -14.714  10.003
   73    HB2  RCY  10           HB2      RCY  10  58.315 -15.396   8.378
   74    HA   RCY  10           HA       RCY  10  60.090 -13.807   7.759
   75    HN1  RCY  10           HN1      RCY  10  60.842 -15.259  10.267
   76    H    ARG  11           HN       ARG  11  58.945 -11.670   8.341
   77    HA   ARG  11           HA       ARG  11  59.537 -10.532  10.959
   78    HE   ARG  11           HE       ARG  11  63.630 -10.287  10.097
   79    HB2  ARG  11           HB2      ARG  11  61.690 -10.530   9.319
   80    HB3  ARG  11           HB1      ARG  11  60.921  -9.040   8.777
   81    HG2  ARG  11           HG2      ARG  11  62.214  -8.234  10.533
   82    HG3  ARG  11           HG1      ARG  11  60.705  -8.582  11.378
   83    HD2  ARG  11           HD2      ARG  11  62.635  -9.498  12.613
   84    HD3  ARG  11           HD1      ARG  11  61.580 -10.791  12.043
   85   HH11  ARG  11          HH21      ARG  11  63.035 -11.605  13.227
   86   HH12  ARG  11          HH22      ARG  11  64.335 -12.746  13.140
   87   HH21  ARG  11          HH11      ARG  11  65.331 -11.769   9.965
   88   HH22  ARG  11          HH12      ARG  11  65.635 -12.839  11.293
   89    H    SER  12           HN       SER  12  59.231  -7.930  10.616
   90    HA   SER  12           HA       SER  12  56.624  -7.702   9.203
   91    HG   SER  12           HG       SER  12  57.576  -7.916  11.857
   92    HB2  SER  12           HB2      SER  12  57.886  -5.642  11.020
   93    HB3  SER  12           HB1      SER  12  56.186  -5.820  10.593
   94    H    ALA  13           HN       ALA  13  56.517  -6.636   7.290
   95    HA   ALA  13           HA       ALA  13  58.722  -4.725   6.603
   96    HB1  ALA  13           HB1      ALA  13  58.498  -5.480   4.253
   97    HB2  ALA  13           HB2      ALA  13  57.304  -6.675   4.759
   98    HB3  ALA  13           HB3      ALA  13  58.973  -6.806   5.314
   99    H    THR  14           HN       THR  14  56.500  -3.724   7.814
  100    HA   THR  14           HA       THR  14  54.692  -2.789   5.634
  101    HB   THR  14           HB       THR  14  53.244  -1.999   7.475
  102    HG1  THR  14           HG1      THR  14  55.451  -2.883   8.985
  103   HG21  THR  14          HG21      THR  14  52.700  -4.230   8.425
  104   HG22  THR  14          HG22      THR  14  54.220  -4.853   7.783
  105   HG23  THR  14          HG23      THR  14  52.960  -4.296   6.682
  106    H    ARG  15           HN       ARG  15  56.375  -1.424   8.487
  107    HA   ARG  15           HA       ARG  15  56.871   0.874   8.888
  108    HE   ARG  15           HE       ARG  15  60.353  -1.893   4.300
  109    HB2  ARG  15           HB2      ARG  15  58.683   1.555   7.165
  110    HB3  ARG  15           HB1      ARG  15  58.981   0.129   8.156
  111    HG2  ARG  15           HG2      ARG  15  58.259  -1.339   6.358
  112    HG3  ARG  15           HG1      ARG  15  57.776   0.043   5.374
  113    HD2  ARG  15           HD2      ARG  15  59.892   0.406   4.669
  114    HD3  ARG  15           HD1      ARG  15  60.543   0.244   6.300
  115   HH11  ARG  15          HH21      ARG  15  60.632  -0.978   7.612
  116   HH12  ARG  15          HH22      ARG  15  61.355  -2.473   8.102
  117   HH21  ARG  15          HH11      ARG  15  61.296  -3.851   4.921
  118   HH22  ARG  15          HH12      ARG  15  61.731  -4.100   6.579
  119    H    VAL  16           HN       VAL  16  57.596   1.831   5.739
  120    HA   VAL  16           HA       VAL  16  54.944   2.706   4.933
  121    HB   VAL  16           HB       VAL  16  55.316   4.302   6.756
  122   HG11  VAL  16          HG11      VAL  16  57.781   5.212   5.254
  123   HG12  VAL  16          HG12      VAL  16  57.853   4.085   6.609
  124   HG13  VAL  16          HG13      VAL  16  57.242   5.722   6.854
  125   HG21  VAL  16          HG21      VAL  16  55.855   5.725   4.139
  126   HG22  VAL  16          HG22      VAL  16  54.925   6.312   5.518
  127   HG23  VAL  16          HG23      VAL  16  54.290   5.005   4.518
  128    H    MET  17           HN       MET  17  58.453   3.195   4.671
  129    HA   MET  17           HA       MET  17  59.812   3.430   2.778
  130    HB2  MET  17           HB2      MET  17  58.334   1.376   2.152
  131    HB3  MET  17           HB1      MET  17  57.491   2.502   1.090
  132    HG2  MET  17           HG2      MET  17  59.186   1.573  -0.278
  133    HG3  MET  17           HG1      MET  17  59.831   3.140   0.209
  134    HE1  MET  17           HE1      MET  17  62.226   3.281   0.700
  135    HE2  MET  17           HE2      MET  17  62.072   2.161  -0.651
  136    HE3  MET  17           HE3      MET  17  63.216   1.817   0.644
  137    H    GLY  18           HN       GLY  18  56.655   4.089   1.241
  138    HA2  GLY  18           HA2      GLY  18  56.389   6.795   1.369
  139    HA3  GLY  18           HA1      GLY  18  57.717   6.632   0.219
  140    H    GLY  19           HN       GLY  19  56.033   7.700  -1.220
  141    HA2  GLY  19           HA2      GLY  19  53.677   6.292  -2.042
  142    HA3  GLY  19           HA1      GLY  19  54.485   7.550  -2.979
  143    HA   PRO  20           HA       PRO  20  54.777   3.671  -5.515
  144    HB2  PRO  20           HB2      PRO  20  55.514   5.836  -7.448
  145    HB3  PRO  20           HB1      PRO  20  54.437   4.443  -7.672
  146    HG2  PRO  20           HG2      PRO  20  53.476   6.898  -7.314
  147    HG3  PRO  20           HG1      PRO  20  52.667   5.478  -6.630
  148    HD2  PRO  20           HD2      PRO  20  54.284   7.572  -5.245
  149    HD3  PRO  20           HD1      PRO  20  52.923   6.606  -4.631
  150    H1U  RCY  21           H1U      RCY  21  63.097  -1.020  -9.829
  151    H1S  RCY  21           H1S      RCY  21  58.707  -0.852  -7.945
  152    HB1  RCY  21           HB1      RCY  21  59.169   1.924  -5.537
  153    HB2  RCY  21           HB2      RCY  21  60.079   1.962  -7.046
  154    HA   RCY  21           HA       RCY  21  59.255   4.218  -5.966
  155    HN1  RCY  21           HN1      RCY  21  56.730   3.447  -7.381
  156    H    THR  22           HN       THR  22  59.746   5.924  -7.366
  157    HA   THR  22           HA       THR  22  60.577   5.106 -10.095
  158    HB   THR  22           HB       THR  22  58.311   6.068 -10.343
  159    HG1  THR  22           HG1      THR  22  60.606   7.183 -11.362
  160   HG21  THR  22          HG21      THR  22  59.294   8.751  -9.495
  161   HG22  THR  22          HG22      THR  22  58.873   7.605  -8.222
  162   HG23  THR  22          HG23      THR  22  57.667   8.074  -9.421
  163    HA   PRO  23           HA       PRO  23  64.140   7.221  -8.175
  164    HB2  PRO  23           HB2      PRO  23  65.017   6.980 -11.034
  165    HB3  PRO  23           HB1      PRO  23  65.918   6.628  -9.545
  166    HG2  PRO  23           HG2      PRO  23  64.884   4.678 -11.030
  167    HG3  PRO  23           HG1      PRO  23  64.898   4.580  -9.261
  168    HD2  PRO  23           HD2      PRO  23  62.600   5.079 -11.096
  169    HD3  PRO  23           HD1      PRO  23  62.618   4.323  -9.487
  170    H    ARG  24           HN       ARG  24  62.497   9.117  -8.153
  171    HA   ARG  24           HA       ARG  24  61.879  11.296  -8.785
  172    HE   ARG  24           HE       ARG  24  61.523  13.642  -9.346
  173    HB2  ARG  24           HB2      ARG  24  64.829  11.052  -8.960
  174    HB3  ARG  24           HB1      ARG  24  64.151  12.445  -9.800
  175    HG2  ARG  24           HG2      ARG  24  63.182  11.841  -7.029
  176    HG3  ARG  24           HG1      ARG  24  64.765  12.595  -7.222
  177    HD2  ARG  24           HD2      ARG  24  63.115  14.356  -6.995
  178    HD3  ARG  24           HD1      ARG  24  63.682  14.345  -8.665
  179   HH11  ARG  24          HH21      ARG  24  62.002  13.376  -5.942
  180   HH12  ARG  24          HH22      ARG  24  60.340  13.028  -5.601
  181   HH21  ARG  24          HH11      ARG  24  59.350  13.188  -8.921
  182   HH22  ARG  24          HH12      ARG  24  58.839  12.921  -7.287
  183    H    LYS  25           HN       LYS  25  64.329  11.211 -11.301
  184    HA   LYS  25           HA       LYS  25  62.181  11.597 -13.307
  185    HB2  LYS  25           HB2      LYS  25  64.574  12.868 -12.983
  186    HB3  LYS  25           HB1      LYS  25  65.028  11.639 -14.162
  187    HG2  LYS  25           HG2      LYS  25  64.283  13.391 -15.530
  188    HG3  LYS  25           HG1      LYS  25  62.845  12.378 -15.400
  189    HD2  LYS  25           HD2      LYS  25  61.920  14.430 -14.870
  190    HD3  LYS  25           HD1      LYS  25  62.402  13.897 -13.259
  191    HE2  LYS  25           HE2      LYS  25  63.294  16.065 -13.362
  192    HE3  LYS  25           HE1      LYS  25  64.671  15.062 -13.819
  193    HZ1  LYS  25           HZ1      LYS  25  64.538  16.789 -15.397
  194    HZ2  LYS  25           HZ2      LYS  25  62.864  16.585 -15.605
  195    HZ3  LYS  25           HZ3      LYS  25  63.944  15.405 -16.177
  196    H    GLY  26           HN       GLY  26  64.846   9.388 -12.543
  197    HA2  GLY  26           HA2      GLY  26  63.741   7.032 -13.419
  198    HA3  GLY  26           HA1      GLY  26  64.365   7.740 -14.910
  199    HA   PRO  27           HA       PRO  27  67.627   5.012 -12.826
  200    HB2  PRO  27           HB2      PRO  27  68.233   4.885 -15.759
  201    HB3  PRO  27           HB1      PRO  27  68.305   3.599 -14.537
  202    HG2  PRO  27           HG2      PRO  27  66.287   3.768 -16.267
  203    HG3  PRO  27           HG1      PRO  27  66.040   3.230 -14.598
  204    HD2  PRO  27           HD2      PRO  27  65.266   5.804 -15.872
  205    HD3  PRO  27           HD1      PRO  27  64.543   4.971 -14.478
  206    HA   PRO  28           HA       PRO  28  70.243   8.712 -12.658
  207    HB2  PRO  28           HB2      PRO  28  72.224   6.548 -12.006
  208    HB3  PRO  28           HB1      PRO  28  71.976   8.120 -11.217
  209    HG2  PRO  28           HG2      PRO  28  71.038   5.869 -10.150
  210    HG3  PRO  28           HG1      PRO  28  70.129   7.386 -10.051
  211    HD2  PRO  28           HD2      PRO  28  69.563   4.969 -11.686
  212    HD3  PRO  28           HD1      PRO  28  68.447   6.222 -11.101
  213    H    LYS  29           HN       LYS  29  71.712   9.661 -14.097
  214    HA   LYS  29           HA       LYS  29  72.120   8.349 -16.638
  215    HB2  LYS  29           HB2      LYS  29  71.994  10.923 -15.977
  216    HB3  LYS  29           HB1      LYS  29  73.742  10.741 -15.833
  217    HG2  LYS  29           HG2      LYS  29  73.625   9.621 -18.159
  218    HG3  LYS  29           HG1      LYS  29  72.011  10.323 -18.269
  219    HD2  LYS  29           HD2      LYS  29  73.219  12.537 -17.549
  220    HD3  LYS  29           HD1      LYS  29  74.671  11.715 -18.122
  221    HE2  LYS  29           HE2      LYS  29  73.920  12.814 -20.053
  222    HE3  LYS  29           HE1      LYS  29  73.240  11.198 -20.246
  223    HZ1  LYS  29           HZ1      LYS  29  71.904  13.701 -19.873
  224    HZ2  LYS  29           HZ2      LYS  29  71.381  12.525 -18.765
  225    HZ3  LYS  29           HZ3      LYS  29  71.291  12.223 -20.435
  226    H1U  RCY  30           H1U      RCY  30  73.597   4.943  -9.344
  227    H1S  RCY  30           H1S      RCY  30  72.799   5.750 -13.677
  228    HB1  RCY  30           HB1      RCY  30  76.162   4.881 -14.542
  229    HB2  RCY  30           HB2      RCY  30  76.146   5.842 -16.020
  230    HA   RCY  30           HA       RCY  30  75.582   6.665 -13.214
  231    HN1  RCY  30           HN1      RCY  30  73.490   7.528 -13.872
  232    H    LYS  31           HN       LYS  31  76.677   8.667 -12.817
  233    HA   LYS  31           HA       LYS  31  78.139   9.923 -15.047
  234    HB2  LYS  31           HB2      LYS  31  78.941  10.970 -12.481
  235    HB3  LYS  31           HB1      LYS  31  78.041  11.772 -13.760
  236    HG2  LYS  31           HG2      LYS  31  76.355  11.810 -12.217
  237    HG3  LYS  31           HG1      LYS  31  76.105  10.141 -12.730
  238    HD2  LYS  31           HD2      LYS  31  78.072  10.805 -10.544
  239    HD3  LYS  31           HD1      LYS  31  76.356  10.604 -10.187
  240    HE2  LYS  31           HE2      LYS  31  76.392   8.355 -11.166
  241    HE3  LYS  31           HE1      LYS  31  78.091   8.552 -11.593
  242    HZ1  LYS  31           HZ1      LYS  31  77.374   9.026  -8.810
  243    HZ2  LYS  31           HZ2      LYS  31  78.756   8.289  -9.468
  244    HZ3  LYS  31           HZ3      LYS  31  77.303   7.417  -9.344
  245    H    GLN  32           HN       GLN  32  78.751   7.142 -14.008
  246    HA   GLN  32           HA       GLN  32  81.670   7.499 -13.947
  247    HB2  GLN  32           HB2      GLN  32  80.140   6.275 -11.634
  248    HB3  GLN  32           HB1      GLN  32  81.871   6.048 -11.883
  249    HG2  GLN  32           HG2      GLN  32  82.034   8.609 -11.963
  250    HG3  GLN  32           HG1      GLN  32  80.394   8.622 -11.313
  251   HE21  GLN  32          HE21      GLN  32  80.078   7.866  -9.109
  252   HE22  GLN  32          HE22      GLN  32  81.386   7.610  -8.057
  253    H    ARG  33           HN       ARG  33  82.410   5.995 -15.344
  254    HA   ARG  33           HA       ARG  33  81.163   3.285 -15.336
  255    HE   ARG  33           HE       ARG  33  80.865   2.071 -16.625
  256    HB2  ARG  33           HB2      ARG  33  81.597   5.102 -17.710
  257    HB3  ARG  33           HB1      ARG  33  81.473   3.354 -17.897
  258    HG2  ARG  33           HG2      ARG  33  79.371   4.673 -16.250
  259    HG3  ARG  33           HG1      ARG  33  79.315   4.967 -17.988
  260    HD2  ARG  33           HD2      ARG  33  78.069   2.878 -16.994
  261    HD3  ARG  33           HD1      ARG  33  78.981   2.712 -18.495
  262   HH11  ARG  33          HH21      ARG  33  77.577   1.159 -17.120
  263   HH12  ARG  33          HH22      ARG  33  77.773  -0.420 -16.436
  264   HH21  ARG  33          HH11      ARG  33  81.140   0.015 -15.728
  265   HH22  ARG  33          HH12      ARG  33  79.790  -1.068 -15.647
  266    H    GLN  34           HN       GLN  34  83.058   2.541 -14.244
  267    HA   GLN  34           HA       GLN  34  85.259   1.856 -16.006
  268    HB2  GLN  34           HB2      GLN  34  85.693   4.293 -15.255
  269    HB3  GLN  34           HB1      GLN  34  86.009   3.608 -13.662
  270    HG2  GLN  34           HG2      GLN  34  88.144   3.633 -14.642
  271    HG3  GLN  34           HG1      GLN  34  87.601   1.982 -14.939
  272   HE21  GLN  34          HE21      GLN  34  89.519   3.583 -16.583
  273   HE22  GLN  34          HE22      GLN  34  88.840   3.663 -18.137
  274    H    THR  35           HN       THR  35  86.681   0.298 -15.001
  275    HA   THR  35           HA       THR  35  85.452  -0.996 -12.627
  276    HB   THR  35           HB       THR  35  86.585  -2.978 -13.290
  277    HG1  THR  35           HG1      THR  35  88.119  -1.300 -14.985
  278   HG21  THR  35          HG21      THR  35  84.736  -2.144 -14.829
  279   HG22  THR  35          HG22      THR  35  85.853  -3.305 -15.544
  280   HG23  THR  35          HG23      THR  35  86.011  -1.588 -15.914
  281    H    ARG  36           HN       ARG  36  87.326  -2.162 -11.257
  282    HA   ARG  36           HA       ARG  36  88.892  -1.692  -9.557
  283    HE   ARG  36           HE       ARG  36  90.794  -4.523 -13.384
  284    HB2  ARG  36           HB2      ARG  36  90.381  -0.425 -11.875
  285    HB3  ARG  36           HB1      ARG  36  91.083  -1.110 -10.409
  286    HG2  ARG  36           HG2      ARG  36  90.253  -3.336 -11.025
  287    HG3  ARG  36           HG1      ARG  36  89.496  -2.667 -12.471
  288    HD2  ARG  36           HD2      ARG  36  91.753  -1.903 -13.238
  289    HD3  ARG  36           HD1      ARG  36  92.462  -2.727 -11.850
  290   HH11  ARG  36          HH21      ARG  36  93.836  -2.906 -13.246
  291   HH12  ARG  36          HH22      ARG  36  94.666  -4.105 -14.180
  292   HH21  ARG  36          HH11      ARG  36  91.861  -6.099 -14.603
  293   HH22  ARG  36          HH12      ARG  36  93.548  -5.913 -14.948
  294    H    GLN  37           HN       GLN  37  86.827   0.340  -9.920
  295    HA   GLN  37           HA       GLN  37  88.181   2.935  -9.692
  296    HB2  GLN  37           HB2      GLN  37  85.905   3.820  -9.335
  297    HB3  GLN  37           HB1      GLN  37  85.958   2.772 -10.753
  298    HG2  GLN  37           HG2      GLN  37  85.275   0.877  -9.114
  299    HG3  GLN  37           HG1      GLN  37  84.809   2.187  -8.028
  300   HE21  GLN  37          HE21      GLN  37  83.705   4.068  -9.755
  301   HE22  GLN  37          HE22      GLN  37  82.364   3.410 -10.561
  302    H1U  RCY  38           H1U      RCY  38  82.476   3.374  -1.317
  303    H1S  RCY  38           H1S      RCY  38  86.731   5.203  -2.327
  304    HB1  RCY  38           HB1      RCY  38  87.009   3.040  -4.284
  305    HB2  RCY  38           HB2      RCY  38  86.466   3.665  -5.840
  306    HA   RCY  38           HA       RCY  38  89.343   3.994  -5.509
  307    HN1  RCY  38           HN1      RCY  38  88.955   3.735  -7.806
  308    H    LYS  39           HN       LYS  39  90.630   2.655  -4.350
  309    HA   LYS  39           HA       LYS  39  89.753   0.109  -3.341
  310    HB2  LYS  39           HB2      LYS  39  90.198  -0.359  -5.832
  311    HB3  LYS  39           HB1      LYS  39  91.899  -0.095  -5.465
  312    HG2  LYS  39           HG2      LYS  39  92.093  -2.145  -4.536
  313    HG3  LYS  39           HG1      LYS  39  90.682  -1.873  -3.513
  314    HD2  LYS  39           HD2      LYS  39  90.359  -2.495  -6.444
  315    HD3  LYS  39           HD1      LYS  39  90.569  -3.790  -5.264
  316    HE2  LYS  39           HE2      LYS  39  88.637  -2.909  -3.979
  317    HE3  LYS  39           HE1      LYS  39  88.408  -1.662  -5.205
  318    HZ1  LYS  39           HZ1      LYS  39  88.479  -4.520  -5.937
  319    HZ2  LYS  39           HZ2      LYS  39  87.803  -3.217  -6.793
  320    HZ3  LYS  39           HZ3      LYS  39  87.045  -3.798  -5.388
  321    H    SER  40           HN       SER  40  92.273  -1.131  -3.052
  322    HA   SER  40           HA       SER  40  94.340  -0.949  -1.939
  323    HG   SER  40           HG       SER  40  96.071   1.151  -1.129
  324    HB2  SER  40           HB2      SER  40  94.307   1.370  -3.293
  325    HB3  SER  40           HB1      SER  40  94.152   2.016  -1.662
  326    H    LYS  41           HN       LYS  41  91.724   1.199  -0.816
  327    HA   LYS  41           HA       LYS  41  92.499   1.513   1.846
  328    HB2  LYS  41           HB2      LYS  41  90.378   2.301   2.201
  329    HB3  LYS  41           HB1      LYS  41  90.289   2.206   0.447
  330    HG2  LYS  41           HG2      LYS  41  89.475  -0.058   2.295
  331    HG3  LYS  41           HG1      LYS  41  88.340   1.112   1.621
  332    HD2  LYS  41           HD2      LYS  41  90.158  -0.178  -0.334
  333    HD3  LYS  41           HD1      LYS  41  88.955  -1.237   0.404
  334    HE2  LYS  41           HE2      LYS  41  87.193   0.449  -0.196
  335    HE3  LYS  41           HE1      LYS  41  88.426   1.358  -1.071
  336    HZ1  LYS  41           HZ1      LYS  41  87.738   0.070  -2.765
  337    HZ2  LYS  41           HZ2      LYS  41  87.138  -1.155  -1.752
  338    HZ3  LYS  41           HZ3      LYS  41  88.802  -1.063  -2.085
  339    HA   PRO  42           HA       PRO  42  92.485  -2.735   3.225
  340    HB2  PRO  42           HB2      PRO  42  92.947  -2.322   5.871
  341    HB3  PRO  42           HB1      PRO  42  94.202  -2.087   4.639
  342    HG2  PRO  42           HG2      PRO  42  92.519  -0.057   6.021
  343    HG3  PRO  42           HG1      PRO  42  94.237   0.002   5.594
  344    HD2  PRO  42           HD2      PRO  42  92.261   1.246   4.127
  345    HD3  PRO  42           HD1      PRO  42  93.812   0.715   3.440
  346    HA   PRO  43           HA       PRO  43  88.354  -3.243   4.884
  347    HB2  PRO  43           HB2      PRO  43  88.345  -5.889   5.349
  348    HB3  PRO  43           HB1      PRO  43  88.482  -5.249   3.698
  349    HG2  PRO  43           HG2      PRO  43  90.610  -6.335   5.473
  350    HG3  PRO  43           HG1      PRO  43  90.376  -6.545   3.730
  351    HD2  PRO  43           HD2      PRO  43  92.145  -4.724   4.884
  352    HD3  PRO  43           HD1      PRO  43  91.515  -4.616   3.225
  353    H    LYS  44           HN       LYS  44  87.230  -3.551   6.887
  354    HA   LYS  44           HA       LYS  44  87.028  -3.460   9.224
  355    HB2  LYS  44           HB2      LYS  44  87.962  -5.890   8.601
  356    HB3  LYS  44           HB1      LYS  44  89.357  -5.315   9.508
  357    HG2  LYS  44           HG2      LYS  44  88.072  -6.236  11.219
  358    HG3  LYS  44           HG1      LYS  44  87.527  -4.559  11.258
  359    HD2  LYS  44           HD2      LYS  44  85.519  -5.805  11.252
  360    HD3  LYS  44           HD1      LYS  44  85.718  -5.315   9.569
  361    HE2  LYS  44           HE2      LYS  44  86.365  -7.452   8.884
  362    HE3  LYS  44           HE1      LYS  44  86.888  -7.921  10.501
  363    HZ1  LYS  44           HZ1      LYS  44  84.448  -8.439   9.326
  364    HZ2  LYS  44           HZ2      LYS  44  84.137  -7.245  10.494
  365    HZ3  LYS  44           HZ3      LYS  44  84.880  -8.705  10.945
  366    H    LYS  45           HN       LYS  45  88.454  -1.311   8.320
  367    HA   LYS  45           HA       LYS  45  90.042  -0.615  10.619
  368    HB2  LYS  45           HB2      LYS  45  91.560  -2.132   9.098
  369    HB3  LYS  45           HB1      LYS  45  91.689  -0.683   8.102
  370    HG2  LYS  45           HG2      LYS  45  93.473  -0.338   9.542
  371    HG3  LYS  45           HG1      LYS  45  92.190   0.470  10.445
  372    HD2  LYS  45           HD2      LYS  45  91.799  -1.620  11.725
  373    HD3  LYS  45           HD1      LYS  45  93.129  -2.385  10.855
  374    HE2  LYS  45           HE2      LYS  45  94.584  -0.442  11.684
  375    HE3  LYS  45           HE1      LYS  45  93.261  -0.064  12.786
  376    HZ1  LYS  45           HZ1      LYS  45  93.773  -2.819  12.899
  377    HZ2  LYS  45           HZ2      LYS  45  93.952  -1.660  14.128
  378    HZ3  LYS  45           HZ3      LYS  45  95.248  -2.001  13.083
  379    H    GLY  46           HN       GLY  46  88.577   0.060   7.604
  380    HA2  GLY  46           HA2      GLY  46  89.443   2.896   7.622
  381    HA3  GLY  46           HA1      GLY  46  88.494   2.118   6.354
  382    H    VAL  47           HN       VAL  47  86.578   3.201   6.291
  383    HA   VAL  47           HA       VAL  47  84.581   4.192   7.023
  384    HB   VAL  47           HB       VAL  47  84.953   2.000   9.080
  385   HG11  VAL  47          HG11      VAL  47  82.419   2.337   9.347
  386   HG12  VAL  47          HG12      VAL  47  82.662   3.905   8.577
  387   HG13  VAL  47          HG13      VAL  47  83.460   3.540  10.107
  388   HG21  VAL  47          HG21      VAL  47  83.169   0.920   7.672
  389   HG22  VAL  47          HG22      VAL  47  84.687   1.173   6.811
  390   HG23  VAL  47          HG23      VAL  47  83.324   2.257   6.534
  391    H    GLN  48           HN       GLN  48  85.332   6.248   7.609
  392    HA   GLN  48           HA       GLN  48  85.026   7.022  10.337
  393    HB2  GLN  48           HB2      GLN  48  87.452   7.739  10.703
  394    HB3  GLN  48           HB1      GLN  48  87.135   6.009  10.830
  395    HG2  GLN  48           HG2      GLN  48  88.033   5.577   8.669
  396    HG3  GLN  48           HG1      GLN  48  88.010   7.287   8.235
  397   HE21  GLN  48          HE21      GLN  48  90.416   5.671   8.130
  398   HE22  GLN  48          HE22      GLN  48  91.497   6.283   9.287
  399    H    GLY  49           HN       GLY  49  85.450   7.626   7.083
  400    HA2  GLY  49           HA2      GLY  49  84.583  10.302   7.169
  401    HA3  GLY  49           HA1      GLY  49  86.345  10.358   7.109
  402    H1U  RCY  50           H1U      RCY  50  86.092   4.900   1.108
  403    H1S  RCY  50           H1S      RCY  50  81.806   5.866   3.000
  404    HB1  RCY  50           HB1      RCY  50  82.631   9.338   1.799
  405    HB2  RCY  50           HB2      RCY  50  82.270  10.347   3.199
  406    HA   RCY  50           HA       RCY  50  84.571   8.376   3.057
  407    HN1  RCY  50           HN1      RCY  50  83.464   9.771   5.290
  408    H    GLY  51           HN       GLY  51  83.597  10.561   1.120
  409    HA2  GLY  51           HA2      GLY  51  85.630  12.651   1.375
  410    HA3  GLY  51           HA1      GLY  51  85.955  11.491   0.086
  411    H    ASP  52           HN       ASP  52  82.799  12.717   1.171
  412    HA   ASP  52           HA       ASP  52  81.098  13.779  -0.048
  413    HB2  ASP  52           HB2      ASP  52  82.955  15.546  -0.039
  414    HB3  ASP  52           HB1      ASP  52  83.334  15.004  -1.674
  415    H    ASP  53           HN       ASP  53  82.011  14.534  -2.995
  416    HA   ASP  53           HA       ASP  53  81.707  13.580  -5.112
  417    HB2  ASP  53           HB2      ASP  53  82.387  10.921  -3.842
  418    HB3  ASP  53           HB1      ASP  53  82.649  11.430  -5.509
  419    H    ILE  54           HN       ILE  54  79.416  13.884  -3.475
  420    HA   ILE  54           HA       ILE  54  77.783  11.525  -4.352
  421    HB   ILE  54           HB       ILE  54  77.301  13.249  -1.900
  422   HG12  ILE  54          HG12      ILE  54  77.941  10.372  -1.620
  423   HG13  ILE  54          HG11      ILE  54  79.283  11.386  -2.150
  424   HG21  ILE  54          HG21      ILE  54  75.981  10.741  -2.978
  425   HG22  ILE  54          HG22      ILE  54  75.244  12.335  -2.808
  426   HG23  ILE  54          HG23      ILE  54  75.676  11.405  -1.373
  427   HD11  ILE  54          HD11      ILE  54  77.559  11.888   0.295
  428   HD12  ILE  54          HD12      ILE  54  78.904  12.897  -0.237
  429   HD13  ILE  54          HD13      ILE  54  79.203  11.249   0.314
  430    HA   PRO  55           HA       PRO  55  76.048  15.393  -6.191
  431    HB2  PRO  55           HB2      PRO  55  76.117  14.651  -8.789
  432    HB3  PRO  55           HB1      PRO  55  77.557  15.269  -7.955
  433    HG2  PRO  55           HG2      PRO  55  76.841  12.479  -8.667
  434    HG3  PRO  55           HG1      PRO  55  78.426  13.268  -8.632
  435    HD2  PRO  55           HD2      PRO  55  77.400  11.592  -6.628
  436    HD3  PRO  55           HD1      PRO  55  78.772  12.705  -6.442
  437    H    GLY  56           HN       GLY  56  75.059  12.227  -5.815
  438    HA2  GLY  56           HA2      GLY  56  72.878  11.796  -7.484
  439    HA3  GLY  56           HA1      GLY  56  72.892  11.306  -5.790
  440    H    MET  57           HN       MET  57  71.981  12.742  -4.218
  441    HA   MET  57           HA       MET  57  70.281  14.166  -3.480
  442    HB2  MET  57           HB2      MET  57  70.907  16.331  -3.759
  443    HB3  MET  57           HB1      MET  57  72.250  15.667  -4.679
  444    HG2  MET  57           HG2      MET  57  71.412  17.105  -6.283
  445    HG3  MET  57           HG1      MET  57  70.411  15.697  -6.638
  446    HE1  MET  57           HE1      MET  57  69.496  17.867  -7.820
  447    HE2  MET  57           HE2      MET  57  68.002  18.582  -7.220
  448    HE3  MET  57           HE3      MET  57  68.072  16.853  -7.553
  449    H    GLU  58           HN       GLU  58  70.064  12.605  -6.332
  450    HA   GLU  58           HA       GLU  58  67.591  13.956  -7.265
  451    HB2  GLU  58           HB2      GLU  58  69.158  11.609  -8.382
  452    HB3  GLU  58           HB1      GLU  58  67.689  12.261  -9.107
  453    HG2  GLU  58           HG2      GLU  58  69.054  14.552  -8.901
  454    HG3  GLU  58           HG1      GLU  58  70.427  13.448  -8.980
  455    H    GLY  59           HN       GLY  59  67.172  10.858  -8.133
  456    HA2  GLY  59           HA2      GLY  59  64.919  10.379  -6.508
  457    HA3  GLY  59           HA1      GLY  59  65.795   9.118  -7.374
  458    H1U  RCY  60           H1U      RCY  60  71.644   2.470  -4.885
  459    H1S  RCY  60           H1S      RCY  60  69.414   6.225  -5.679
  460    HB1  RCY  60           HB1      RCY  60  68.299   7.274  -4.095
  461    HB2  RCY  60           HB2      RCY  60  69.562   7.878  -3.023
  462    HA   RCY  60           HA       RCY  60  67.336   9.136  -2.950
  463    HN1  RCY  60           HN1      RCY  60  68.055  10.532  -5.444
  464    H    GLY  61           HN       GLY  61  70.644   9.285  -3.129
  465    HA2  GLY  61           HA2      GLY  61  72.232  10.815  -2.323
  466    HA3  GLY  61           HA1      GLY  61  71.131  12.102  -2.820
  467    H    THR  62           HN       THR  62  69.149  12.342  -1.324
  468    HA   THR  62           HA       THR  62  69.985  12.980   1.294
  469    HB   THR  62           HB       THR  62  67.971  13.998   0.657
  470    HG1  THR  62           HG1      THR  62  66.879  13.533   2.381
  471   HG21  THR  62          HG21      THR  62  67.289  12.765  -1.224
  472   HG22  THR  62          HG22      THR  62  65.993  12.472  -0.065
  473   HG23  THR  62          HG23      THR  62  67.236  11.248  -0.325
  474    H    ASP  63           HN       ASP  63  68.542   9.997   0.029
  475    HA   ASP  63           HA       ASP  63  68.281   8.723   2.610
  476    HB2  ASP  63           HB2      ASP  63  68.434   7.599  -0.202
  477    HB3  ASP  63           HB1      ASP  63  68.108   6.618   1.228
  478    H    ILE  64           HN       ILE  64  70.894   9.944   2.208
  479    HA   ILE  64           HA       ILE  64  72.562   7.527   2.683
  480    HB   ILE  64           HB       ILE  64  73.499   9.806   0.928
  481   HG12  ILE  64          HG12      ILE  64  72.361   7.103   0.148
  482   HG13  ILE  64          HG11      ILE  64  71.656   8.678  -0.216
  483   HG21  ILE  64          HG21      ILE  64  74.562   6.986   1.220
  484   HG22  ILE  64          HG22      ILE  64  75.153   8.337   2.189
  485   HG23  ILE  64          HG23      ILE  64  75.346   8.357   0.436
  486   HD11  ILE  64          HD11      ILE  64  74.177   7.449  -1.325
  487   HD12  ILE  64          HD12      ILE  64  73.916   9.192  -1.375
  488   HD13  ILE  64          HD13      ILE  64  72.797   8.110  -2.202
  489    H    THR  65           HN       THR  65  72.177  11.041   2.912
  490    HA   THR  65           HA       THR  65  74.375  11.226   4.876
  491    HB   THR  65           HB       THR  65  72.434  13.341   3.895
  492    HG1  THR  65           HG1      THR  65  74.859  13.774   3.050
  493   HG21  THR  65          HG21      THR  65  73.345  14.002   6.017
  494   HG22  THR  65          HG22      THR  65  74.253  14.870   4.779
  495   HG23  THR  65          HG23      THR  65  74.958  13.456   5.561
  496    H    VAL  66           HN       VAL  66  70.824  11.502   4.801
  497    HA   VAL  66           HA       VAL  66  70.790  11.839   7.746
  498    HB   VAL  66           HB       VAL  66  68.215  11.847   7.229
  499   HG11  VAL  66          HG11      VAL  66  68.425  14.268   6.503
  500   HG12  VAL  66          HG12      VAL  66  70.164  14.005   6.383
  501   HG13  VAL  66          HG13      VAL  66  69.354  13.844   7.941
  502   HG21  VAL  66          HG21      VAL  66  67.659  12.472   4.951
  503   HG22  VAL  66          HG22      VAL  66  68.580  10.969   4.895
  504   HG23  VAL  66          HG23      VAL  66  69.363  12.498   4.498
  505    H    ILE  67           HN       ILE  67  69.620   9.548   5.263
  506    HA   ILE  67           HA       ILE  67  69.554   7.458   7.403
  507    HB   ILE  67           HB       ILE  67  67.466   7.892   5.248
  508   HG12  ILE  67          HG12      ILE  67  67.105   7.822   8.250
  509   HG13  ILE  67          HG11      ILE  67  67.436   9.322   7.384
  510   HG21  ILE  67          HG21      ILE  67  66.364   5.935   6.464
  511   HG22  ILE  67          HG22      ILE  67  67.927   5.654   7.231
  512   HG23  ILE  67          HG23      ILE  67  67.770   5.531   5.479
  513   HD11  ILE  67          HD11      ILE  67  65.024   9.065   7.636
  514   HD12  ILE  67          HD12      ILE  67  65.092   7.456   6.918
  515   HD13  ILE  67          HD13      ILE  67  65.451   8.876   5.936
  516    H1U  RCY  68           H1U      RCY  68  75.405   1.784  -0.732
  517    H1S  RCY  68           H1S      RCY  68  72.931   3.799   2.876
  518    HB1  RCY  68           HB1      RCY  68  73.618   5.961   6.104
  519    HB2  RCY  68           HB2      RCY  68  73.748   6.619   4.474
  520    HA   RCY  68           HA       RCY  68  71.681   5.754   3.819
  521    HN1  RCY  68           HN1      RCY  68  71.515   6.591   6.655
  522    HA   PRO  69           HA       PRO  69  69.728   1.817   4.807
  523    HB2  PRO  69           HB2      PRO  69  71.667   1.037   2.641
  524    HB3  PRO  69           HB1      PRO  69  69.976   0.542   2.864
  525    HG2  PRO  69           HG2      PRO  69  70.652   2.442   1.120
  526    HG3  PRO  69           HG1      PRO  69  69.154   2.543   2.060
  527    HD2  PRO  69           HD2      PRO  69  71.626   4.160   2.314
  528    HD3  PRO  69           HD1      PRO  69  69.973   4.538   2.845
  529    H    TRP  70           HN       TRP  70  73.126   2.539   4.894
  530    HA   TRP  70           HA       TRP  70  74.144   0.031   5.794
  531    HD1  TRP  70           HD1      TRP  70  76.421  -0.709   5.612
  532    HE1  TRP  70           HE1      TRP  70  78.283  -1.383   7.260
  533    HE3  TRP  70           HE3      TRP  70  76.420   3.385   8.663
  534    HZ2  TRP  70           HZ2      TRP  70  79.602  -0.324   9.572
  535    HZ3  TRP  70           HZ3      TRP  70  77.985   3.528  10.575
  536    HH2  TRP  70           HH2      TRP  70  79.574   1.683  11.035
  537    HB2  TRP  70           HB2      TRP  70  75.531   2.035   5.133
  538    HB3  TRP  70           HB1      TRP  70  75.088   2.778   6.671
  539    H    GLU  71           HN       GLU  71  71.773   1.919   7.132
  540    HA   GLU  71           HA       GLU  71  72.422   1.068   9.928
  541    HB2  GLU  71           HB2      GLU  71  70.587   3.240   8.870
  542    HB3  GLU  71           HB1      GLU  71  70.710   2.789  10.573
  543    HG2  GLU  71           HG2      GLU  71  73.173   3.268  10.455
  544    HG3  GLU  71           HG1      GLU  71  72.928   3.880   8.819
  545    H    ALA  72           HN       ALA  72  69.627   1.456   7.714
  546    HA   ALA  72           HA       ALA  72  67.890  -0.231   9.269
  547    HB1  ALA  72           HB1      ALA  72  67.842   0.668   6.380
  548    HB2  ALA  72           HB2      ALA  72  66.858   1.266   7.716
  549    HB3  ALA  72           HB3      ALA  72  66.582  -0.352   7.073
  550    H1U  RCY  73           H1U      RCY  73  71.822   2.376   2.960
  551    H1S  RCY  73           H1S      RCY  73  69.439  -1.737   1.910
  552    HB1  RCY  73           HB1      RCY  73  70.515  -3.877   4.351
  553    HB2  RCY  73           HB2      RCY  73  70.732  -2.132   4.489
  554    HA   RCY  73           HA       RCY  73  68.954  -3.754   6.333
  555    HN1  RCY  73           HN1      RCY  73  69.415  -0.904   6.088
  556    H    ASN  74           HN       ASN  74  70.147  -3.097   8.680
  557    HA   ASN  74           HA       ASN  74  71.896  -3.793  10.079
  558    HB2  ASN  74           HB2      ASN  74  73.273  -5.139   7.774
  559    HB3  ASN  74           HB1      ASN  74  73.121  -5.668   9.451
  560   HD21  ASN  74          HD21      ASN  74  70.469  -5.744   9.985
  561   HD22  ASN  74          HD22      ASN  74  69.626  -6.719   8.880
  562    H    HIS  75           HN       HIS  75  74.665  -4.048   9.453
  563    HA   HIS  75           HA       HIS  75  75.370  -1.521   8.070
  564    HD1  HIS  75           HD1      HIS  75  73.171  -1.366  10.742
  565    HD2  HIS  75           HD2      HIS  75  76.480  -3.096  12.601
  566    HE1  HIS  75           HE1      HIS  75  72.296  -2.547  12.805
  567    HE2  HIS  75           HE2      HIS  75  74.300  -3.604  13.946
  568    HB2  HIS  75           HB2      HIS  75  76.967  -1.488  10.395
  569    HB3  HIS  75           HB1      HIS  75  75.637  -0.399  10.018
  570    H1U  RCY  76           H1U      RCY  76  75.717   2.821   4.626
  571    H1S  RCY  76           H1S      RCY  76  77.366  -1.391   6.204
  572    HB1  RCY  76           HB1      RCY  76  79.778  -4.167   5.779
  573    HB2  RCY  76           HB2      RCY  76  79.243  -2.803   6.761
  574    HA   RCY  76           HA       RCY  76  77.627  -5.312   6.213
  575    HN1  RCY  76           HN1      RCY  76  75.945  -3.770   6.850
  576    H    GLU  77           HN       GLU  77  76.996  -5.787   8.855
  577    HA   GLU  77           HA       GLU  77  79.183  -5.579  10.675
  578    HB2  GLU  77           HB2      GLU  77  76.610  -6.399  10.918
  579    HB3  GLU  77           HB1      GLU  77  77.414  -7.965  10.912
  580    HG2  GLU  77           HG2      GLU  77  78.880  -7.252  12.742
  581    HG3  GLU  77           HG1      GLU  77  78.144  -5.648  12.726
  582    H    LEU  78           HN       LEU  78  78.945  -8.686  11.130
  583    HA   LEU  78           HA       LEU  78  81.501  -9.326  10.038
  584    HG   LEU  78           HG       LEU  78  81.228  -9.494  12.424
  585    HB2  LEU  78           HB2      LEU  78  79.285 -10.905  11.302
  586    HB3  LEU  78           HB1      LEU  78  80.633 -11.760  10.553
  587   HD11  LEU  78          HD11      LEU  78  80.328 -12.277  13.204
  588   HD12  LEU  78          HD12      LEU  78  79.677 -10.736  13.761
  589   HD13  LEU  78          HD13      LEU  78  81.284 -11.251  14.273
  590   HD21  LEU  78          HD21      LEU  78  83.049 -10.568  11.178
  591   HD22  LEU  78          HD22      LEU  78  82.549 -12.150  11.777
  592   HD23  LEU  78          HD23      LEU  78  83.194 -10.947  12.895
  593    H    HIS  79           HN       HIS  79  78.214  -9.921   8.802
  594    HA   HIS  79           HA       HIS  79  79.346 -10.390   6.138
  595    HD1  HIS  79           HD1      HIS  79  80.062 -13.644   8.842
  596    HD2  HIS  79           HD2      HIS  79  80.995 -12.228   5.031
  597    HE1  HIS  79           HE1      HIS  79  82.483 -14.259   8.423
  598    HE2  HIS  79           HE2      HIS  79  83.064 -13.402   6.106
  599    HB2  HIS  79           HB2      HIS  79  78.081 -12.612   7.747
  600    HB3  HIS  79           HB1      HIS  79  78.126 -12.650   5.985
  601    H    GLU  80           HN       GLU  80  76.445 -10.504   8.205
  602    HA   GLU  80           HA       GLU  80  74.226  -9.915   7.731
  603    HB2  GLU  80           HB2      GLU  80  75.832  -8.058   5.975
  604    HB3  GLU  80           HB1      GLU  80  74.070  -8.012   5.968
  605    HG2  GLU  80           HG2      GLU  80  75.267  -6.431   7.609
  606    HG3  GLU  80           HG1      GLU  80  73.965  -7.424   8.264
  607    H    LEU  81           HN       LEU  81  74.372  -8.960   4.535
  608    HA   LEU  81           HA       LEU  81  73.272 -11.583   3.659
  609    HG   LEU  81           HG       LEU  81  70.691  -9.130   2.919
  610    HB2  LEU  81           HB2      LEU  81  73.048  -8.752   2.644
  611    HB3  LEU  81           HB1      LEU  81  72.634 -10.111   1.602
  612   HD11  LEU  81          HD11      LEU  81  71.109 -11.973   3.775
  613   HD12  LEU  81          HD12      LEU  81  71.052 -11.605   2.051
  614   HD13  LEU  81          HD13      LEU  81  69.675 -11.214   3.082
  615   HD21  LEU  81          HD21      LEU  81  72.187  -8.872   5.003
  616   HD22  LEU  81          HD22      LEU  81  71.933 -10.600   5.250
  617   HD23  LEU  81          HD23      LEU  81  70.558  -9.496   5.264
  618    H    ALA  82           HN       ALA  82  76.200 -10.878   3.971
  619    HA   ALA  82           HA       ALA  82  77.380 -10.535   1.390
  620    HB1  ALA  82           HB1      ALA  82  78.661 -10.229   3.463
  621    HB2  ALA  82           HB2      ALA  82  79.428 -11.451   2.449
  622    HB3  ALA  82           HB3      ALA  82  78.471 -11.940   3.846
  623    H    GLN  83           HN       GLN  83  75.928 -12.033   0.152
  624    HA   GLN  83           HA       GLN  83  75.906 -14.855   0.552
  625    HB2  GLN  83           HB2      GLN  83  74.338 -13.739  -0.977
  626    HB3  GLN  83           HB1      GLN  83  75.674 -13.277  -2.031
  627    HG2  GLN  83           HG2      GLN  83  76.152 -15.576  -2.564
  628    HG3  GLN  83           HG1      GLN  83  75.030 -16.152  -1.331
  629   HE21  GLN  83          HE21      GLN  83  72.656 -15.366  -1.688
  630   HE22  GLN  83          HE22      GLN  83  72.107 -15.314  -3.293
  631    H    TYR  84           HN       TYR  84  77.997 -12.826  -1.512
  632    HA   TYR  84           HA       TYR  84  80.298 -14.503  -1.054
  633    HD1  TYR  84           HD2      TYR  84  81.871 -16.152  -1.959
  634    HD2  TYR  84           HD1      TYR  84  77.775 -17.142  -2.794
  635    HE1  TYR  84           HE2      TYR  84  82.237 -18.430  -1.050
  636    HE2  TYR  84           HE1      TYR  84  78.141 -19.420  -1.884
  637    HH   TYR  84           HH       TYR  84  80.566 -20.261   0.043
  638    HB2  TYR  84           HB2      TYR  84  78.586 -15.050  -3.416
  639    HB3  TYR  84           HB1      TYR  84  80.311 -14.910  -3.756
  640    H    GLY  85           HN       GLY  85  78.925 -12.430  -3.643
  641    HA2  GLY  85           HA2      GLY  85  81.465 -11.047  -4.003
  642    HA3  GLY  85           HA1      GLY  85  79.925 -10.588  -4.738
  643    H    ILE  86           HN       ILE  86  80.978 -10.931  -1.337
  644    HA   ILE  86           HA       ILE  86  79.386  -8.914  -0.258
  645    HB   ILE  86           HB       ILE  86  80.921 -10.508   0.998
  646   HG12  ILE  86          HG12      ILE  86  81.106  -7.586   1.794
  647   HG13  ILE  86          HG11      ILE  86  79.675  -8.588   2.040
  648   HG21  ILE  86          HG21      ILE  86  82.971  -8.319   0.626
  649   HG22  ILE  86          HG22      ILE  86  82.940  -9.751  -0.402
  650   HG23  ILE  86          HG23      ILE  86  83.200  -9.918   1.334
  651   HD11  ILE  86          HD11      ILE  86  80.855  -8.696   4.101
  652   HD12  ILE  86          HD12      ILE  86  82.408  -8.901   3.290
  653   HD13  ILE  86          HD13      ILE  86  81.230 -10.213   3.283
  654    H1U  RCY  87           H1U      RCY  87  76.033   1.167   1.999
  655    H1S  RCY  87           H1S      RCY  87  78.360  -2.190  -0.494
  656    HB1  RCY  87           HB1      RCY  87  78.811  -4.691  -1.738
  657    HB2  RCY  87           HB2      RCY  87  79.926  -3.344  -1.505
  658    HA   RCY  87           HA       RCY  87  81.195  -5.344  -2.102
  659    HN1  RCY  87           HN1      RCY  87  79.453  -6.707  -0.191
  Start of MODEL   78
    1    HA   MET   1           HA       MET   1  62.505   6.891  14.273
    2    HB2  MET   1           HB2      MET   1  64.297   6.863  16.718
    3    HB3  MET   1           HB1      MET   1  62.549   6.627  16.675
    4    HG2  MET   1           HG2      MET   1  64.579   4.803  15.350
    5    HG3  MET   1           HG1      MET   1  63.771   4.472  16.883
    6    HE1  MET   1           HE1      MET   1  63.837   2.481  14.943
    7    HE2  MET   1           HE2      MET   1  63.655   3.260  13.372
    8    HE3  MET   1           HE3      MET   1  62.412   2.152  13.949
    9    H    ASN   2           HN       ASN   2  61.539   8.868  14.413
   10    HA   ASN   2           HA       ASN   2  62.794  11.085  15.841
   11    HB2  ASN   2           HB2      ASN   2  62.694  11.017  12.825
   12    HB3  ASN   2           HB1      ASN   2  62.675  12.547  13.703
   13   HD21  ASN   2          HD21      ASN   2  64.747  10.169  12.410
   14   HD22  ASN   2          HD22      ASN   2  66.167  10.619  13.225
   15    H    LEU   3           HN       LEU   3  60.515  10.878  13.084
   16    HA   LEU   3           HA       LEU   3  58.259  11.449  14.893
   17    HG   LEU   3           HG       LEU   3  56.471  13.040  13.576
   18    HB2  LEU   3           HB2      LEU   3  59.367  13.669  14.211
   19    HB3  LEU   3           HB1      LEU   3  58.794  13.322  12.581
   20   HD11  LEU   3          HD11      LEU   3  56.361  14.455  15.810
   21   HD12  LEU   3          HD12      LEU   3  58.033  13.918  15.980
   22   HD13  LEU   3          HD13      LEU   3  56.733  12.731  15.865
   23   HD21  LEU   3          HD21      LEU   3  56.936  15.067  12.390
   24   HD22  LEU   3          HD22      LEU   3  57.942  15.684  13.702
   25   HD23  LEU   3          HD23      LEU   3  56.195  15.562  13.912
   26    H    GLU   4           HN       GLU   4  59.580  10.284  11.960
   27    HA   GLU   4           HA       GLU   4  57.429  10.184  10.190
   28    HB2  GLU   4           HB2      GLU   4  59.437   7.997  10.810
   29    HB3  GLU   4           HB1      GLU   4  58.396   8.021   9.387
   30    HG2  GLU   4           HG2      GLU   4  60.234  10.322  10.062
   31    HG3  GLU   4           HG1      GLU   4  60.766   8.956   9.081
   32    HA   PRO   5           HA       PRO   5  54.332   7.823  12.314
   33    HB2  PRO   5           HB2      PRO   5  52.932   6.818  10.194
   34    HB3  PRO   5           HB1      PRO   5  52.858   8.522  10.684
   35    HG2  PRO   5           HG2      PRO   5  54.422   7.261   8.486
   36    HG3  PRO   5           HG1      PRO   5  53.537   8.796   8.506
   37    HD2  PRO   5           HD2      PRO   5  56.255   8.653   8.795
   38    HD3  PRO   5           HD1      PRO   5  55.273   9.942   9.526
   39    HA   PRO   6           HA       PRO   6  56.280   3.714  11.960
   40    HB2  PRO   6           HB2      PRO   6  55.906   2.922  14.512
   41    HB3  PRO   6           HB1      PRO   6  57.136   4.129  14.084
   42    HG2  PRO   6           HG2      PRO   6  54.451   4.526  15.295
   43    HG3  PRO   6           HG1      PRO   6  55.972   5.373  15.616
   44    HD2  PRO   6           HD2      PRO   6  53.919   6.336  13.982
   45    HD3  PRO   6           HD1      PRO   6  55.602   6.904  13.948
   46    H    LYS   7           HN       LYS   7  55.450   1.456  12.269
   47    HA   LYS   7           HA       LYS   7  52.464   1.318  12.449
   48    HB2  LYS   7           HB2      LYS   7  54.290   0.133  10.353
   49    HB3  LYS   7           HB1      LYS   7  52.682  -0.521  10.659
   50    HG2  LYS   7           HG2      LYS   7  51.625   1.537  10.067
   51    HG3  LYS   7           HG1      LYS   7  53.157   2.412  10.094
   52    HD2  LYS   7           HD2      LYS   7  53.009   0.081   8.256
   53    HD3  LYS   7           HD1      LYS   7  52.043   1.489   7.811
   54    HE2  LYS   7           HE2      LYS   7  54.494   1.389   6.967
   55    HE3  LYS   7           HE1      LYS   7  53.931   2.897   7.686
   56    HZ1  LYS   7           HZ1      LYS   7  54.902   2.227   9.787
   57    HZ2  LYS   7           HZ2      LYS   7  56.084   2.235   8.566
   58    HZ3  LYS   7           HZ3      LYS   7  55.430   0.764   9.109
   59    H    ALA   8           HN       ALA   8  53.827  -1.607  11.541
   60    HA   ALA   8           HA       ALA   8  54.580  -2.473  14.253
   61    HB1  ALA   8           HB1      ALA   8  52.840  -4.097  14.513
   62    HB2  ALA   8           HB2      ALA   8  52.259  -3.836  12.869
   63    HB3  ALA   8           HB3      ALA   8  52.034  -2.586  14.092
   64    H    GLU   9           HN       GLU   9  55.310  -2.434  11.164
   65    HA   GLU   9           HA       GLU   9  56.647  -5.079  11.273
   66    HB2  GLU   9           HB2      GLU   9  55.123  -4.199   8.808
   67    HB3  GLU   9           HB1      GLU   9  55.888  -5.762   9.102
   68    HG2  GLU   9           HG2      GLU   9  54.308  -6.091  11.035
   69    HG3  GLU   9           HG1      GLU   9  53.473  -4.620  10.533
   70    H1U  RCY  10           H1U      RCY  10  62.291   1.864   5.281
   71    H1S  RCY  10           H1S      RCY  10  60.693  -1.771   6.491
   72    HB1  RCY  10           HB1      RCY  10  60.573  -4.867   8.796
   73    HB2  RCY  10           HB2      RCY  10  60.417  -3.553   9.961
   74    HA   RCY  10           HA       RCY  10  58.972  -2.326   8.366
   75    HN1  RCY  10           HN1      RCY  10  57.689  -4.978   8.642
   76    H    ARG  11           HN       ARG  11  57.131  -3.860   6.704
   77    HA   ARG  11           HA       ARG  11  58.648  -3.740   4.215
   78    HE   ARG  11           HE       ARG  11  61.107  -7.927   2.319
   79    HB2  ARG  11           HB2      ARG  11  59.040  -6.082   5.324
   80    HB3  ARG  11           HB1      ARG  11  57.393  -6.417   4.790
   81    HG2  ARG  11           HG2      ARG  11  58.026  -5.803   2.476
   82    HG3  ARG  11           HG1      ARG  11  59.679  -5.506   3.015
   83    HD2  ARG  11           HD2      ARG  11  59.431  -7.973   3.983
   84    HD3  ARG  11           HD1      ARG  11  58.222  -8.099   2.705
   85   HH11  ARG  11          HH21      ARG  11  57.969  -7.292   1.040
   86   HH12  ARG  11          HH22      ARG  11  58.487  -7.336  -0.612
   87   HH21  ARG  11          HH11      ARG  11  61.803  -7.987   0.169
   88   HH22  ARG  11          HH12      ARG  11  60.658  -7.729  -1.105
   89    H    SER  12           HN       SER  12  57.124  -2.422   3.267
   90    HA   SER  12           HA       SER  12  54.271  -2.810   3.626
   91    HG   SER  12           HG       SER  12  55.034  -0.871   4.214
   92    HB2  SER  12           HB2      SER  12  55.909  -1.122   1.724
   93    HB3  SER  12           HB1      SER  12  54.148  -1.146   1.692
   94    H    ALA  13           HN       ALA  13  56.657  -4.189   1.576
   95    HA   ALA  13           HA       ALA  13  56.472  -5.861  -0.058
   96    HB1  ALA  13           HB1      ALA  13  54.620  -7.261   0.010
   97    HB2  ALA  13           HB2      ALA  13  53.487  -5.929   0.236
   98    HB3  ALA  13           HB3      ALA  13  54.482  -6.479   1.584
   99    H    THR  14           HN       THR  14  56.623  -3.277  -0.971
  100    HA   THR  14           HA       THR  14  55.461  -3.476  -3.588
  101    HB   THR  14           HB       THR  14  53.378  -2.867  -2.481
  102    HG1  THR  14           HG1      THR  14  54.554  -1.467  -4.361
  103   HG21  THR  14          HG21      THR  14  54.603  -1.818  -0.497
  104   HG22  THR  14          HG22      THR  14  53.156  -0.974  -1.048
  105   HG23  THR  14          HG23      THR  14  54.753  -0.366  -1.486
  106    H    ARG  15           HN       ARG  15  58.053  -3.038  -2.763
  107    HA   ARG  15           HA       ARG  15  58.772  -0.670  -4.198
  108    HE   ARG  15           HE       ARG  15  57.719  -0.890   1.626
  109    HB2  ARG  15           HB2      ARG  15  59.837   0.457  -2.083
  110    HB3  ARG  15           HB1      ARG  15  58.125   0.710  -2.417
  111    HG2  ARG  15           HG2      ARG  15  57.441  -0.774  -0.737
  112    HG3  ARG  15           HG1      ARG  15  58.996  -1.607  -0.707
  113    HD2  ARG  15           HD2      ARG  15  60.050   0.155   0.465
  114    HD3  ARG  15           HD1      ARG  15  58.767   1.299   0.072
  115   HH11  ARG  15          HH21      ARG  15  59.629   1.978   1.752
  116   HH12  ARG  15          HH22      ARG  15  59.255   2.314   3.409
  117   HH21  ARG  15          HH11      ARG  15  57.219  -0.467   3.789
  118   HH22  ARG  15          HH12      ARG  15  57.890   0.931   4.563
  119    H    VAL  16           HN       VAL  16  61.255  -0.115  -2.953
  120    HA   VAL  16           HA       VAL  16  63.447  -0.946  -2.960
  121    HB   VAL  16           HB       VAL  16  62.161  -3.449  -1.839
  122   HG11  VAL  16          HG11      VAL  16  64.340  -3.628  -0.656
  123   HG12  VAL  16          HG12      VAL  16  64.902  -2.191  -1.510
  124   HG13  VAL  16          HG13      VAL  16  64.537  -3.664  -2.408
  125   HG21  VAL  16          HG21      VAL  16  62.875  -0.812  -0.534
  126   HG22  VAL  16          HG22      VAL  16  62.663  -2.302   0.385
  127   HG23  VAL  16          HG23      VAL  16  61.312  -1.629  -0.529
  128    H    MET  17           HN       MET  17  61.914  -4.111  -3.459
  129    HA   MET  17           HA       MET  17  63.350  -4.284  -6.071
  130    HB2  MET  17           HB2      MET  17  62.033  -6.562  -4.579
  131    HB3  MET  17           HB1      MET  17  63.287  -6.651  -5.818
  132    HG2  MET  17           HG2      MET  17  64.708  -5.243  -4.148
  133    HG3  MET  17           HG1      MET  17  63.535  -5.782  -2.946
  134    HE1  MET  17           HE1      MET  17  66.312  -6.084  -2.665
  135    HE2  MET  17           HE2      MET  17  67.045  -6.730  -4.132
  136    HE3  MET  17           HE3      MET  17  66.964  -7.727  -2.682
  137    H    GLY  18           HN       GLY  18  60.185  -4.562  -4.549
  138    HA2  GLY  18           HA2      GLY  18  58.037  -4.694  -5.475
  139    HA3  GLY  18           HA1      GLY  18  58.709  -3.714  -6.776
  140    H    GLY  19           HN       GLY  19  59.108  -7.123  -5.713
  141    HA2  GLY  19           HA2      GLY  19  58.226  -8.977  -7.051
  142    HA3  GLY  19           HA1      GLY  19  58.335  -7.945  -8.476
  143    HA   PRO  20           HA       PRO  20  61.851 -10.684  -9.326
  144    HB2  PRO  20           HB2      PRO  20  62.296  -8.402 -11.226
  145    HB3  PRO  20           HB1      PRO  20  62.418 -10.149 -11.517
  146    HG2  PRO  20           HG2      PRO  20  60.288  -8.762 -12.301
  147    HG3  PRO  20           HG1      PRO  20  60.133 -10.411 -11.673
  148    HD2  PRO  20           HD2      PRO  20  59.367  -7.838 -10.390
  149    HD3  PRO  20           HD1      PRO  20  58.715  -9.470 -10.125
  150    H1U  RCY  21           H1U      RCY  21  69.130  -3.682  -6.606
  151    H1S  RCY  21           H1S      RCY  21  67.375  -7.239  -7.636
  152    HB1  RCY  21           HB1      RCY  21  66.177 -10.663  -7.353
  153    HB2  RCY  21           HB2      RCY  21  64.843  -9.902  -6.487
  154    HA   RCY  21           HA       RCY  21  65.193  -7.888  -8.039
  155    HN1  RCY  21           HN1      RCY  21  64.263 -10.328  -9.483
  156    H    THR  22           HN       THR  22  66.261  -7.092  -9.876
  157    HA   THR  22           HA       THR  22  68.519  -8.785 -10.879
  158    HB   THR  22           HB       THR  22  68.046  -8.261 -13.088
  159    HG1  THR  22           HG1      THR  22  68.081  -6.002 -12.720
  160   HG21  THR  22          HG21      THR  22  66.090  -9.455 -11.982
  161   HG22  THR  22          HG22      THR  22  65.710  -8.604 -13.479
  162   HG23  THR  22          HG23      THR  22  65.279  -7.890 -11.925
  163    HA   PRO  23           HA       PRO  23  71.481  -5.691  -9.813
  164    HB2  PRO  23           HB2      PRO  23  71.931  -5.481 -12.779
  165    HB3  PRO  23           HB1      PRO  23  73.123  -5.601 -11.469
  166    HG2  PRO  23           HG2      PRO  23  72.430  -7.710 -12.979
  167    HG3  PRO  23           HG1      PRO  23  72.881  -7.866 -11.274
  168    HD2  PRO  23           HD2      PRO  23  70.242  -8.233 -12.526
  169    HD3  PRO  23           HD1      PRO  23  70.802  -8.741 -10.918
  170    H    ARG  24           HN       ARG  24  70.731  -3.694  -9.193
  171    HA   ARG  24           HA       ARG  24  69.606  -1.628  -9.303
  172    HE   ARG  24           HE       ARG  24  68.707   2.197 -12.025
  173    HB2  ARG  24           HB2      ARG  24  71.665  -1.183 -10.653
  174    HB3  ARG  24           HB1      ARG  24  70.775  -1.648 -12.101
  175    HG2  ARG  24           HG2      ARG  24  69.145   0.223 -10.738
  176    HG3  ARG  24           HG1      ARG  24  70.778   0.891 -10.733
  177    HD2  ARG  24           HD2      ARG  24  70.940   0.699 -13.133
  178    HD3  ARG  24           HD1      ARG  24  69.426  -0.201 -13.214
  179   HH11  ARG  24          HH21      ARG  24  70.385   1.218 -14.874
  180   HH12  ARG  24          HH22      ARG  24  69.882   2.590 -15.803
  181   HH21  ARG  24          HH11      ARG  24  68.041   3.995 -13.221
  182   HH22  ARG  24          HH12      ARG  24  68.555   4.163 -14.867
  183    H    LYS  25           HN       LYS  25  67.955  -3.841  -9.871
  184    HA   LYS  25           HA       LYS  25  65.840  -4.275 -10.706
  185    HB2  LYS  25           HB2      LYS  25  66.026  -1.448 -10.572
  186    HB3  LYS  25           HB1      LYS  25  65.301  -1.814 -12.136
  187    HG2  LYS  25           HG2      LYS  25  64.344  -2.813  -9.436
  188    HG3  LYS  25           HG1      LYS  25  63.538  -1.621 -10.456
  189    HD2  LYS  25           HD2      LYS  25  63.601  -3.504 -12.270
  190    HD3  LYS  25           HD1      LYS  25  63.842  -4.581 -10.894
  191    HE2  LYS  25           HE2      LYS  25  61.503  -4.539 -11.114
  192    HE3  LYS  25           HE1      LYS  25  61.800  -3.334  -9.860
  193    HZ1  LYS  25           HZ1      LYS  25  60.497  -2.952 -12.260
  194    HZ2  LYS  25           HZ2      LYS  25  61.995  -2.169 -12.435
  195    HZ3  LYS  25           HZ3      LYS  25  60.963  -1.758 -11.149
  196    H    GLY  26           HN       GLY  26  68.479  -3.461 -12.656
  197    HA2  GLY  26           HA2      GLY  26  67.893  -5.249 -14.715
  198    HA3  GLY  26           HA1      GLY  26  67.206  -3.716 -15.247
  199    HA   PRO  27           HA       PRO  27  71.024  -2.817 -17.333
  200    HB2  PRO  27           HB2      PRO  27  70.452  -0.087 -16.223
  201    HB3  PRO  27           HB1      PRO  27  70.941  -0.552 -17.865
  202    HG2  PRO  27           HG2      PRO  27  68.401   0.026 -17.254
  203    HG3  PRO  27           HG1      PRO  27  68.823  -1.205 -18.454
  204    HD2  PRO  27           HD2      PRO  27  67.666  -1.558 -15.755
  205    HD3  PRO  27           HD1      PRO  27  67.661  -2.675 -17.138
  206    HA   PRO  28           HA       PRO  28  74.309  -3.163 -14.358
  207    HB2  PRO  28           HB2      PRO  28  75.569  -0.943 -15.934
  208    HB3  PRO  28           HB1      PRO  28  76.272  -2.482 -15.398
  209    HG2  PRO  28           HG2      PRO  28  75.456  -2.089 -17.919
  210    HG3  PRO  28           HG1      PRO  28  75.339  -3.664 -17.120
  211    HD2  PRO  28           HD2      PRO  28  73.175  -1.792 -17.867
  212    HD3  PRO  28           HD1      PRO  28  73.090  -3.533 -17.526
  213    H    LYS  29           HN       LYS  29  75.487  -1.809 -12.716
  214    HA   LYS  29           HA       LYS  29  73.745   0.391 -11.798
  215    HB2  LYS  29           HB2      LYS  29  76.230  -0.523 -10.363
  216    HB3  LYS  29           HB1      LYS  29  74.737   0.127  -9.692
  217    HG2  LYS  29           HG2      LYS  29  74.275  -2.066  -9.258
  218    HG3  LYS  29           HG1      LYS  29  73.786  -2.094 -10.952
  219    HD2  LYS  29           HD2      LYS  29  75.737  -3.149 -11.643
  220    HD3  LYS  29           HD1      LYS  29  76.672  -2.542 -10.275
  221    HE2  LYS  29           HE2      LYS  29  75.823  -5.083 -10.389
  222    HE3  LYS  29           HE1      LYS  29  75.950  -4.211  -8.862
  223    HZ1  LYS  29           HZ1      LYS  29  73.732  -4.071  -8.653
  224    HZ2  LYS  29           HZ2      LYS  29  73.725  -5.405  -9.706
  225    HZ3  LYS  29           HZ3      LYS  29  73.468  -3.839 -10.313
  226    H1U  RCY  30           H1U      RCY  30  78.989   5.559  -6.760
  227    H1S  RCY  30           H1S      RCY  30  79.367   6.253 -10.807
  228    HB1  RCY  30           HB1      RCY  30  78.043   3.192 -10.511
  229    HB2  RCY  30           HB2      RCY  30  76.595   3.520 -11.464
  230    HA   RCY  30           HA       RCY  30  77.812   2.334 -13.399
  231    HN1  RCY  30           HN1      RCY  30  77.295   0.208 -11.532
  232    H    LYS  31           HN       LYS  31  78.794   0.498 -10.566
  233    HA   LYS  31           HA       LYS  31  80.936  -0.152  -9.819
  234    HB2  LYS  31           HB2      LYS  31  81.298  -0.365 -12.822
  235    HB3  LYS  31           HB1      LYS  31  82.283  -1.180 -11.608
  236    HG2  LYS  31           HG2      LYS  31  80.682  -2.747 -11.169
  237    HG3  LYS  31           HG1      LYS  31  79.364  -1.586 -11.332
  238    HD2  LYS  31           HD2      LYS  31  79.181  -3.154 -13.160
  239    HD3  LYS  31           HD1      LYS  31  79.748  -1.622 -13.826
  240    HE2  LYS  31           HE2      LYS  31  81.088  -3.421 -14.766
  241    HE3  LYS  31           HE1      LYS  31  82.096  -2.482 -13.665
  242    HZ1  LYS  31           HZ1      LYS  31  82.412  -4.813 -13.258
  243    HZ2  LYS  31           HZ2      LYS  31  80.742  -5.054 -13.059
  244    HZ3  LYS  31           HZ3      LYS  31  81.610  -4.128 -11.930
  245    H    GLN  32           HN       GLN  32  81.805   1.762  -8.928
  246    HA   GLN  32           HA       GLN  32  83.924   3.020 -10.565
  247    HB2  GLN  32           HB2      GLN  32  81.756   4.367 -10.803
  248    HB3  GLN  32           HB1      GLN  32  81.934   4.757  -9.092
  249    HG2  GLN  32           HG2      GLN  32  84.245   5.613  -9.599
  250    HG3  GLN  32           HG1      GLN  32  83.899   5.381 -11.313
  251   HE21  GLN  32          HE21      GLN  32  82.554   7.052  -8.413
  252   HE22  GLN  32          HE22      GLN  32  81.915   8.362  -9.284
  253    H    ARG  33           HN       ARG  33  84.815   1.463  -8.752
  254    HA   ARG  33           HA       ARG  33  84.766   1.978  -6.030
  255    HE   ARG  33           HE       ARG  33  89.050   0.804  -7.255
  256    HB2  ARG  33           HB2      ARG  33  86.108   0.186  -7.203
  257    HB3  ARG  33           HB1      ARG  33  87.311   1.417  -7.578
  258    HG2  ARG  33           HG2      ARG  33  86.469   1.311  -4.741
  259    HG3  ARG  33           HG1      ARG  33  87.363  -0.098  -5.311
  260    HD2  ARG  33           HD2      ARG  33  88.259   2.790  -5.544
  261    HD3  ARG  33           HD1      ARG  33  88.918   1.587  -4.436
  262   HH11  ARG  33          HH21      ARG  33  90.520   2.418  -4.587
  263   HH12  ARG  33          HH22      ARG  33  92.129   2.266  -5.210
  264   HH21  ARG  33          HH11      ARG  33  91.143   0.596  -8.084
  265   HH22  ARG  33          HH12      ARG  33  92.482   1.235  -7.190
  266    H    GLN  34           HN       GLN  34  84.813   3.987  -5.143
  267    HA   GLN  34           HA       GLN  34  87.182   5.540  -5.036
  268    HB2  GLN  34           HB2      GLN  34  85.631   5.967  -7.427
  269    HB3  GLN  34           HB1      GLN  34  85.546   7.424  -6.442
  270    HG2  GLN  34           HG2      GLN  34  87.967   7.547  -6.313
  271    HG3  GLN  34           HG1      GLN  34  88.128   5.995  -7.136
  272   HE21  GLN  34          HE21      GLN  34  88.076   9.351  -7.664
  273   HE22  GLN  34          HE22      GLN  34  87.796   9.331  -9.338
  274    H    THR  35           HN       THR  35  86.096   5.068  -2.881
  275    HA   THR  35           HA       THR  35  84.414   7.404  -2.138
  276    HB   THR  35           HB       THR  35  82.647   5.909  -2.291
  277    HG1  THR  35           HG1      THR  35  82.195   5.245  -0.216
  278   HG21  THR  35          HG21      THR  35  83.897   4.004  -3.099
  279   HG22  THR  35          HG22      THR  35  82.909   3.467  -1.740
  280   HG23  THR  35          HG23      THR  35  84.634   3.758  -1.515
  281    H    ARG  36           HN       ARG  36  86.665   7.908  -1.292
  282    HA   ARG  36           HA       ARG  36  87.484   6.343   1.073
  283    HE   ARG  36           HE       ARG  36  90.000   9.378  -3.384
  284    HB2  ARG  36           HB2      ARG  36  88.808   8.943   0.458
  285    HB3  ARG  36           HB1      ARG  36  89.521   7.391   0.886
  286    HG2  ARG  36           HG2      ARG  36  90.115   7.551  -1.361
  287    HG3  ARG  36           HG1      ARG  36  88.602   6.650  -1.472
  288    HD2  ARG  36           HD2      ARG  36  87.921   8.274  -2.892
  289    HD3  ARG  36           HD1      ARG  36  87.752   9.285  -1.457
  290   HH11  ARG  36          HH21      ARG  36  88.504  10.362  -0.437
  291   HH12  ARG  36          HH22      ARG  36  89.485  11.778  -0.257
  292   HH21  ARG  36          HH11      ARG  36  91.290  11.222  -3.165
  293   HH22  ARG  36          HH12      ARG  36  91.062  12.265  -1.801
  294    H    GLN  37           HN       GLN  37  85.062   7.167   1.695
  295    HA   GLN  37           HA       GLN  37  83.864   8.332   3.337
  296    HB2  GLN  37           HB2      GLN  37  86.170   8.032   4.540
  297    HB3  GLN  37           HB1      GLN  37  86.393   9.742   4.171
  298    HG2  GLN  37           HG2      GLN  37  83.981   9.992   5.180
  299    HG3  GLN  37           HG1      GLN  37  84.343   8.443   5.942
  300   HE21  GLN  37          HE21      GLN  37  86.568  11.188   5.263
  301   HE22  GLN  37          HE22      GLN  37  87.007  11.430   6.885
  302    H1U  RCY  38           H1U      RCY  38  81.810   7.427  -2.358
  303    H1S  RCY  38           H1S      RCY  38  83.346  11.121  -1.821
  304    HB1  RCY  38           HB1      RCY  38  81.288  12.754   1.719
  305    HB2  RCY  38           HB2      RCY  38  81.759  11.084   1.421
  306    HA   RCY  38           HA       RCY  38  84.112  12.661   1.981
  307    HN1  RCY  38           HN1      RCY  38  83.073  10.538   3.770
  308    H    LYS  39           HN       LYS  39  81.186  12.035   3.943
  309    HA   LYS  39           HA       LYS  39  81.790  14.547   5.463
  310    HB2  LYS  39           HB2      LYS  39  79.116  13.195   4.990
  311    HB3  LYS  39           HB1      LYS  39  79.371  14.715   5.846
  312    HG2  LYS  39           HG2      LYS  39  79.648  15.902   3.919
  313    HG3  LYS  39           HG1      LYS  39  80.556  14.605   3.139
  314    HD2  LYS  39           HD2      LYS  39  78.455  14.861   1.961
  315    HD3  LYS  39           HD1      LYS  39  78.392  13.349   2.868
  316    HE2  LYS  39           HE2      LYS  39  77.354  15.918   4.059
  317    HE3  LYS  39           HE1      LYS  39  76.339  14.924   3.013
  318    HZ1  LYS  39           HZ1      LYS  39  75.868  13.986   5.010
  319    HZ2  LYS  39           HZ2      LYS  39  77.383  14.355   5.683
  320    HZ3  LYS  39           HZ3      LYS  39  77.224  13.049   4.608
  321    H    SER  40           HN       SER  40  80.896  11.152   5.661
  322    HA   SER  40           HA       SER  40  81.066   9.659   7.464
  323    HG   SER  40           HG       SER  40  84.212  11.122   8.097
  324    HB2  SER  40           HB2      SER  40  82.144  11.807   9.255
  325    HB3  SER  40           HB1      SER  40  82.613  10.114   9.133
  326    H    LYS  41           HN       LYS  41  78.615  10.722   7.061
  327    HA   LYS  41           HA       LYS  41  77.640  11.382   9.818
  328    HB2  LYS  41           HB2      LYS  41  76.429  12.219   7.165
  329    HB3  LYS  41           HB1      LYS  41  75.818  12.642   8.763
  330    HG2  LYS  41           HG2      LYS  41  78.664  13.298   8.067
  331    HG3  LYS  41           HG1      LYS  41  77.370  14.335   7.466
  332    HD2  LYS  41           HD2      LYS  41  77.669  13.564  10.380
  333    HD3  LYS  41           HD1      LYS  41  78.327  15.050   9.694
  334    HE2  LYS  41           HE2      LYS  41  75.776  15.174   8.763
  335    HE3  LYS  41           HE1      LYS  41  75.516  14.326  10.288
  336    HZ1  LYS  41           HZ1      LYS  41  75.399  16.612  10.770
  337    HZ2  LYS  41           HZ2      LYS  41  76.795  16.964   9.868
  338    HZ3  LYS  41           HZ3      LYS  41  76.919  16.109  11.330
  339    HA   PRO  42           HA       PRO  42  75.669   7.449   8.462
  340    HB2  PRO  42           HB2      PRO  42  76.139   6.039  10.756
  341    HB3  PRO  42           HB1      PRO  42  77.313   6.165   9.435
  342    HG2  PRO  42           HG2      PRO  42  77.273   7.510  12.062
  343    HG3  PRO  42           HG1      PRO  42  78.646   7.045  11.048
  344    HD2  PRO  42           HD2      PRO  42  77.568   9.640  11.289
  345    HD3  PRO  42           HD1      PRO  42  78.714   9.093  10.048
  346    HA   PRO  43           HA       PRO  43  71.923   8.349  10.737
  347    HB2  PRO  43           HB2      PRO  43  70.342   6.356   9.878
  348    HB3  PRO  43           HB1      PRO  43  70.946   7.595   8.758
  349    HG2  PRO  43           HG2      PRO  43  71.915   4.811   9.178
  350    HG3  PRO  43           HG1      PRO  43  71.716   5.722   7.672
  351    HD2  PRO  43           HD2      PRO  43  74.136   5.398   9.011
  352    HD3  PRO  43           HD1      PRO  43  73.791   6.695   7.846
  353    H    LYS  44           HN       LYS  44  70.520   7.541  12.450
  354    HA   LYS  44           HA       LYS  44  70.161   6.462  14.498
  355    HB2  LYS  44           HB2      LYS  44  69.470   4.635  13.033
  356    HB3  LYS  44           HB1      LYS  44  71.145   4.113  12.851
  357    HG2  LYS  44           HG2      LYS  44  71.287   3.365  15.076
  358    HG3  LYS  44           HG1      LYS  44  69.904   4.332  15.587
  359    HD2  LYS  44           HD2      LYS  44  68.361   2.891  14.467
  360    HD3  LYS  44           HD1      LYS  44  69.656   2.067  13.598
  361    HE2  LYS  44           HE2      LYS  44  70.471   1.046  15.616
  362    HE3  LYS  44           HE1      LYS  44  69.414   2.043  16.615
  363    HZ1  LYS  44           HZ1      LYS  44  68.433  -0.099  16.393
  364    HZ2  LYS  44           HZ2      LYS  44  68.596  -0.071  14.702
  365    HZ3  LYS  44           HZ3      LYS  44  67.508   0.983  15.470
  366    H    LYS  45           HN       LYS  45  73.231   6.871  13.274
  367    HA   LYS  45           HA       LYS  45  74.568   5.571  15.595
  368    HB2  LYS  45           HB2      LYS  45  75.455   6.579  12.916
  369    HB3  LYS  45           HB1      LYS  45  76.638   6.509  14.221
  370    HG2  LYS  45           HG2      LYS  45  74.897   4.118  13.740
  371    HG3  LYS  45           HG1      LYS  45  76.249   4.410  12.645
  372    HD2  LYS  45           HD2      LYS  45  76.537   4.361  15.659
  373    HD3  LYS  45           HD1      LYS  45  76.800   2.946  14.639
  374    HE2  LYS  45           HE2      LYS  45  78.317   4.784  13.327
  375    HE3  LYS  45           HE1      LYS  45  78.479   5.361  14.986
  376    HZ1  LYS  45           HZ1      LYS  45  80.179   3.799  14.695
  377    HZ2  LYS  45           HZ2      LYS  45  79.161   2.694  13.902
  378    HZ3  LYS  45           HZ3      LYS  45  78.983   2.971  15.568
  379    H    GLY  46           HN       GLY  46  75.775   8.454  13.992
  380    HA2  GLY  46           HA2      GLY  46  74.830  10.506  15.623
  381    HA3  GLY  46           HA1      GLY  46  76.162   9.791  16.533
  382    H    VAL  47           HN       VAL  47  78.268  10.213  15.879
  383    HA   VAL  47           HA       VAL  47  78.746  11.474  13.250
  384    HB   VAL  47           HB       VAL  47  80.043  13.342  14.426
  385   HG11  VAL  47          HG11      VAL  47  77.044  13.307  14.872
  386   HG12  VAL  47          HG12      VAL  47  77.805  13.605  13.309
  387   HG13  VAL  47          HG13      VAL  47  78.064  14.728  14.645
  388   HG21  VAL  47          HG21      VAL  47  79.921  12.102  16.665
  389   HG22  VAL  47          HG22      VAL  47  78.239  12.626  16.748
  390   HG23  VAL  47          HG23      VAL  47  79.534  13.822  16.712
  391    H    GLN  48           HN       GLN  48  79.528   8.968  14.623
  392    HA   GLN  48           HA       GLN  48  82.173   9.039  15.628
  393    HB2  GLN  48           HB2      GLN  48  80.589   6.953  14.133
  394    HB3  GLN  48           HB1      GLN  48  82.274   6.658  14.561
  395    HG2  GLN  48           HG2      GLN  48  80.694   5.806  16.290
  396    HG3  GLN  48           HG1      GLN  48  81.778   7.045  16.924
  397   HE21  GLN  48          HE21      GLN  48  80.833   9.344  16.943
  398   HE22  GLN  48          HE22      GLN  48  79.167   9.510  17.227
  399    H    GLY  49           HN       GLY  49  83.775   7.502  13.962
  400    HA2  GLY  49           HA2      GLY  49  83.970   9.027  11.412
  401    HA3  GLY  49           HA1      GLY  49  85.369   8.989  12.486
  402    H1U  RCY  50           H1U      RCY  50  83.790  -0.920   8.609
  403    H1S  RCY  50           H1S      RCY  50  82.873   1.556  11.644
  404    HB1  RCY  50           HB1      RCY  50  83.295   3.472   9.404
  405    HB2  RCY  50           HB2      RCY  50  82.389   4.981   9.504
  406    HA   RCY  50           HA       RCY  50  84.892   4.474  11.129
  407    HN1  RCY  50           HN1      RCY  50  83.062   6.707  10.968
  408    H    GLY  51           HN       GLY  51  85.516   7.179   9.608
  409    HA2  GLY  51           HA2      GLY  51  86.476   5.877   7.092
  410    HA3  GLY  51           HA1      GLY  51  86.091   7.591   7.220
  411    H    ASP  52           HN       ASP  52  87.894   8.810   7.230
  412    HA   ASP  52           HA       ASP  52  90.032   9.576   7.809
  413    HB2  ASP  52           HB2      ASP  52  90.635   9.195   9.967
  414    HB3  ASP  52           HB1      ASP  52  89.170   8.226  10.082
  415    H    ASP  53           HN       ASP  53  89.254   6.586   6.570
  416    HA   ASP  53           HA       ASP  53  91.333   6.298   4.774
  417    HB2  ASP  53           HB2      ASP  53  92.653   4.403   6.015
  418    HB3  ASP  53           HB1      ASP  53  93.060   6.082   6.361
  419    H    ILE  54           HN       ILE  54  88.508   5.544   5.710
  420    HA   ILE  54           HA       ILE  54  88.479   2.888   4.397
  421    HB   ILE  54           HB       ILE  54  87.353   3.459   7.162
  422   HG12  ILE  54          HG12      ILE  54  89.444   1.534   6.102
  423   HG13  ILE  54          HG11      ILE  54  89.708   2.881   7.211
  424   HG21  ILE  54          HG21      ILE  54  87.131   0.842   5.680
  425   HG22  ILE  54          HG22      ILE  54  85.895   2.088   5.509
  426   HG23  ILE  54          HG23      ILE  54  86.227   1.387   7.093
  427   HD11  ILE  54          HD11      ILE  54  88.030   1.709   8.768
  428   HD12  ILE  54          HD12      ILE  54  89.618   0.960   8.606
  429   HD13  ILE  54          HD13      ILE  54  88.237   0.295   7.734
  430    HA   PRO  55           HA       PRO  55  84.903   4.869   2.586
  431    HB2  PRO  55           HB2      PRO  55  83.599   2.618   1.651
  432    HB3  PRO  55           HB1      PRO  55  84.975   3.378   0.831
  433    HG2  PRO  55           HG2      PRO  55  84.914   0.977   2.579
  434    HG3  PRO  55           HG1      PRO  55  85.869   1.291   1.121
  435    HD2  PRO  55           HD2      PRO  55  86.924   1.467   3.635
  436    HD3  PRO  55           HD1      PRO  55  87.506   2.459   2.278
  437    H    GLY  56           HN       GLY  56  84.861   4.171   5.460
  438    HA2  GLY  56           HA2      GLY  56  82.571   2.775   6.296
  439    HA3  GLY  56           HA1      GLY  56  83.270   4.131   7.181
  440    H    MET  57           HN       MET  57  82.722   5.640   4.448
  441    HA   MET  57           HA       MET  57  80.542   7.165   5.265
  442    HB2  MET  57           HB2      MET  57  80.104   7.285   2.607
  443    HB3  MET  57           HB1      MET  57  81.449   8.119   3.378
  444    HG2  MET  57           HG2      MET  57  82.331   6.893   1.485
  445    HG3  MET  57           HG1      MET  57  82.863   6.073   2.953
  446    HE1  MET  57           HE1      MET  57  80.401   6.523   0.326
  447    HE2  MET  57           HE2      MET  57  79.077   5.729   1.175
  448    HE3  MET  57           HE3      MET  57  79.850   4.924  -0.189
  449    H    GLU  58           HN       GLU  58  78.385   6.792   5.482
  450    HA   GLU  58           HA       GLU  58  77.339   4.201   4.414
  451    HB2  GLU  58           HB2      GLU  58  77.354   4.988   6.990
  452    HB3  GLU  58           HB1      GLU  58  75.824   5.709   6.499
  453    HG2  GLU  58           HG2      GLU  58  75.137   3.489   5.561
  454    HG3  GLU  58           HG1      GLU  58  76.620   2.797   6.220
  455    H    GLY  59           HN       GLY  59  75.553   7.103   5.466
  456    HA2  GLY  59           HA2      GLY  59  74.899   8.229   3.004
  457    HA3  GLY  59           HA1      GLY  59  73.769   6.888   3.194
  458    H1U  RCY  60           H1U      RCY  60  72.529   6.201   6.163
  459    H1S  RCY  60           H1S      RCY  60  73.918   9.708   3.429
  460    HB1  RCY  60           HB1      RCY  60  71.088  11.818   5.242
  461    HB2  RCY  60           HB2      RCY  60  71.146  11.302   3.556
  462    HA   RCY  60           HA       RCY  60  71.744   9.636   6.015
  463    HN1  RCY  60           HN1      RCY  60  72.124   8.633   3.233
  464    H    GLY  61           HN       GLY  61  70.555   7.344   4.949
  465    HA2  GLY  61           HA2      GLY  61  68.257   6.622   5.323
  466    HA3  GLY  61           HA1      GLY  61  67.709   8.218   4.806
  467    H    THR  62           HN       THR  62  69.870   7.908   2.576
  468    HA   THR  62           HA       THR  62  68.007   6.633   0.657
  469    HB   THR  62           HB       THR  62  68.770   8.599  -0.306
  470    HG1  THR  62           HG1      THR  62  69.495   7.515  -1.939
  471   HG21  THR  62          HG21      THR  62  70.243   9.325   1.444
  472   HG22  THR  62          HG22      THR  62  71.180   9.349  -0.050
  473   HG23  THR  62          HG23      THR  62  71.388   8.029   1.100
  474    H    ASP  63           HN       ASP  63  71.377   6.309   1.780
  475    HA   ASP  63           HA       ASP  63  71.990   4.072   0.082
  476    HB2  ASP  63           HB2      ASP  63  73.669   5.532   1.309
  477    HB3  ASP  63           HB1      ASP  63  73.229   4.664   2.780
  478    H    ILE  64           HN       ILE  64  69.654   3.213   0.713
  479    HA   ILE  64           HA       ILE  64  70.052   0.808   2.250
  480    HB   ILE  64           HB       ILE  64  69.709   2.843   3.934
  481   HG12  ILE  64          HG12      ILE  64  68.120   0.277   4.233
  482   HG13  ILE  64          HG11      ILE  64  69.865   0.386   4.468
  483   HG21  ILE  64          HG21      ILE  64  67.550   3.428   2.645
  484   HG22  ILE  64          HG22      ILE  64  67.448   3.376   4.405
  485   HG23  ILE  64          HG23      ILE  64  66.844   2.025   3.447
  486   HD11  ILE  64          HD11      ILE  64  68.619   0.567   6.615
  487   HD12  ILE  64          HD12      ILE  64  67.809   2.007   5.998
  488   HD13  ILE  64          HD13      ILE  64  69.552   2.021   6.262
  489    H    THR  65           HN       THR  65  68.418   2.778   0.131
  490    HA   THR  65           HA       THR  65  66.546   0.634  -0.585
  491    HB   THR  65           HB       THR  65  65.580   3.362   0.336
  492    HG1  THR  65           HG1      THR  65  65.105   2.304   2.064
  493   HG21  THR  65          HG21      THR  65  64.326   2.856  -1.625
  494   HG22  THR  65          HG22      THR  65  63.308   2.355  -0.275
  495   HG23  THR  65          HG23      THR  65  64.206   1.150  -1.197
  496    H    VAL  66           HN       VAL  66  68.113   3.682  -1.102
  497    HA   VAL  66           HA       VAL  66  67.238   3.735  -3.950
  498    HB   VAL  66           HB       VAL  66  68.886   5.829  -2.520
  499   HG11  VAL  66          HG11      VAL  66  67.014   5.918  -4.907
  500   HG12  VAL  66          HG12      VAL  66  68.776   5.920  -4.988
  501   HG13  VAL  66          HG13      VAL  66  67.925   7.285  -4.264
  502   HG21  VAL  66          HG21      VAL  66  66.704   7.011  -2.153
  503   HG22  VAL  66          HG22      VAL  66  66.857   5.533  -1.204
  504   HG23  VAL  66          HG23      VAL  66  65.868   5.545  -2.664
  505    H    ILE  67           HN       ILE  67  70.197   3.858  -1.916
  506    HA   ILE  67           HA       ILE  67  71.650   2.606  -4.215
  507    HB   ILE  67           HB       ILE  67  72.671   4.913  -2.534
  508   HG12  ILE  67          HG12      ILE  67  72.111   4.768  -5.510
  509   HG13  ILE  67          HG11      ILE  67  70.991   5.464  -4.338
  510   HG21  ILE  67          HG21      ILE  67  74.594   4.772  -4.187
  511   HG22  ILE  67          HG22      ILE  67  73.946   3.211  -4.690
  512   HG23  ILE  67          HG23      ILE  67  74.505   3.442  -3.033
  513   HD11  ILE  67          HD11      ILE  67  72.476   7.165  -5.447
  514   HD12  ILE  67          HD12      ILE  67  73.859   6.381  -4.683
  515   HD13  ILE  67          HD13      ILE  67  72.616   7.140  -3.689
  516    H1U  RCY  68           H1U      RCY  68  73.616  -1.473   5.567
  517    H1S  RCY  68           H1S      RCY  68  70.784  -1.946   2.198
  518    HB1  RCY  68           HB1      RCY  68  72.389  -2.064  -0.900
  519    HB2  RCY  68           HB2      RCY  68  71.237  -1.358  -2.033
  520    HA   RCY  68           HA       RCY  68  72.896   0.524  -0.411
  521    HN1  RCY  68           HN1      RCY  68  71.608   0.591  -3.082
  522    HA   PRO  69           HA       PRO  69  76.904  -0.483  -1.945
  523    HB2  PRO  69           HB2      PRO  69  77.563  -2.567  -0.172
  524    HB3  PRO  69           HB1      PRO  69  77.830  -0.838   0.109
  525    HG2  PRO  69           HG2      PRO  69  75.688  -2.609   1.114
  526    HG3  PRO  69           HG1      PRO  69  76.430  -1.187   1.864
  527    HD2  PRO  69           HD2      PRO  69  73.938  -1.125   0.760
  528    HD3  PRO  69           HD1      PRO  69  75.010   0.294   0.781
  529    H    TRP  70           HN       TRP  70  74.332  -2.657  -2.049
  530    HA   TRP  70           HA       TRP  70  75.795  -4.921  -3.182
  531    HD1  TRP  70           HD1      TRP  70  74.402  -6.698  -5.113
  532    HE1  TRP  70           HE1      TRP  70  72.588  -6.967  -6.922
  533    HE3  TRP  70           HE3      TRP  70  70.754  -3.711  -3.153
  534    HZ2  TRP  70           HZ2      TRP  70  69.934  -6.037  -7.468
  535    HZ3  TRP  70           HZ3      TRP  70  68.599  -3.420  -4.334
  536    HH2  TRP  70           HH2      TRP  70  68.182  -4.576  -6.486
  537    HB2  TRP  70           HB2      TRP  70  73.886  -5.842  -2.350
  538    HB3  TRP  70           HB1      TRP  70  73.032  -4.303  -2.384
  539    H    GLU  71           HN       GLU  71  74.253  -2.016  -4.374
  540    HA   GLU  71           HA       GLU  71  74.115  -2.979  -7.136
  541    HB2  GLU  71           HB2      GLU  71  73.716  -0.269  -5.852
  542    HB3  GLU  71           HB1      GLU  71  73.617  -0.519  -7.596
  543    HG2  GLU  71           HG2      GLU  71  71.856  -2.229  -7.236
  544    HG3  GLU  71           HG1      GLU  71  71.930  -1.921  -5.500
  545    H    ALA  72           HN       ALA  72  76.300  -0.995  -5.193
  546    HA   ALA  72           HA       ALA  72  77.949  -0.112  -7.389
  547    HB1  ALA  72           HB1      ALA  72  77.947   0.919  -5.094
  548    HB2  ALA  72           HB2      ALA  72  79.561   0.514  -5.677
  549    HB3  ALA  72           HB3      ALA  72  78.765  -0.524  -4.495
  550    H1U  RCY  73           H1U      RCY  73  77.283  -1.396  -2.598
  551    H1S  RCY  73           H1S      RCY  73  80.614  -0.095  -4.469
  552    HB1  RCY  73           HB1      RCY  73  83.024  -2.636  -6.989
  553    HB2  RCY  73           HB2      RCY  73  82.760  -3.694  -5.604
  554    HA   RCY  73           HA       RCY  73  80.979  -3.359  -7.686
  555    HN1  RCY  73           HN1      RCY  73  80.491  -1.105  -6.019
  556    H    ASN  74           HN       ASN  74  79.006  -4.595  -7.268
  557    HA   ASN  74           HA       ASN  74  77.916  -5.643  -5.033
  558    HB2  ASN  74           HB2      ASN  74  77.658  -6.312  -7.587
  559    HB3  ASN  74           HB1      ASN  74  78.672  -7.671  -7.105
  560   HD21  ASN  74          HD21      ASN  74  75.903  -7.998  -7.875
  561   HD22  ASN  74          HD22      ASN  74  75.044  -8.525  -6.509
  562    H    HIS  75           HN       HIS  75  81.104  -6.592  -6.261
  563    HA   HIS  75           HA       HIS  75  82.748  -7.965  -5.285
  564    HD1  HIS  75           HD1      HIS  75  81.900  -8.092  -0.766
  565    HD2  HIS  75           HD2      HIS  75  84.857  -8.607  -3.662
  566    HE1  HIS  75           HE1      HIS  75  83.626  -9.647   0.243
  567    HE2  HIS  75           HE2      HIS  75  85.432  -9.969  -1.510
  568    HB2  HIS  75           HB2      HIS  75  82.833  -6.224  -3.611
  569    HB3  HIS  75           HB1      HIS  75  81.369  -6.825  -2.835
  570    H1U  RCY  76           H1U      RCY  76  75.798  -5.139  -0.930
  571    H1S  RCY  76           H1S      RCY  76  78.867  -7.684  -1.686
  572    HB1  RCY  76           HB1      RCY  76  77.616 -11.470  -3.720
  573    HB2  RCY  76           HB2      RCY  76  77.510  -9.833  -4.368
  574    HA   RCY  76           HA       RCY  76  80.083 -11.416  -4.084
  575    HN1  RCY  76           HN1      RCY  76  79.673  -8.805  -5.487
  576    H    GLU  77           HN       GLU  77  77.676 -10.052  -6.361
  577    HA   GLU  77           HA       GLU  77  77.637 -12.521  -7.897
  578    HB2  GLU  77           HB2      GLU  77  75.630 -11.161  -7.829
  579    HB3  GLU  77           HB1      GLU  77  76.501  -9.766  -8.462
  580    HG2  GLU  77           HG2      GLU  77  75.134 -11.013 -10.188
  581    HG3  GLU  77           HG1      GLU  77  76.843 -10.851 -10.590
  582    H    LEU  78           HN       LEU  78  79.687  -9.809  -7.828
  583    HA   LEU  78           HA       LEU  78  80.926 -10.694 -10.389
  584    HG   LEU  78           HG       LEU  78  80.911  -7.596 -12.180
  585    HB2  LEU  78           HB2      LEU  78  79.470  -8.424 -10.318
  586    HB3  LEU  78           HB1      LEU  78  80.996  -7.772  -9.742
  587   HD11  LEU  78          HD11      LEU  78  82.748  -9.855 -11.328
  588   HD12  LEU  78          HD12      LEU  78  83.082  -8.141 -11.085
  589   HD13  LEU  78          HD13      LEU  78  82.974  -8.795 -12.719
  590   HD21  LEU  78          HD21      LEU  78  79.421  -9.883 -12.083
  591   HD22  LEU  78          HD22      LEU  78  80.978 -10.525 -12.607
  592   HD23  LEU  78          HD23      LEU  78  80.179  -9.269 -13.552
  593    H    HIS  79           HN       HIS  79  82.544  -7.993  -9.417
  594    HA   HIS  79           HA       HIS  79  83.975  -8.826  -7.096
  595    HD1  HIS  79           HD1      HIS  79  87.513  -8.700  -9.836
  596    HD2  HIS  79           HD2      HIS  79  86.479  -9.930  -5.987
  597    HE1  HIS  79           HE1      HIS  79  89.589  -8.416  -8.413
  598    HE2  HIS  79           HE2      HIS  79  88.973  -9.161  -6.067
  599    HB2  HIS  79           HB2      HIS  79  84.830 -10.675  -8.388
  600    HB3  HIS  79           HB1      HIS  79  85.193  -9.625  -9.756
  601    H    GLU  80           HN       GLU  80  86.051  -7.509  -6.871
  602    HA   GLU  80           HA       GLU  80  86.637  -5.380  -8.703
  603    HB2  GLU  80           HB2      GLU  80  84.312  -4.783  -7.577
  604    HB3  GLU  80           HB1      GLU  80  85.329  -4.305  -6.219
  605    HG2  GLU  80           HG2      GLU  80  85.259  -2.316  -7.421
  606    HG3  GLU  80           HG1      GLU  80  86.710  -3.055  -8.100
  607    H    LEU  81           HN       LEU  81  87.216  -3.514  -6.386
  608    HA   LEU  81           HA       LEU  81  89.764  -4.789  -5.620
  609    HG   LEU  81           HG       LEU  81  90.601  -1.460  -6.704
  610    HB2  LEU  81           HB2      LEU  81  88.627  -2.020  -5.523
  611    HB3  LEU  81           HB1      LEU  81  89.916  -2.418  -4.393
  612   HD11  LEU  81          HD11      LEU  81  92.422  -3.384  -6.844
  613   HD12  LEU  81          HD12      LEU  81  91.692  -3.882  -5.318
  614   HD13  LEU  81          HD13      LEU  81  92.395  -2.272  -5.475
  615   HD21  LEU  81          HD21      LEU  81  90.505  -2.863  -8.575
  616   HD22  LEU  81          HD22      LEU  81  88.968  -3.212  -7.785
  617   HD23  LEU  81          HD23      LEU  81  90.328  -4.319  -7.596
  618    H    ALA  82           HN       ALA  82  86.773  -5.110  -4.467
  619    HA   ALA  82           HA       ALA  82  87.051  -4.548  -1.643
  620    HB1  ALA  82           HB1      ALA  82  85.205  -6.302  -3.269
  621    HB2  ALA  82           HB2      ALA  82  84.828  -4.806  -2.418
  622    HB3  ALA  82           HB3      ALA  82  85.137  -6.284  -1.507
  623    H    GLN  83           HN       GLN  83  89.391  -5.890  -2.591
  624    HA   GLN  83           HA       GLN  83  89.333  -8.700  -1.957
  625    HB2  GLN  83           HB2      GLN  83  91.850  -8.342  -1.648
  626    HB3  GLN  83           HB1      GLN  83  91.206  -7.896  -3.228
  627    HG2  GLN  83           HG2      GLN  83  91.303  -5.592  -2.755
  628    HG3  GLN  83           HG1      GLN  83  91.393  -5.860  -1.014
  629   HE21  GLN  83          HE21      GLN  83  93.360  -4.227  -1.993
  630   HE22  GLN  83          HE22      GLN  83  94.845  -5.043  -2.092
  631    H    TYR  84           HN       TYR  84  87.852  -7.950   0.020
  632    HA   TYR  84           HA       TYR  84  87.655  -8.092   2.350
  633    HD1  TYR  84           HD1      TYR  84  87.795 -10.094   1.209
  634    HD2  TYR  84           HD2      TYR  84  92.022  -9.986   1.966
  635    HE1  TYR  84           HE1      TYR  84  88.115 -12.033  -0.303
  636    HE2  TYR  84           HE2      TYR  84  92.342 -11.925   0.453
  637    HH   TYR  84           HH       TYR  84  91.366 -13.380  -0.899
  638    HB2  TYR  84           HB2      TYR  84  90.629  -8.207   2.720
  639    HB3  TYR  84           HB1      TYR  84  89.359  -9.083   3.571
  640    H    GLY  85           HN       GLY  85  87.172  -5.715   1.733
  641    HA2  GLY  85           HA2      GLY  85  89.154  -3.690   2.287
  642    HA3  GLY  85           HA1      GLY  85  87.406  -3.423   2.239
  643    H    ILE  86           HN       ILE  86  87.299  -5.796   4.185
  644    HA   ILE  86           HA       ILE  86  87.135  -6.106   6.502
  645    HB   ILE  86           HB       ILE  86  89.231  -3.952   6.838
  646   HG12  ILE  86          HG12      ILE  86  90.417  -6.544   6.695
  647   HG13  ILE  86          HG11      ILE  86  89.436  -6.327   5.245
  648   HG21  ILE  86          HG21      ILE  86  89.815  -5.180   8.805
  649   HG22  ILE  86          HG22      ILE  86  88.855  -6.572   8.305
  650   HG23  ILE  86          HG23      ILE  86  88.054  -5.083   8.806
  651   HD11  ILE  86          HD11      ILE  86  91.358  -4.209   6.225
  652   HD12  ILE  86          HD12      ILE  86  90.593  -4.330   4.641
  653   HD13  ILE  86          HD13      ILE  86  91.846  -5.481   5.105
  654    H1U  RCY  87           H1U      RCY  87  80.136  -1.766   4.511
  655    H1S  RCY  87           H1S      RCY  87  82.968  -2.415   7.370
  656    HB1  RCY  87           HB1      RCY  87  84.489  -3.415  10.564
  657    HB2  RCY  87           HB2      RCY  87  84.561  -4.936   9.677
  658    HA   RCY  87           HA       RCY  87  84.539  -2.806   7.764
  659    HN1  RCY  87           HN1      RCY  87  86.276  -5.066   8.425
  Start of MODEL   79
    1    HA   MET   1           HA       MET   1  81.361  -6.008  22.586
    2    HB2  MET   1           HB2      MET   1  79.445  -4.905  20.518
    3    HB3  MET   1           HB1      MET   1  80.620  -4.012  21.483
    4    HG2  MET   1           HG2      MET   1  82.456  -5.245  20.355
    5    HG3  MET   1           HG1      MET   1  81.264  -6.075  19.355
    6    HE1  MET   1           HE1      MET   1  83.483  -4.852  18.018
    7    HE2  MET   1           HE2      MET   1  83.828  -3.522  19.121
    8    HE3  MET   1           HE3      MET   1  83.401  -3.180  17.446
    9    H    ASN   2           HN       ASN   2  80.339  -6.090  24.531
   10    HA   ASN   2           HA       ASN   2  77.635  -6.855  24.940
   11    HB2  ASN   2           HB2      ASN   2  77.918  -6.043  27.218
   12    HB3  ASN   2           HB1      ASN   2  79.411  -6.832  26.707
   13   HD21  ASN   2          HD21      ASN   2  80.272  -4.584  24.972
   14   HD22  ASN   2          HD22      ASN   2  80.745  -3.333  26.017
   15    H    LEU   3           HN       LEU   3  75.878  -5.419  25.810
   16    HA   LEU   3           HA       LEU   3  75.579  -3.079  24.075
   17    HG   LEU   3           HG       LEU   3  72.415  -4.946  24.231
   18    HB2  LEU   3           HB2      LEU   3  73.795  -4.363  26.159
   19    HB3  LEU   3           HB1      LEU   3  73.344  -2.896  25.294
   20   HD11  LEU   3          HD11      LEU   3  73.385  -2.788  22.979
   21   HD12  LEU   3          HD12      LEU   3  72.734  -4.162  22.088
   22   HD13  LEU   3          HD13      LEU   3  74.477  -3.990  22.289
   23   HD21  LEU   3          HD21      LEU   3  75.228  -5.662  23.415
   24   HD22  LEU   3          HD22      LEU   3  73.776  -6.660  23.371
   25   HD23  LEU   3          HD23      LEU   3  74.542  -6.290  24.914
   26    H    GLU   4           HN       GLU   4  77.570  -2.102  25.253
   27    HA   GLU   4           HA       GLU   4  77.030  -1.013  27.919
   28    HB2  GLU   4           HB2      GLU   4  79.225   0.223  27.465
   29    HB3  GLU   4           HB1      GLU   4  79.320  -1.538  27.481
   30    HG2  GLU   4           HG2      GLU   4  79.258  -1.620  25.056
   31    HG3  GLU   4           HG1      GLU   4  78.976   0.119  24.967
   32    HA   PRO   5           HA       PRO   5  74.879   2.753  27.109
   33    HB2  PRO   5           HB2      PRO   5  77.369   4.048  28.180
   34    HB3  PRO   5           HB1      PRO   5  75.670   4.392  28.564
   35    HG2  PRO   5           HG2      PRO   5  77.244   2.905  30.166
   36    HG3  PRO   5           HG1      PRO   5  75.501   2.634  30.014
   37    HD2  PRO   5           HD2      PRO   5  77.709   0.925  29.095
   38    HD3  PRO   5           HD1      PRO   5  75.981   0.537  29.246
   39    HA   PRO   6           HA       PRO   6  77.271   3.720  23.312
   40    HB2  PRO   6           HB2      PRO   6  75.239   3.519  21.549
   41    HB3  PRO   6           HB1      PRO   6  76.031   2.081  22.224
   42    HG2  PRO   6           HG2      PRO   6  73.399   3.278  22.893
   43    HG3  PRO   6           HG1      PRO   6  73.900   1.579  22.879
   44    HD2  PRO   6           HD2      PRO   6  73.710   3.235  25.165
   45    HD3  PRO   6           HD1      PRO   6  74.512   1.652  25.085
   46    H    LYS   7           HN       LYS   7  77.230   5.622  21.917
   47    HA   LYS   7           HA       LYS   7  76.094   7.965  23.167
   48    HB2  LYS   7           HB2      LYS   7  77.288   7.626  20.397
   49    HB3  LYS   7           HB1      LYS   7  76.981   9.167  21.197
   50    HG2  LYS   7           HG2      LYS   7  78.776   7.004  22.334
   51    HG3  LYS   7           HG1      LYS   7  79.365   8.370  21.389
   52    HD2  LYS   7           HD2      LYS   7  78.018   9.807  23.135
   53    HD3  LYS   7           HD1      LYS   7  78.140   8.360  24.136
   54    HE2  LYS   7           HE2      LYS   7  80.036   9.750  24.659
   55    HE3  LYS   7           HE1      LYS   7  80.632   8.385  23.714
   56    HZ1  LYS   7           HZ1      LYS   7  79.878  10.975  22.489
   57    HZ2  LYS   7           HZ2      LYS   7  80.760   9.704  21.787
   58    HZ3  LYS   7           HZ3      LYS   7  81.452  10.640  23.024
   59    H    ALA   8           HN       ALA   8  74.106   8.857  22.837
   60    HA   ALA   8           HA       ALA   8  72.003   7.586  21.517
   61    HB1  ALA   8           HB1      ALA   8  72.274  10.598  21.681
   62    HB2  ALA   8           HB2      ALA   8  71.863   9.596  23.073
   63    HB3  ALA   8           HB3      ALA   8  70.787   9.650  21.676
   64    H    GLU   9           HN       GLU   9  74.635   9.332  20.124
   65    HA   GLU   9           HA       GLU   9  75.062  10.033  17.919
   66    HB2  GLU   9           HB2      GLU   9  74.177   7.289  17.987
   67    HB3  GLU   9           HB1      GLU   9  73.623   8.024  16.486
   68    HG2  GLU   9           HG2      GLU   9  75.839   7.095  16.127
   69    HG3  GLU   9           HG1      GLU   9  75.953   8.855  16.093
   70    H1U  RCY  10           H1U      RCY  10  76.267  15.716  12.505
   71    H1S  RCY  10           H1S      RCY  10  74.605  11.309  13.344
   72    HB1  RCY  10           HB1      RCY  10  72.715  13.759  16.135
   73    HB2  RCY  10           HB2      RCY  10  71.187  13.211  15.448
   74    HA   RCY  10           HA       RCY  10  71.486  13.083  18.025
   75    HN1  RCY  10           HN1      RCY  10  73.455  11.844  18.482
   76    H    ARG  11           HN       ARG  11  69.718  12.018  18.907
   77    HA   ARG  11           HA       ARG  11  68.482   9.670  18.497
   78    HE   ARG  11           HE       ARG  11  65.562   9.854  20.058
   79    HB2  ARG  11           HB2      ARG  11  67.036  12.332  18.353
   80    HB3  ARG  11           HB1      ARG  11  66.270  10.784  18.702
   81    HG2  ARG  11           HG2      ARG  11  68.555  11.903  20.347
   82    HG3  ARG  11           HG1      ARG  11  66.861  12.187  20.742
   83    HD2  ARG  11           HD2      ARG  11  68.386   9.586  20.763
   84    HD3  ARG  11           HD1      ARG  11  67.409  10.303  22.042
   85   HH11  ARG  11          HH21      ARG  11  68.020   7.978  21.583
   86   HH12  ARG  11          HH22      ARG  11  67.182   6.475  21.384
   87   HH21  ARG  11          HH11      ARG  11  64.454   7.903  19.789
   88   HH22  ARG  11          HH12      ARG  11  65.163   6.432  20.369
   89    H    SER  12           HN       SER  12  66.810  12.094  16.569
   90    HA   SER  12           HA       SER  12  66.139  12.056  14.316
   91    HG   SER  12           HG       SER  12  68.394  12.199  12.233
   92    HB2  SER  12           HB2      SER  12  68.764  11.598  14.192
   93    HB3  SER  12           HB1      SER  12  68.217  10.012  13.657
   94    H    ALA  13           HN       ALA  13  65.207  10.025  16.325
   95    HA   ALA  13           HA       ALA  13  64.909   7.465  15.124
   96    HB1  ALA  13           HB1      ALA  13  62.907   8.860  16.926
   97    HB2  ALA  13           HB2      ALA  13  64.352   8.037  17.512
   98    HB3  ALA  13           HB3      ALA  13  63.087   7.122  16.692
   99    H    THR  14           HN       THR  14  61.760   8.311  15.596
  100    HA   THR  14           HA       THR  14  59.957   8.581  14.132
  101    HB   THR  14           HB       THR  14  60.070  10.414  12.673
  102    HG1  THR  14           HG1      THR  14  62.843  10.382  12.442
  103   HG21  THR  14          HG21      THR  14  62.492  11.029  14.354
  104   HG22  THR  14          HG22      THR  14  60.902  10.847  15.096
  105   HG23  THR  14          HG23      THR  14  61.173  12.101  13.886
  106    H    ARG  15           HN       ARG  15  59.295   6.861  12.935
  107    HA   ARG  15           HA       ARG  15  61.085   5.254  11.369
  108    HE   ARG  15           HE       ARG  15  56.194   3.683   9.788
  109    HB2  ARG  15           HB2      ARG  15  58.946   4.418  12.349
  110    HB3  ARG  15           HB1      ARG  15  58.062   5.404  11.183
  111    HG2  ARG  15           HG2      ARG  15  59.067   4.187   9.325
  112    HG3  ARG  15           HG1      ARG  15  60.074   3.262  10.438
  113    HD2  ARG  15           HD2      ARG  15  57.975   2.076   9.621
  114    HD3  ARG  15           HD1      ARG  15  58.173   2.141  11.370
  115   HH11  ARG  15          HH21      ARG  15  57.719   2.936  12.798
  116   HH12  ARG  15          HH22      ARG  15  56.453   3.627  13.756
  117   HH21  ARG  15          HH11      ARG  15  54.543   4.586  11.029
  118   HH22  ARG  15          HH12      ARG  15  54.659   4.559  12.757
  119    H    VAL  16           HN       VAL  16  58.322   7.232  10.216
  120    HA   VAL  16           HA       VAL  16  57.969   8.180   8.090
  121    HB   VAL  16           HB       VAL  16  60.881   8.908   8.037
  122   HG11  VAL  16          HG11      VAL  16  58.944   9.737   6.473
  123   HG12  VAL  16          HG12      VAL  16  60.099  10.912   7.103
  124   HG13  VAL  16          HG13      VAL  16  58.507  10.753   7.847
  125   HG21  VAL  16          HG21      VAL  16  60.329  10.701   9.752
  126   HG22  VAL  16          HG22      VAL  16  60.440   9.063  10.397
  127   HG23  VAL  16          HG23      VAL  16  58.860   9.795  10.113
  128    H    MET  17           HN       MET  17  60.036   8.502   6.032
  129    HA   MET  17           HA       MET  17  60.327   7.226   4.027
  130    HB2  MET  17           HB2      MET  17  62.282   5.573   4.554
  131    HB3  MET  17           HB1      MET  17  62.543   7.302   4.778
  132    HG2  MET  17           HG2      MET  17  62.150   7.122   7.158
  133    HG3  MET  17           HG1      MET  17  61.658   5.436   6.994
  134    HE1  MET  17           HE1      MET  17  64.678   3.397   6.481
  135    HE2  MET  17           HE2      MET  17  63.057   3.698   5.860
  136    HE3  MET  17           HE3      MET  17  63.313   3.550   7.596
  137    H    GLY  18           HN       GLY  18  58.397   6.065   3.627
  138    HA2  GLY  18           HA2      GLY  18  58.603   3.168   4.163
  139    HA3  GLY  18           HA1      GLY  18  57.173   3.974   4.810
  140    H    GLY  19           HN       GLY  19  55.668   4.934   3.298
  141    HA2  GLY  19           HA2      GLY  19  55.126   3.393   0.994
  142    HA3  GLY  19           HA1      GLY  19  54.465   5.003   1.282
  143    HA   PRO  20           HA       PRO  20  57.285   4.872  -2.558
  144    HB2  PRO  20           HB2      PRO  20  55.076   6.736  -3.336
  145    HB3  PRO  20           HB1      PRO  20  55.898   5.495  -4.303
  146    HG2  PRO  20           HG2      PRO  20  53.450   5.101  -3.327
  147    HG3  PRO  20           HG1      PRO  20  54.633   3.786  -3.434
  148    HD2  PRO  20           HD2      PRO  20  53.674   5.257  -1.022
  149    HD3  PRO  20           HD1      PRO  20  54.266   3.587  -1.166
  150    H1U  RCY  21           H1U      RCY  21  65.559   9.756   1.000
  151    H1S  RCY  21           H1S      RCY  21  62.389   6.227   0.174
  152    HB1  RCY  21           HB1      RCY  21  59.565   7.885  -0.108
  153    HB2  RCY  21           HB2      RCY  21  60.538   9.211  -0.745
  154    HA   RCY  21           HA       RCY  21  58.372   9.184  -1.873
  155    HN1  RCY  21           HN1      RCY  21  58.860   6.425  -2.889
  156    H    THR  22           HN       THR  22  60.072  10.714  -2.716
  157    HA   THR  22           HA       THR  22  60.827   9.929  -5.490
  158    HB   THR  22           HB       THR  22  61.020  12.336  -5.906
  159    HG1  THR  22           HG1      THR  22  61.718  13.171  -4.032
  160   HG21  THR  22          HG21      THR  22  58.639  12.982  -5.336
  161   HG22  THR  22          HG22      THR  22  58.518  11.464  -4.445
  162   HG23  THR  22          HG23      THR  22  58.807  11.445  -6.185
  163    HA   PRO  23           HA       PRO  23  64.963   9.307  -3.653
  164    HB2  PRO  23           HB2      PRO  23  65.600   9.323  -6.580
  165    HB3  PRO  23           HB1      PRO  23  66.125   8.192  -5.317
  166    HG2  PRO  23           HG2      PRO  23  64.219   7.542  -7.061
  167    HG3  PRO  23           HG1      PRO  23  64.162   7.003  -5.373
  168    HD2  PRO  23           HD2      PRO  23  62.520   9.081  -6.736
  169    HD3  PRO  23           HD1      PRO  23  62.118   8.058  -5.339
  170    H    ARG  24           HN       ARG  24  66.809  10.663  -3.431
  171    HA   ARG  24           HA       ARG  24  66.415  13.431  -4.419
  172    HE   ARG  24           HE       ARG  24  69.210  13.764  -0.457
  173    HB2  ARG  24           HB2      ARG  24  66.888  13.090  -2.022
  174    HB3  ARG  24           HB1      ARG  24  68.403  12.289  -2.432
  175    HG2  ARG  24           HG2      ARG  24  68.317  14.822  -3.799
  176    HG3  ARG  24           HG1      ARG  24  67.940  15.090  -2.098
  177    HD2  ARG  24           HD2      ARG  24  70.329  13.507  -3.088
  178    HD3  ARG  24           HD1      ARG  24  70.391  15.194  -2.578
  179   HH11  ARG  24          HH21      ARG  24  72.156  13.869  -2.245
  180   HH12  ARG  24          HH22      ARG  24  73.135  13.335  -0.919
  181   HH21  ARG  24          HH11      ARG  24  70.471  13.066   1.285
  182   HH22  ARG  24          HH12      ARG  24  72.180  12.881   1.079
  183    H    LYS  25           HN       LYS  25  67.809  14.407  -5.872
  184    HA   LYS  25           HA       LYS  25  69.592  12.659  -7.392
  185    HB2  LYS  25           HB2      LYS  25  70.059  14.801  -8.673
  186    HB3  LYS  25           HB1      LYS  25  68.365  14.308  -8.642
  187    HG2  LYS  25           HG2      LYS  25  67.825  15.924  -6.967
  188    HG3  LYS  25           HG1      LYS  25  69.526  16.245  -6.630
  189    HD2  LYS  25           HD2      LYS  25  69.838  17.352  -8.716
  190    HD3  LYS  25           HD1      LYS  25  68.306  16.747  -9.349
  191    HE2  LYS  25           HE2      LYS  25  67.064  18.105  -7.743
  192    HE3  LYS  25           HE1      LYS  25  68.569  18.651  -7.003
  193    HZ1  LYS  25           HZ1      LYS  25  67.261  19.884  -9.041
  194    HZ2  LYS  25           HZ2      LYS  25  68.511  19.055  -9.839
  195    HZ3  LYS  25           HZ3      LYS  25  68.875  20.154  -8.595
  196    H    GLY  26           HN       GLY  26  71.891  13.408  -7.841
  197    HA2  GLY  26           HA2      GLY  26  73.165  15.064  -5.788
  198    HA3  GLY  26           HA1      GLY  26  73.545  13.347  -5.657
  199    HA   PRO  27           HA       PRO  27  76.771  15.380  -8.374
  200    HB2  PRO  27           HB2      PRO  27  78.141  12.930  -7.333
  201    HB3  PRO  27           HB1      PRO  27  78.765  14.582  -7.501
  202    HG2  PRO  27           HG2      PRO  27  78.069  13.603  -5.127
  203    HG3  PRO  27           HG1      PRO  27  77.781  15.299  -5.552
  204    HD2  PRO  27           HD2      PRO  27  75.822  13.057  -5.335
  205    HD3  PRO  27           HD1      PRO  27  75.587  14.794  -5.041
  206    HA   PRO  28           HA       PRO  28  76.261  13.119 -12.139
  207    HB2  PRO  28           HB2      PRO  28  79.205  12.544 -11.989
  208    HB3  PRO  28           HB1      PRO  28  78.242  13.127 -13.361
  209    HG2  PRO  28           HG2      PRO  28  79.765  14.774 -11.896
  210    HG3  PRO  28           HG1      PRO  28  78.228  15.291 -12.609
  211    HD2  PRO  28           HD2      PRO  28  78.889  14.816  -9.766
  212    HD3  PRO  28           HD1      PRO  28  77.556  15.756 -10.469
  213    H    LYS  29           HN       LYS  29  75.556  11.037 -12.452
  214    HA   LYS  29           HA       LYS  29  76.279   8.986 -10.482
  215    HB2  LYS  29           HB2      LYS  29  74.697   7.602 -12.071
  216    HB3  LYS  29           HB1      LYS  29  74.012   8.843 -11.023
  217    HG2  LYS  29           HG2      LYS  29  73.167   8.988 -13.368
  218    HG3  LYS  29           HG1      LYS  29  74.006  10.451 -12.856
  219    HD2  LYS  29           HD2      LYS  29  75.950   9.905 -14.108
  220    HD3  LYS  29           HD1      LYS  29  75.437   8.229 -14.322
  221    HE2  LYS  29           HE2      LYS  29  75.130   9.963 -16.289
  222    HE3  LYS  29           HE1      LYS  29  73.870   8.774 -15.955
  223    HZ1  LYS  29           HZ1      LYS  29  73.935  11.641 -15.270
  224    HZ2  LYS  29           HZ2      LYS  29  72.951  10.566 -14.396
  225    HZ3  LYS  29           HZ3      LYS  29  72.722  10.764 -16.068
  226    H1U  RCY  30           H1U      RCY  30  71.599   2.644 -15.934
  227    H1S  RCY  30           H1S      RCY  30  80.749   2.479 -11.365
  228    HB1  RCY  30           HB1      RCY  30  78.260   4.667 -11.747
  229    HB2  RCY  30           HB2      RCY  30  79.310   6.046 -11.420
  230    HA   RCY  30           HA       RCY  30  78.683   6.952 -13.693
  231    HN1  RCY  30           HN1      RCY  30  76.410   6.648 -11.766
  232    H    LYS  31           HN       LYS  31  75.802   5.138 -12.789
  233    HA   LYS  31           HA       LYS  31  74.473   3.644 -13.993
  234    HB2  LYS  31           HB2      LYS  31  73.689   4.936 -15.662
  235    HB3  LYS  31           HB1      LYS  31  75.183   5.855 -15.703
  236    HG2  LYS  31           HG2      LYS  31  75.078   3.154 -17.041
  237    HG3  LYS  31           HG1      LYS  31  74.363   4.544 -17.841
  238    HD2  LYS  31           HD2      LYS  31  76.727   5.650 -17.163
  239    HD3  LYS  31           HD1      LYS  31  77.235   3.966 -17.278
  240    HE2  LYS  31           HE2      LYS  31  77.526   4.911 -19.460
  241    HE3  LYS  31           HE1      LYS  31  76.082   3.901 -19.547
  242    HZ1  LYS  31           HZ1      LYS  31  75.022   5.696 -20.266
  243    HZ2  LYS  31           HZ2      LYS  31  76.340   6.711 -19.918
  244    HZ3  LYS  31           HZ3      LYS  31  75.193   6.360 -18.715
  245    H    GLN  32           HN       GLN  32  74.594   1.630 -15.088
  246    HA   GLN  32           HA       GLN  32  76.758   0.705 -16.659
  247    HB2  GLN  32           HB2      GLN  32  77.435   0.984 -13.885
  248    HB3  GLN  32           HB1      GLN  32  77.362  -0.737 -14.251
  249    HG2  GLN  32           HG2      GLN  32  78.926  -0.472 -16.087
  250    HG3  GLN  32           HG1      GLN  32  78.907   1.283 -15.901
  251   HE21  GLN  32          HE21      GLN  32  81.155   1.487 -15.314
  252   HE22  GLN  32          HE22      GLN  32  81.773   0.869 -13.859
  253    H    ARG  33           HN       ARG  33  73.791   0.394 -15.460
  254    HA   ARG  33           HA       ARG  33  72.204  -1.340 -15.391
  255    HE   ARG  33           HE       ARG  33  71.043  -0.297 -20.445
  256    HB2  ARG  33           HB2      ARG  33  74.165  -2.663 -17.293
  257    HB3  ARG  33           HB1      ARG  33  72.456  -3.056 -17.115
  258    HG2  ARG  33           HG2      ARG  33  72.866  -0.200 -17.618
  259    HG3  ARG  33           HG1      ARG  33  73.537  -1.197 -18.907
  260    HD2  ARG  33           HD2      ARG  33  71.421  -2.304 -19.252
  261    HD3  ARG  33           HD1      ARG  33  70.730  -1.540 -17.820
  262   HH11  ARG  33          HH21      ARG  33  70.806   0.131 -17.032
  263   HH12  ARG  33          HH22      ARG  33  70.200   1.749 -17.143
  264   HH21  ARG  33          HH11      ARG  33  70.253   1.815 -20.609
  265   HH22  ARG  33          HH12      ARG  33  69.887   2.703 -19.168
  266    H    GLN  34           HN       GLN  34  72.488  -2.019 -13.225
  267    HA   GLN  34           HA       GLN  34  74.643  -3.745 -12.389
  268    HB2  GLN  34           HB2      GLN  34  71.986  -2.966 -11.191
  269    HB3  GLN  34           HB1      GLN  34  73.006  -4.180 -10.420
  270    HG2  GLN  34           HG2      GLN  34  74.852  -2.597 -10.264
  271    HG3  GLN  34           HG1      GLN  34  73.927  -1.386 -11.153
  272   HE21  GLN  34          HE21      GLN  34  73.201  -3.546  -8.340
  273   HE22  GLN  34          HE22      GLN  34  72.572  -2.303  -7.370
  274    H    THR  35           HN       THR  35  71.953  -4.349 -14.321
  275    HA   THR  35           HA       THR  35  71.038  -6.339 -15.141
  276    HB   THR  35           HB       THR  35  73.763  -6.867 -14.587
  277    HG1  THR  35           HG1      THR  35  73.312  -8.556 -16.152
  278   HG21  THR  35          HG21      THR  35  72.947  -8.297 -12.683
  279   HG22  THR  35          HG22      THR  35  73.807  -9.196 -13.929
  280   HG23  THR  35          HG23      THR  35  72.048  -9.259 -13.857
  281    H    ARG  36           HN       ARG  36  71.274  -5.586 -11.913
  282    HA   ARG  36           HA       ARG  36  70.141  -6.334  -9.999
  283    HE   ARG  36           HE       ARG  36  66.894  -4.003 -13.374
  284    HB2  ARG  36           HB2      ARG  36  68.355  -7.210 -12.265
  285    HB3  ARG  36           HB1      ARG  36  67.934  -7.585 -10.595
  286    HG2  ARG  36           HG2      ARG  36  67.844  -5.278  -9.995
  287    HG3  ARG  36           HG1      ARG  36  68.630  -4.783 -11.493
  288    HD2  ARG  36           HD2      ARG  36  66.053  -6.301 -11.684
  289    HD3  ARG  36           HD1      ARG  36  65.992  -4.604 -11.216
  290   HH11  ARG  36          HH21      ARG  36  66.457  -7.399 -12.886
  291   HH12  ARG  36          HH22      ARG  36  66.577  -7.782 -14.570
  292   HH21  ARG  36          HH11      ARG  36  67.053  -4.499 -15.565
  293   HH22  ARG  36          HH12      ARG  36  66.914  -6.146 -16.082
  294    H    GLN  37           HN       GLN  37  72.288  -8.001 -10.982
  295    HA   GLN  37           HA       GLN  37  71.816 -10.362  -9.421
  296    HB2  GLN  37           HB2      GLN  37  70.966 -10.479 -12.183
  297    HB3  GLN  37           HB1      GLN  37  72.317 -11.585 -11.944
  298    HG2  GLN  37           HG2      GLN  37  69.929 -11.508 -10.083
  299    HG3  GLN  37           HG1      GLN  37  69.998 -12.554 -11.501
  300   HE21  GLN  37          HE21      GLN  37  69.858 -13.717  -8.922
  301   HE22  GLN  37          HE22      GLN  37  71.341 -14.464  -8.570
  302    H1U  RCY  38           H1U      RCY  38  78.730  -5.221  -5.458
  303    H1S  RCY  38           H1S      RCY  38  77.956  -7.783  -7.807
  304    HB1  RCY  38           HB1      RCY  38  77.267 -10.906  -8.756
  305    HB2  RCY  38           HB2      RCY  38  75.649 -10.397  -8.273
  306    HA   RCY  38           HA       RCY  38  76.088 -10.922 -11.176
  307    HN1  RCY  38           HN1      RCY  38  73.733 -11.983  -9.868
  308    H    LYS  39           HN       LYS  39  76.880 -12.844 -11.912
  309    HA   LYS  39           HA       LYS  39  76.347 -15.381 -10.730
  310    HB2  LYS  39           HB2      LYS  39  78.850 -14.828 -12.323
  311    HB3  LYS  39           HB1      LYS  39  77.859 -16.284 -12.308
  312    HG2  LYS  39           HG2      LYS  39  77.085 -13.592 -13.473
  313    HG3  LYS  39           HG1      LYS  39  77.465 -15.052 -14.381
  314    HD2  LYS  39           HD2      LYS  39  75.120 -14.680 -12.490
  315    HD3  LYS  39           HD1      LYS  39  75.040 -14.777 -14.246
  316    HE2  LYS  39           HE2      LYS  39  75.656 -16.958 -12.268
  317    HE3  LYS  39           HE1      LYS  39  74.512 -16.967 -13.608
  318    HZ1  LYS  39           HZ1      LYS  39  76.580 -18.269 -13.994
  319    HZ2  LYS  39           HZ2      LYS  39  77.452 -16.811 -13.968
  320    HZ3  LYS  39           HZ3      LYS  39  76.276 -17.081 -15.164
  321    H    SER  40           HN       SER  40  78.691 -12.929  -9.992
  322    HA   SER  40           HA       SER  40  80.568 -14.591  -8.570
  323    HG   SER  40           HG       SER  40  80.277 -11.675 -10.120
  324    HB2  SER  40           HB2      SER  40  79.973 -11.684  -7.980
  325    HB3  SER  40           HB1      SER  40  81.487 -12.549  -7.731
  326    H    LYS  41           HN       LYS  41  79.534 -15.943  -7.095
  327    HA   LYS  41           HA       LYS  41  77.351 -15.367  -5.450
  328    HB2  LYS  41           HB2      LYS  41  79.764 -17.061  -4.736
  329    HB3  LYS  41           HB1      LYS  41  78.180 -17.150  -3.966
  330    HG2  LYS  41           HG2      LYS  41  77.143 -17.949  -5.962
  331    HG3  LYS  41           HG1      LYS  41  78.555 -17.547  -6.940
  332    HD2  LYS  41           HD2      LYS  41  79.876 -19.224  -5.629
  333    HD3  LYS  41           HD1      LYS  41  78.390 -19.690  -4.801
  334    HE2  LYS  41           HE2      LYS  41  78.949 -21.166  -6.755
  335    HE3  LYS  41           HE1      LYS  41  77.374 -20.384  -6.892
  336    HZ1  LYS  41           HZ1      LYS  41  78.304 -18.737  -8.334
  337    HZ2  LYS  41           HZ2      LYS  41  78.715 -20.269  -8.943
  338    HZ3  LYS  41           HZ3      LYS  41  79.872 -19.343  -8.112
  339    HA   PRO  42           HA       PRO  42  79.027 -12.302  -2.679
  340    HB2  PRO  42           HB2      PRO  42  77.124 -12.383  -0.729
  341    HB3  PRO  42           HB1      PRO  42  76.824 -11.672  -2.327
  342    HG2  PRO  42           HG2      PRO  42  76.059 -14.357  -1.278
  343    HG3  PRO  42           HG1      PRO  42  75.127 -13.229  -2.280
  344    HD2  PRO  42           HD2      PRO  42  76.433 -15.414  -3.309
  345    HD3  PRO  42           HD1      PRO  42  76.130 -13.930  -4.241
  346    HA   PRO  43           HA       PRO  43  81.351 -14.396   0.455
  347    HB2  PRO  43           HB2      PRO  43  81.419 -12.504   2.468
  348    HB3  PRO  43           HB1      PRO  43  82.416 -12.432   1.002
  349    HG2  PRO  43           HG2      PRO  43  79.884 -10.999   1.642
  350    HG3  PRO  43           HG1      PRO  43  81.327 -10.419   0.792
  351    HD2  PRO  43           HD2      PRO  43  79.062 -11.148  -0.530
  352    HD3  PRO  43           HD1      PRO  43  80.681 -11.359  -1.233
  353    H    LYS  44           HN       LYS  44  80.865 -15.889   2.031
  354    HA   LYS  44           HA       LYS  44  78.313 -15.507   3.555
  355    HB2  LYS  44           HB2      LYS  44  78.495 -17.415   1.822
  356    HB3  LYS  44           HB1      LYS  44  79.610 -18.172   2.957
  357    HG2  LYS  44           HG2      LYS  44  77.029 -17.203   4.099
  358    HG3  LYS  44           HG1      LYS  44  76.931 -18.593   3.023
  359    HD2  LYS  44           HD2      LYS  44  79.008 -18.556   5.195
  360    HD3  LYS  44           HD1      LYS  44  77.343 -18.967   5.594
  361    HE2  LYS  44           HE2      LYS  44  78.980 -20.327   3.433
  362    HE3  LYS  44           HE1      LYS  44  78.716 -20.976   5.051
  363    HZ1  LYS  44           HZ1      LYS  44  77.129 -21.453   2.940
  364    HZ2  LYS  44           HZ2      LYS  44  76.313 -20.159   3.678
  365    HZ3  LYS  44           HZ3      LYS  44  76.635 -21.576   4.558
  366    H    LYS  45           HN       LYS  45  81.716 -16.309   3.704
  367    HA   LYS  45           HA       LYS  45  81.508 -16.364   6.693
  368    HB2  LYS  45           HB2      LYS  45  83.397 -17.996   4.967
  369    HB3  LYS  45           HB1      LYS  45  83.347 -17.997   6.730
  370    HG2  LYS  45           HG2      LYS  45  80.870 -18.666   6.479
  371    HG3  LYS  45           HG1      LYS  45  81.270 -19.035   4.801
  372    HD2  LYS  45           HD2      LYS  45  82.712 -20.193   7.204
  373    HD3  LYS  45           HD1      LYS  45  81.448 -21.027   6.301
  374    HE2  LYS  45           HE2      LYS  45  82.867 -20.684   4.219
  375    HE3  LYS  45           HE1      LYS  45  84.164 -20.155   5.290
  376    HZ1  LYS  45           HZ1      LYS  45  83.062 -22.547   6.276
  377    HZ2  LYS  45           HZ2      LYS  45  84.645 -22.252   5.734
  378    HZ3  LYS  45           HZ3      LYS  45  83.450 -22.762   4.639
  379    H    GLY  46           HN       GLY  46  82.260 -14.308   4.487
  380    HA2  GLY  46           HA2      GLY  46  83.911 -12.659   4.171
  381    HA3  GLY  46           HA1      GLY  46  84.110 -12.780   5.920
  382    H    VAL  47           HN       VAL  47  85.133 -14.318   2.873
  383    HA   VAL  47           HA       VAL  47  87.283 -15.805   4.116
  384    HB   VAL  47           HB       VAL  47  87.268 -15.018   1.208
  385   HG11  VAL  47          HG11      VAL  47  89.113 -16.405   2.070
  386   HG12  VAL  47          HG12      VAL  47  88.101 -17.339   0.968
  387   HG13  VAL  47          HG13      VAL  47  87.950 -17.566   2.711
  388   HG21  VAL  47          HG21      VAL  47  85.737 -17.049   0.909
  389   HG22  VAL  47          HG22      VAL  47  84.973 -15.592   1.544
  390   HG23  VAL  47          HG23      VAL  47  85.390 -16.916   2.633
  391    H    GLN  48           HN       GLN  48  87.173 -12.847   4.612
  392    HA   GLN  48           HA       GLN  48  88.749 -11.134   4.890
  393    HB2  GLN  48           HB2      GLN  48  90.188 -13.312   5.313
  394    HB3  GLN  48           HB1      GLN  48  90.903 -12.898   3.756
  395    HG2  GLN  48           HG2      GLN  48  90.810 -11.173   6.245
  396    HG3  GLN  48           HG1      GLN  48  92.241 -11.843   5.462
  397   HE21  GLN  48          HE21      GLN  48  89.762  -9.328   5.215
  398   HE22  GLN  48          HE22      GLN  48  90.519  -8.455   3.973
  399    H    GLY  49           HN       GLY  49  88.614  -9.472   3.466
  400    HA2  GLY  49           HA2      GLY  49  90.111  -9.137   1.153
  401    HA3  GLY  49           HA1      GLY  49  88.628  -9.912   0.594
  402    H1U  RCY  50           H1U      RCY  50  83.223  -0.564  -1.839
  403    H1S  RCY  50           H1S      RCY  50  85.090  -3.868   0.928
  404    HB1  RCY  50           HB1      RCY  50  86.362  -5.102   3.859
  405    HB2  RCY  50           HB2      RCY  50  86.633  -6.839   3.968
  406    HA   RCY  50           HA       RCY  50  87.679  -5.479   1.533
  407    HN1  RCY  50           HN1      RCY  50  89.156  -7.469   3.149
  408    H    GLY  51           HN       GLY  51  88.933  -6.059   4.843
  409    HA2  GLY  51           HA2      GLY  51  90.253  -4.681   6.210
  410    HA3  GLY  51           HA1      GLY  51  91.046  -4.199   4.710
  411    H    ASP  52           HN       ASP  52  91.164  -2.052   5.836
  412    HA   ASP  52           HA       ASP  52  89.099  -0.290   4.861
  413    HB2  ASP  52           HB2      ASP  52  88.003  -1.300   6.918
  414    HB3  ASP  52           HB1      ASP  52  89.263  -0.523   7.877
  415    H    ASP  53           HN       ASP  53  91.762  -0.210   4.380
  416    HA   ASP  53           HA       ASP  53  92.989   1.715   6.278
  417    HB2  ASP  53           HB2      ASP  53  94.130   0.393   3.797
  418    HB3  ASP  53           HB1      ASP  53  95.032   1.381   4.946
  419    H    ILE  54           HN       ILE  54  90.700   2.450   4.494
  420    HA   ILE  54           HA       ILE  54  91.949   4.875   3.380
  421    HB   ILE  54           HB       ILE  54  91.910   2.970   1.624
  422   HG12  ILE  54          HG12      ILE  54  92.389   5.269   1.020
  423   HG13  ILE  54          HG11      ILE  54  91.295   4.585  -0.179
  424   HG21  ILE  54          HG21      ILE  54  89.092   3.798   1.064
  425   HG22  ILE  54          HG22      ILE  54  89.371   2.564   2.295
  426   HG23  ILE  54          HG23      ILE  54  89.935   2.309   0.646
  427   HD11  ILE  54          HD11      ILE  54  89.389   5.608   1.196
  428   HD12  ILE  54          HD12      ILE  54  90.416   6.739   0.319
  429   HD13  ILE  54          HD13      ILE  54  90.636   6.515   2.052
  430    HA   PRO  55           HA       PRO  55  87.775   5.622   5.151
  431    HB2  PRO  55           HB2      PRO  55  88.497   7.174   7.225
  432    HB3  PRO  55           HB1      PRO  55  88.676   5.409   7.289
  433    HG2  PRO  55           HG2      PRO  55  90.741   7.503   6.905
  434    HG3  PRO  55           HG1      PRO  55  90.861   5.929   7.707
  435    HD2  PRO  55           HD2      PRO  55  91.691   6.537   5.053
  436    HD3  PRO  55           HD1      PRO  55  91.577   4.920   5.781
  437    H    GLY  56           HN       GLY  56  87.430   6.928   3.154
  438    HA2  GLY  56           HA2      GLY  56  86.738   9.558   3.473
  439    HA3  GLY  56           HA1      GLY  56  88.458   9.674   3.101
  440    H    MET  57           HN       MET  57  87.908   7.050   1.454
  441    HA   MET  57           HA       MET  57  87.698   6.660  -0.858
  442    HB2  MET  57           HB2      MET  57  85.288   8.458  -0.446
  443    HB3  MET  57           HB1      MET  57  85.535   7.359  -1.803
  444    HG2  MET  57           HG2      MET  57  84.150   6.146  -0.306
  445    HG3  MET  57           HG1      MET  57  85.768   5.503  -0.033
  446    HE1  MET  57           HE1      MET  57  84.241   9.104   1.543
  447    HE2  MET  57           HE2      MET  57  83.125   8.129   2.494
  448    HE3  MET  57           HE3      MET  57  83.176   7.939   0.744
  449    H    GLU  58           HN       GLU  58  86.040   9.493  -1.727
  450    HA   GLU  58           HA       GLU  58  88.243  11.309  -2.033
  451    HB2  GLU  58           HB2      GLU  58  89.120   9.746  -3.644
  452    HB3  GLU  58           HB1      GLU  58  87.543   9.564  -4.410
  453    HG2  GLU  58           HG2      GLU  58  89.153  11.080  -5.647
  454    HG3  GLU  58           HG1      GLU  58  87.604  11.822  -5.250
  455    H    GLY  59           HN       GLY  59  85.017  10.284  -2.636
  456    HA2  GLY  59           HA2      GLY  59  83.367  12.209  -2.391
  457    HA3  GLY  59           HA1      GLY  59  84.310  13.019  -3.643
  458    H1U  RCY  60           H1U      RCY  60  77.263   6.527  -1.537
  459    H1S  RCY  60           H1S      RCY  60  81.543   4.966  -3.325
  460    HB1  RCY  60           HB1      RCY  60  83.103   7.298  -5.378
  461    HB2  RCY  60           HB2      RCY  60  81.343   7.424  -5.363
  462    HA   RCY  60           HA       RCY  60  82.863   9.389  -6.343
  463    HN1  RCY  60           HN1      RCY  60  83.668   9.568  -3.691
  464    H    GLY  61           HN       GLY  61  80.348   8.956  -3.876
  465    HA2  GLY  61           HA2      GLY  61  78.377  10.359  -3.629
  466    HA3  GLY  61           HA1      GLY  61  78.684  11.023  -5.234
  467    H    THR  62           HN       THR  62  77.588  10.135  -6.924
  468    HA   THR  62           HA       THR  62  75.782   8.889  -7.843
  469    HB   THR  62           HB       THR  62  77.786   7.751  -8.647
  470    HG1  THR  62           HG1      THR  62  76.791   5.879  -9.144
  471   HG21  THR  62          HG21      THR  62  78.592   5.718  -7.381
  472   HG22  THR  62          HG22      THR  62  77.603   6.250  -6.023
  473   HG23  THR  62          HG23      THR  62  78.936   7.256  -6.592
  474    H    ASP  63           HN       ASP  63  75.092   9.419  -5.206
  475    HA   ASP  63           HA       ASP  63  74.542   7.082  -3.639
  476    HB2  ASP  63           HB2      ASP  63  72.785   8.595  -2.568
  477    HB3  ASP  63           HB1      ASP  63  74.439   9.208  -2.544
  478    H    ILE  64           HN       ILE  64  73.507   7.612  -6.659
  479    HA   ILE  64           HA       ILE  64  70.946   6.143  -6.188
  480    HB   ILE  64           HB       ILE  64  71.409   8.521  -8.007
  481   HG12  ILE  64          HG12      ILE  64  70.709   8.676  -5.462
  482   HG13  ILE  64          HG11      ILE  64  69.893   9.674  -6.660
  483   HG21  ILE  64          HG21      ILE  64  70.152   7.061  -9.359
  484   HG22  ILE  64          HG22      ILE  64  68.925   8.062  -8.584
  485   HG23  ILE  64          HG23      ILE  64  69.237   6.431  -7.989
  486   HD11  ILE  64          HD11      ILE  64  67.982   8.292  -6.690
  487   HD12  ILE  64          HD12      ILE  64  68.420   8.361  -4.983
  488   HD13  ILE  64          HD13      ILE  64  68.835   6.942  -5.942
  489    H    THR  65           HN       THR  65  73.730   6.809  -8.183
  490    HA   THR  65           HA       THR  65  74.494   5.795 -10.173
  491    HB   THR  65           HB       THR  65  73.531   3.361  -8.643
  492    HG1  THR  65           HG1      THR  65  76.051   4.655  -8.651
  493   HG21  THR  65          HG21      THR  65  75.124   3.775 -11.108
  494   HG22  THR  65          HG22      THR  65  74.165   2.383 -10.605
  495   HG23  THR  65          HG23      THR  65  75.786   2.618  -9.955
  496    H    VAL  66           HN       VAL  66  71.693   6.632 -10.195
  497    HA   VAL  66           HA       VAL  66  69.868   6.490 -11.651
  498    HB   VAL  66           HB       VAL  66  71.485   4.372 -13.098
  499   HG11  VAL  66          HG11      VAL  66  69.216   6.202 -13.926
  500   HG12  VAL  66          HG12      VAL  66  69.150   4.446 -13.775
  501   HG13  VAL  66          HG13      VAL  66  70.134   5.186 -15.038
  502   HG21  VAL  66          HG21      VAL  66  72.177   6.315 -14.546
  503   HG22  VAL  66          HG22      VAL  66  72.840   6.379 -12.913
  504   HG23  VAL  66          HG23      VAL  66  71.465   7.394 -13.347
  505    H    ILE  67           HN       ILE  67  71.274   3.357 -10.716
  506    HA   ILE  67           HA       ILE  67  68.517   2.460 -10.013
  507    HB   ILE  67           HB       ILE  67  70.502   0.518 -11.174
  508   HG12  ILE  67          HG12      ILE  67  68.578   2.290 -12.717
  509   HG13  ILE  67          HG11      ILE  67  70.337   2.293 -12.849
  510   HG21  ILE  67          HG21      ILE  67  68.650  -0.871 -11.401
  511   HG22  ILE  67          HG22      ILE  67  67.523   0.478 -11.546
  512   HG23  ILE  67          HG23      ILE  67  68.184   0.047  -9.970
  513   HD11  ILE  67          HD11      ILE  67  70.139  -0.186 -13.479
  514   HD12  ILE  67          HD12      ILE  67  69.583   0.978 -14.683
  515   HD13  ILE  67          HD13      ILE  67  68.413   0.117 -13.682
  516    H1U  RCY  68           H1U      RCY  68  63.159   6.648 -13.147
  517    H1S  RCY  68           H1S      RCY  68  66.944   5.466  -8.610
  518    HB1  RCY  68           HB1      RCY  68  70.800   2.501  -4.645
  519    HB2  RCY  68           HB2      RCY  68  69.925   3.566  -5.739
  520    HA   RCY  68           HA       RCY  68  71.000   0.894  -6.656
  521    HN1  RCY  68           HN1      RCY  68  68.824   2.603  -7.800
  522    HA   PRO  69           HA       PRO  69  68.356  -1.833  -4.430
  523    HB2  PRO  69           HB2      PRO  69  69.015  -0.116  -2.051
  524    HB3  PRO  69           HB1      PRO  69  68.935  -1.886  -2.169
  525    HG2  PRO  69           HG2      PRO  69  71.257  -0.446  -2.341
  526    HG3  PRO  69           HG1      PRO  69  71.022  -2.049  -3.053
  527    HD2  PRO  69           HD2      PRO  69  71.446   0.437  -4.446
  528    HD3  PRO  69           HD1      PRO  69  71.186  -1.166  -5.156
  529    H    TRP  70           HN       TRP  70  67.903   1.518  -3.151
  530    HA   TRP  70           HA       TRP  70  65.156   1.140  -2.494
  531    HD1  TRP  70           HD1      TRP  70  67.040   4.895  -4.625
  532    HE1  TRP  70           HE1      TRP  70  69.591   5.225  -4.442
  533    HE3  TRP  70           HE3      TRP  70  68.030   1.906  -0.605
  534    HZ2  TRP  70           HZ2      TRP  70  71.764   4.337  -2.807
  535    HZ3  TRP  70           HZ3      TRP  70  70.345   1.667   0.244
  536    HH2  TRP  70           HH2      TRP  70  72.212   2.877  -0.851
  537    HB2  TRP  70           HB2      TRP  70  65.251   3.808  -3.133
  538    HB3  TRP  70           HB1      TRP  70  65.765   3.144  -1.584
  539    H    GLU  71           HN       GLU  71  66.525   0.813  -5.437
  540    HA   GLU  71           HA       GLU  71  63.948   1.280  -6.826
  541    HB2  GLU  71           HB2      GLU  71  66.620   2.463  -7.635
  542    HB3  GLU  71           HB1      GLU  71  65.274   2.292  -8.760
  543    HG2  GLU  71           HG2      GLU  71  65.034   3.747  -6.115
  544    HG3  GLU  71           HG1      GLU  71  65.449   4.556  -7.623
  545    H    ALA  72           HN       ALA  72  67.139  -0.166  -6.656
  546    HA   ALA  72           HA       ALA  72  66.808  -1.817  -9.032
  547    HB1  ALA  72           HB1      ALA  72  68.859  -2.959  -8.199
  548    HB2  ALA  72           HB2      ALA  72  68.763  -2.001  -6.721
  549    HB3  ALA  72           HB3      ALA  72  69.051  -1.207  -8.268
  550    H1U  RCY  73           H1U      RCY  73  68.336 -12.638  -6.827
  551    H1S  RCY  73           H1S      RCY  73  67.856  -8.496  -7.212
  552    HB1  RCY  73           HB1      RCY  73  66.958  -6.674  -4.759
  553    HB2  RCY  73           HB2      RCY  73  67.723  -5.193  -4.182
  554    HA   RCY  73           HA       RCY  73  65.821  -5.494  -6.520
  555    HN1  RCY  73           HN1      RCY  73  67.811  -3.394  -6.097
  556    H    ASN  74           HN       ASN  74  66.250  -2.762  -4.356
  557    HA   ASN  74           HA       ASN  74  64.945  -2.023  -2.532
  558    HB2  ASN  74           HB2      ASN  74  62.635  -1.691  -3.119
  559    HB3  ASN  74           HB1      ASN  74  63.571  -1.525  -4.604
  560   HD21  ASN  74          HD21      ASN  74  63.430  -3.271  -6.196
  561   HD22  ASN  74          HD22      ASN  74  62.196  -4.434  -6.117
  562    H    HIS  75           HN       HIS  75  65.750  -4.925  -2.549
  563    HA   HIS  75           HA       HIS  75  64.068  -5.734  -0.302
  564    HD1  HIS  75           HD1      HIS  75  64.269  -9.764  -2.056
  565    HD2  HIS  75           HD2      HIS  75  61.981  -7.458   0.562
  566    HE1  HIS  75           HE1      HIS  75  63.401 -11.346  -0.276
  567    HE2  HIS  75           HE2      HIS  75  62.008  -9.953   1.321
  568    HB2  HIS  75           HB2      HIS  75  62.699  -6.503  -2.212
  569    HB3  HIS  75           HB1      HIS  75  64.082  -7.401  -2.838
  570    H1U  RCY  76           H1U      RCY  76  64.896  -1.942   3.985
  571    H1S  RCY  76           H1S      RCY  76  67.345  -2.831   0.574
  572    HB1  RCY  76           HB1      RCY  76  69.611  -6.048  -1.957
  573    HB2  RCY  76           HB2      RCY  76  70.285  -6.251  -0.345
  574    HA   RCY  76           HA       RCY  76  68.309  -7.791  -1.067
  575    HN1  RCY  76           HN1      RCY  76  66.955  -5.245  -1.152
  576    H    GLU  77           HN       GLU  77  67.657  -9.009   0.702
  577    HA   GLU  77           HA       GLU  77  67.212  -8.031   3.332
  578    HB2  GLU  77           HB2      GLU  77  66.844 -10.429   2.175
  579    HB3  GLU  77           HB1      GLU  77  68.361 -10.773   3.004
  580    HG2  GLU  77           HG2      GLU  77  67.278  -9.819   5.109
  581    HG3  GLU  77           HG1      GLU  77  65.750  -9.855   4.228
  582    H    LEU  78           HN       LEU  78  68.685  -8.756   5.251
  583    HA   LEU  78           HA       LEU  78  71.558  -8.786   4.651
  584    HG   LEU  78           HG       LEU  78  68.957  -6.541   5.727
  585    HB2  LEU  78           HB2      LEU  78  71.961  -6.732   6.080
  586    HB3  LEU  78           HB1      LEU  78  71.217  -6.410   4.517
  587   HD11  LEU  78          HD11      LEU  78  70.872  -6.722   8.022
  588   HD12  LEU  78          HD12      LEU  78  69.279  -7.450   7.828
  589   HD13  LEU  78          HD13      LEU  78  69.422  -5.744   8.238
  590   HD21  LEU  78          HD21      LEU  78  69.732  -4.405   5.008
  591   HD22  LEU  78          HD22      LEU  78  70.996  -4.366   6.237
  592   HD23  LEU  78          HD23      LEU  78  69.304  -4.195   6.706
  593    H    HIS  79           HN       HIS  79  69.212 -10.114   6.251
  594    HA   HIS  79           HA       HIS  79  70.419 -10.076   8.963
  595    HD1  HIS  79           HD1      HIS  79  67.778  -8.146   8.534
  596    HD2  HIS  79           HD2      HIS  79  68.120 -10.893  11.655
  597    HE1  HIS  79           HE1      HIS  79  67.239  -6.883  10.665
  598    HE2  HIS  79           HE2      HIS  79  67.444  -8.546  12.570
  599    HB2  HIS  79           HB2      HIS  79  67.786 -10.748   7.812
  600    HB3  HIS  79           HB1      HIS  79  68.320 -11.875   9.056
  601    H    GLU  80           HN       GLU  80  71.758 -11.331   6.596
  602    HA   GLU  80           HA       GLU  80  72.274 -13.948   7.877
  603    HB2  GLU  80           HB2      GLU  80  70.464 -14.236   6.096
  604    HB3  GLU  80           HB1      GLU  80  71.698 -13.803   4.911
  605    HG2  GLU  80           HG2      GLU  80  73.106 -15.663   5.655
  606    HG3  GLU  80           HG1      GLU  80  71.930 -16.078   6.902
  607    H    LEU  81           HN       LEU  81  73.078 -11.752   5.179
  608    HA   LEU  81           HA       LEU  81  75.802 -12.820   5.017
  609    HG   LEU  81           HG       LEU  81  73.684  -9.978   4.577
  610    HB2  LEU  81           HB2      LEU  81  76.058 -10.714   3.490
  611    HB3  LEU  81           HB1      LEU  81  75.055 -12.051   2.931
  612   HD11  LEU  81          HD11      LEU  81  74.945  -8.469   3.227
  613   HD12  LEU  81          HD12      LEU  81  73.373  -8.607   2.440
  614   HD13  LEU  81          HD13      LEU  81  74.762  -9.483   1.795
  615   HD21  LEU  81          HD21      LEU  81  72.957 -11.332   1.959
  616   HD22  LEU  81          HD22      LEU  81  71.867 -10.449   3.028
  617   HD23  LEU  81          HD23      LEU  81  72.563 -11.983   3.549
  618    H    ALA  82           HN       ALA  82  74.737 -11.549   7.546
  619    HA   ALA  82           HA       ALA  82  76.056  -9.017   7.902
  620    HB1  ALA  82           HB1      ALA  82  74.221 -10.046   9.372
  621    HB2  ALA  82           HB2      ALA  82  75.554  -9.261  10.219
  622    HB3  ALA  82           HB3      ALA  82  75.500 -11.020  10.099
  623    H    GLN  83           HN       GLN  83  77.471  -9.785  10.409
  624    HA   GLN  83           HA       GLN  83  79.820  -9.946  10.793
  625    HB2  GLN  83           HB2      GLN  83  80.431 -12.498  10.314
  626    HB3  GLN  83           HB1      GLN  83  79.347 -12.054  11.630
  627    HG2  GLN  83           HG2      GLN  83  77.401 -12.435  10.136
  628    HG3  GLN  83           HG1      GLN  83  78.505 -12.935   8.853
  629   HE21  GLN  83          HE21      GLN  83  79.661 -14.992   9.140
  630   HE22  GLN  83          HE22      GLN  83  79.151 -16.125  10.296
  631    H    TYR  84           HN       TYR  84  80.120  -8.503   8.812
  632    HA   TYR  84           HA       TYR  84  81.997  -9.857   6.966
  633    HD1  TYR  84           HD2      TYR  84  82.038 -10.749   4.678
  634    HD2  TYR  84           HD1      TYR  84  80.391  -6.798   4.305
  635    HE1  TYR  84           HE2      TYR  84  83.348 -10.397   2.602
  636    HE2  TYR  84           HE1      TYR  84  81.702  -6.448   2.230
  637    HH   TYR  84           HH       TYR  84  82.825  -7.649   0.542
  638    HB2  TYR  84           HB2      TYR  84  79.799  -9.943   5.828
  639    HB3  TYR  84           HB1      TYR  84  79.636  -8.198   6.018
  640    H    GLY  85           HN       GLY  85  80.415  -6.791   7.872
  641    HA2  GLY  85           HA2      GLY  85  82.238  -5.174   8.814
  642    HA3  GLY  85           HA1      GLY  85  82.941  -5.352   7.206
  643    H    ILE  86           HN       ILE  86  79.633  -4.809   8.473
  644    HA   ILE  86           HA       ILE  86  79.202  -2.856   6.282
  645    HB   ILE  86           HB       ILE  86  76.803  -2.893   7.410
  646   HG12  ILE  86          HG12      ILE  86  76.336  -5.123   8.420
  647   HG13  ILE  86          HG11      ILE  86  78.060  -5.479   8.403
  648   HG21  ILE  86          HG21      ILE  86  76.307  -4.991   6.082
  649   HG22  ILE  86          HG22      ILE  86  78.042  -5.138   5.805
  650   HG23  ILE  86          HG23      ILE  86  77.168  -3.735   5.193
  651   HD11  ILE  86          HD11      ILE  86  76.794  -3.143   9.868
  652   HD12  ILE  86          HD12      ILE  86  78.494  -3.612   9.923
  653   HD13  ILE  86          HD13      ILE  86  77.265  -4.664  10.622
  654    H1U  RCY  87           H1U      RCY  87  72.143   2.166  11.456
  655    H1S  RCY  87           H1S      RCY  87  75.186   3.509   8.227
  656    HB1  RCY  87           HB1      RCY  87  76.542   0.735  10.835
  657    HB2  RCY  87           HB2      RCY  87  75.903  -0.484   9.733
  658    HA   RCY  87           HA       RCY  87  78.705   0.438   9.273
  659    HN1  RCY  87           HN1      RCY  87  77.127  -1.948   8.657
  Start of MODEL   80
    1    HA   MET   1           HA       MET   1  64.510  -1.665  21.345
    2    HB2  MET   1           HB2      MET   1  65.175   0.358  23.493
    3    HB3  MET   1           HB1      MET   1  66.386  -0.244  22.360
    4    HG2  MET   1           HG2      MET   1  65.091   0.559  20.467
    5    HG3  MET   1           HG1      MET   1  63.764   1.031  21.529
    6    HE1  MET   1           HE1      MET   1  64.046   3.146  20.009
    7    HE2  MET   1           HE2      MET   1  65.644   2.838  19.333
    8    HE3  MET   1           HE3      MET   1  65.328   4.353  20.174
    9    H    ASN   2           HN       ASN   2  67.051  -1.930  22.465
   10    HA   ASN   2           HA       ASN   2  68.372  -3.553  23.527
   11    HB2  ASN   2           HB2      ASN   2  67.350  -2.278  25.508
   12    HB3  ASN   2           HB1      ASN   2  66.212  -3.619  25.642
   13   HD21  ASN   2          HD21      ASN   2  69.725  -3.653  24.836
   14   HD22  ASN   2          HD22      ASN   2  70.158  -4.685  26.113
   15    H    LEU   3           HN       LEU   3  66.989  -4.684  21.527
   16    HA   LEU   3           HA       LEU   3  66.017  -6.682  20.762
   17    HG   LEU   3           HG       LEU   3  68.558  -6.728  21.042
   18    HB2  LEU   3           HB2      LEU   3  67.431  -7.550  23.292
   19    HB3  LEU   3           HB1      LEU   3  66.629  -8.699  22.222
   20   HD11  LEU   3          HD11      LEU   3  69.786  -7.668  22.941
   21   HD12  LEU   3          HD12      LEU   3  70.395  -8.362  21.439
   22   HD13  LEU   3          HD13      LEU   3  69.311  -9.299  22.467
   23   HD21  LEU   3          HD21      LEU   3  67.242  -8.171  19.562
   24   HD22  LEU   3          HD22      LEU   3  67.779  -9.601  20.443
   25   HD23  LEU   3          HD23      LEU   3  68.936  -8.656  19.506
   26    H    GLU   4           HN       GLU   4  63.799  -6.331  20.878
   27    HA   GLU   4           HA       GLU   4  62.458  -7.298  23.371
   28    HB2  GLU   4           HB2      GLU   4  60.680  -5.594  22.940
   29    HB3  GLU   4           HB1      GLU   4  62.247  -4.867  23.293
   30    HG2  GLU   4           HG2      GLU   4  62.646  -4.735  20.800
   31    HG3  GLU   4           HG1      GLU   4  60.968  -5.228  20.572
   32    HA   PRO   5           HA       PRO   5  60.209 -10.300  21.040
   33    HB2  PRO   5           HB2      PRO   5  57.786  -8.824  22.021
   34    HB3  PRO   5           HB1      PRO   5  58.110 -10.569  22.009
   35    HG2  PRO   5           HG2      PRO   5  58.373  -9.079  24.224
   36    HG3  PRO   5           HG1      PRO   5  59.406 -10.477  23.891
   37    HD2  PRO   5           HD2      PRO   5  60.109  -7.614  23.893
   38    HD3  PRO   5           HD1      PRO   5  61.175  -9.033  23.978
   39    HA   PRO   6           HA       PRO   6  59.322  -7.524  17.518
   40    HB2  PRO   6           HB2      PRO   6  60.115  -9.210  15.551
   41    HB3  PRO   6           HB1      PRO   6  61.276  -8.316  16.552
   42    HG2  PRO   6           HG2      PRO   6  60.454 -11.165  16.708
   43    HG3  PRO   6           HG1      PRO   6  62.041 -10.429  16.982
   44    HD2  PRO   6           HD2      PRO   6  60.270 -11.197  18.998
   45    HD3  PRO   6           HD1      PRO   6  61.605 -10.043  19.200
   46    H    LYS   7           HN       LYS   7  57.459  -7.375  16.274
   47    HA   LYS   7           HA       LYS   7  55.743  -9.827  16.093
   48    HB2  LYS   7           HB2      LYS   7  53.924  -7.836  15.890
   49    HB3  LYS   7           HB1      LYS   7  54.389  -8.543  17.436
   50    HG2  LYS   7           HG2      LYS   7  56.054  -6.299  16.369
   51    HG3  LYS   7           HG1      LYS   7  54.474  -5.906  17.048
   52    HD2  LYS   7           HD2      LYS   7  55.038  -6.851  19.165
   53    HD3  LYS   7           HD1      LYS   7  56.477  -7.635  18.512
   54    HE2  LYS   7           HE2      LYS   7  57.607  -5.546  18.235
   55    HE3  LYS   7           HE1      LYS   7  56.126  -4.631  18.519
   56    HZ1  LYS   7           HZ1      LYS   7  57.073  -6.468  20.600
   57    HZ2  LYS   7           HZ2      LYS   7  56.197  -5.020  20.752
   58    HZ3  LYS   7           HZ3      LYS   7  57.862  -4.978  20.416
   59    H    ALA   8           HN       ALA   8  56.584 -10.330  13.999
   60    HA   ALA   8           HA       ALA   8  55.165  -9.459  11.775
   61    HB1  ALA   8           HB1      ALA   8  57.448  -7.654  12.458
   62    HB2  ALA   8           HB2      ALA   8  55.914  -7.272  11.677
   63    HB3  ALA   8           HB3      ALA   8  57.205  -8.045  10.756
   64    H    GLU   9           HN       GLU   9  56.254 -10.143   9.683
   65    HA   GLU   9           HA       GLU   9  57.353 -12.699   9.816
   66    HB2  GLU   9           HB2      GLU   9  57.670 -10.518   7.747
   67    HB3  GLU   9           HB1      GLU   9  58.391 -12.113   7.525
   68    HG2  GLU   9           HG2      GLU   9  56.188 -12.055   6.462
   69    HG3  GLU   9           HG1      GLU   9  56.148 -13.143   7.850
   70    H1U  RCY  10           H1U      RCY  10  63.459 -13.665   4.077
   71    H1S  RCY  10           H1S      RCY  10  64.446 -12.210   8.165
   72    HB1  RCY  10           HB1      RCY  10  62.130 -11.121   9.717
   73    HB2  RCY  10           HB2      RCY  10  61.574 -12.630   8.996
   74    HA   RCY  10           HA       RCY  10  61.417 -13.362  11.565
   75    HN1  RCY  10           HN1      RCY  10  59.171 -13.322  10.884
   76    H    ARG  11           HN       ARG  11  63.043 -10.763  11.370
   77    HA   ARG  11           HA       ARG  11  62.236  -9.736  13.968
   78    HE   ARG  11           HE       ARG  11  63.092  -6.238  13.088
   79    HB2  ARG  11           HB2      ARG  11  64.626  -9.832  12.883
   80    HB3  ARG  11           HB1      ARG  11  64.155  -8.308  12.134
   81    HG2  ARG  11           HG2      ARG  11  63.381  -8.058  14.823
   82    HG3  ARG  11           HG1      ARG  11  64.971  -8.821  14.876
   83    HD2  ARG  11           HD2      ARG  11  65.447  -6.502  14.840
   84    HD3  ARG  11           HD1      ARG  11  65.683  -7.017  13.169
   85   HH11  ARG  11          HH21      ARG  11  65.892  -4.852  14.546
   86   HH12  ARG  11          HH22      ARG  11  65.334  -3.220  14.379
   87   HH21  ARG  11          HH11      ARG  11  62.348  -4.116  12.862
   88   HH22  ARG  11          HH12      ARG  11  63.328  -2.804  13.426
   89    H    SER  12           HN       SER  12  61.705  -8.846  10.632
   90    HA   SER  12           HA       SER  12  59.452  -7.265  11.057
   91    HG   SER  12           HG       SER  12  62.794  -6.241  10.941
   92    HB2  SER  12           HB2      SER  12  60.842  -4.973  10.569
   93    HB3  SER  12           HB1      SER  12  60.354  -5.490  12.179
   94    H    ALA  13           HN       ALA  13  58.567  -7.210   9.064
   95    HA   ALA  13           HA       ALA  13  59.849  -6.190   6.731
   96    HB1  ALA  13           HB1      ALA  13  61.250  -8.120   6.669
   97    HB2  ALA  13           HB2      ALA  13  59.979  -8.431   5.488
   98    HB3  ALA  13           HB3      ALA  13  59.912  -9.194   7.076
   99    H    THR  14           HN       THR  14  58.275  -8.937   5.692
  100    HA   THR  14           HA       THR  14  55.529  -8.336   6.191
  101    HB   THR  14           HB       THR  14  55.646  -7.636   3.424
  102    HG1  THR  14           HG1      THR  14  57.291  -6.365   3.300
  103   HG21  THR  14          HG21      THR  14  53.862  -6.954   4.909
  104   HG22  THR  14          HG22      THR  14  54.655  -5.498   4.306
  105   HG23  THR  14          HG23      THR  14  54.994  -6.076   5.937
  106    H    ARG  15           HN       ARG  15  57.604  -9.316   3.438
  107    HA   ARG  15           HA       ARG  15  56.601 -12.060   3.622
  108    HE   ARG  15           HE       ARG  15  52.988 -10.820   0.862
  109    HB2  ARG  15           HB2      ARG  15  55.761 -12.061   1.251
  110    HB3  ARG  15           HB1      ARG  15  54.771 -11.109   2.356
  111    HG2  ARG  15           HG2      ARG  15  56.325  -9.127   1.616
  112    HG3  ARG  15           HG1      ARG  15  56.672 -10.158   0.228
  113    HD2  ARG  15           HD2      ARG  15  54.150  -8.769   0.971
  114    HD3  ARG  15           HD1      ARG  15  54.817  -9.113  -0.625
  115   HH11  ARG  15          HH21      ARG  15  55.556 -10.652  -1.432
  116   HH12  ARG  15          HH22      ARG  15  55.127 -12.134  -2.220
  117   HH21  ARG  15          HH11      ARG  15  52.413 -12.756  -0.153
  118   HH22  ARG  15          HH12      ARG  15  53.348 -13.325  -1.496
  119    H    VAL  16           HN       VAL  16  57.346 -11.772   0.482
  120    HA   VAL  16           HA       VAL  16  60.289 -11.663   0.856
  121    HB   VAL  16           HB       VAL  16  60.416 -13.844  -0.497
  122   HG11  VAL  16          HG11      VAL  16  60.191 -15.216   1.534
  123   HG12  VAL  16          HG12      VAL  16  59.264 -13.931   2.309
  124   HG13  VAL  16          HG13      VAL  16  60.964 -13.677   1.913
  125   HG21  VAL  16          HG21      VAL  16  57.912 -13.700  -1.044
  126   HG22  VAL  16          HG22      VAL  16  57.628 -14.236   0.612
  127   HG23  VAL  16          HG23      VAL  16  58.505 -15.273  -0.513
  128    H    MET  17           HN       MET  17  59.602  -9.646  -0.415
  129    HA   MET  17           HA       MET  17  59.478  -8.485  -2.450
  130    HB2  MET  17           HB2      MET  17  61.669  -9.595  -2.731
  131    HB3  MET  17           HB1      MET  17  60.864 -10.997  -3.435
  132    HG2  MET  17           HG2      MET  17  60.278  -9.852  -5.384
  133    HG3  MET  17           HG1      MET  17  60.374  -8.273  -4.603
  134    HE1  MET  17           HE1      MET  17  63.202  -9.686  -7.467
  135    HE2  MET  17           HE2      MET  17  61.460  -9.452  -7.353
  136    HE3  MET  17           HE3      MET  17  62.187 -10.928  -6.722
  137    H    GLY  18           HN       GLY  18  57.339  -8.341  -3.047
  138    HA2  GLY  18           HA2      GLY  18  56.151 -10.671  -4.497
  139    HA3  GLY  18           HA1      GLY  18  55.207  -9.448  -3.645
  140    H    GLY  19           HN       GLY  19  54.094  -9.296  -5.800
  141    HA2  GLY  19           HA2      GLY  19  55.617  -8.008  -7.962
  142    HA3  GLY  19           HA1      GLY  19  53.909  -8.443  -8.014
  143    HA   PRO  20           HA       PRO  20  52.267  -4.604  -6.475
  144    HB2  PRO  20           HB2      PRO  20  52.885  -5.131  -3.588
  145    HB3  PRO  20           HB1      PRO  20  51.378  -4.555  -4.331
  146    HG2  PRO  20           HG2      PRO  20  51.640  -7.073  -3.534
  147    HG3  PRO  20           HG1      PRO  20  50.763  -6.671  -5.020
  148    HD2  PRO  20           HD2      PRO  20  53.465  -7.904  -4.707
  149    HD3  PRO  20           HD1      PRO  20  52.272  -8.114  -6.008
  150    H1U  RCY  21           H1U      RCY  21  58.867   1.415  -3.382
  151    H1S  RCY  21           H1S      RCY  21  56.911  -1.734  -4.978
  152    HB1  RCY  21           HB1      RCY  21  57.287  -1.996  -7.662
  153    HB2  RCY  21           HB2      RCY  21  56.482  -3.551  -7.860
  154    HA   RCY  21           HA       RCY  21  55.765  -2.076  -5.392
  155    HN1  RCY  21           HN1      RCY  21  53.926  -3.314  -7.387
  156    H    THR  22           HN       THR  22  55.640   0.132  -5.502
  157    HA   THR  22           HA       THR  22  54.406   1.323  -7.965
  158    HB   THR  22           HB       THR  22  52.951   1.519  -5.996
  159    HG1  THR  22           HG1      THR  22  53.667   4.079  -5.951
  160   HG21  THR  22          HG21      THR  22  53.670   2.191  -3.932
  161   HG22  THR  22          HG22      THR  22  54.840   3.331  -4.597
  162   HG23  THR  22          HG23      THR  22  55.223   1.611  -4.532
  163    HA   PRO  23           HA       PRO  23  58.669   3.053  -7.853
  164    HB2  PRO  23           HB2      PRO  23  58.032   3.751 -10.653
  165    HB3  PRO  23           HB1      PRO  23  59.377   2.790 -10.013
  166    HG2  PRO  23           HG2      PRO  23  57.334   1.702 -11.382
  167    HG3  PRO  23           HG1      PRO  23  58.197   0.837 -10.100
  168    HD2  PRO  23           HD2      PRO  23  55.496   2.139 -10.008
  169    HD3  PRO  23           HD1      PRO  23  56.060   0.652  -9.211
  170    H    ARG  24           HN       ARG  24  59.220   5.197  -7.468
  171    HA   ARG  24           HA       ARG  24  57.866   7.431  -8.679
  172    HE   ARG  24           HE       ARG  24  53.521   8.232  -7.763
  173    HB2  ARG  24           HB2      ARG  24  56.117   6.602  -7.037
  174    HB3  ARG  24           HB1      ARG  24  57.242   7.013  -5.746
  175    HG2  ARG  24           HG2      ARG  24  55.959   8.964  -5.911
  176    HG3  ARG  24           HG1      ARG  24  57.347   9.348  -6.931
  177    HD2  ARG  24           HD2      ARG  24  55.802   9.822  -8.524
  178    HD3  ARG  24           HD1      ARG  24  55.669   8.073  -8.702
  179   HH11  ARG  24          HH21      ARG  24  55.502  10.910  -6.874
  180   HH12  ARG  24          HH22      ARG  24  54.239  11.731  -6.020
  181   HH21  ARG  24          HH11      ARG  24  51.860   9.289  -6.652
  182   HH22  ARG  24          HH12      ARG  24  52.177  10.814  -5.894
  183    H    LYS  25           HN       LYS  25  58.440   8.267  -5.483
  184    HA   LYS  25           HA       LYS  25  60.714   9.848  -6.062
  185    HB2  LYS  25           HB2      LYS  25  60.500   8.790  -3.284
  186    HB3  LYS  25           HB1      LYS  25  60.667  10.452  -3.844
  187    HG2  LYS  25           HG2      LYS  25  58.466  10.570  -3.206
  188    HG3  LYS  25           HG1      LYS  25  58.205   9.906  -4.819
  189    HD2  LYS  25           HD2      LYS  25  58.320   7.602  -3.805
  190    HD3  LYS  25           HD1      LYS  25  58.351   8.364  -2.215
  191    HE2  LYS  25           HE2      LYS  25  56.220   9.567  -3.647
  192    HE3  LYS  25           HE1      LYS  25  56.081   7.828  -3.902
  193    HZ1  LYS  25           HZ1      LYS  25  56.222   9.264  -1.311
  194    HZ2  LYS  25           HZ2      LYS  25  56.356   7.576  -1.454
  195    HZ3  LYS  25           HZ3      LYS  25  54.922   8.359  -1.920
  196    H    GLY  26           HN       GLY  26  60.478   6.486  -5.788
  197    HA2  GLY  26           HA2      GLY  26  62.855   5.673  -4.551
  198    HA3  GLY  26           HA1      GLY  26  62.136   4.825  -5.920
  199    HA   PRO  27           HA       PRO  27  65.378   5.637  -8.762
  200    HB2  PRO  27           HB2      PRO  27  63.425   7.385 -10.225
  201    HB3  PRO  27           HB1      PRO  27  64.505   6.129 -10.862
  202    HG2  PRO  27           HG2      PRO  27  61.887   5.700 -10.447
  203    HG3  PRO  27           HG1      PRO  27  63.103   4.428 -10.262
  204    HD2  PRO  27           HD2      PRO  27  61.504   5.772  -8.185
  205    HD3  PRO  27           HD1      PRO  27  62.415   4.251  -8.091
  206    HA   PRO  28           HA       PRO  28  67.261   9.363  -7.109
  207    HB2  PRO  28           HB2      PRO  28  68.556   9.360  -9.817
  208    HB3  PRO  28           HB1      PRO  28  69.294   9.578  -8.218
  209    HG2  PRO  28           HG2      PRO  28  69.444   7.259  -9.541
  210    HG3  PRO  28           HG1      PRO  28  69.320   7.328  -7.776
  211    HD2  PRO  28           HD2      PRO  28  67.296   6.454  -9.754
  212    HD3  PRO  28           HD1      PRO  28  67.421   6.069  -8.024
  213    H    LYS  29           HN       LYS  29  67.329  11.696  -7.614
  214    HA   LYS  29           HA       LYS  29  66.147  12.770 -10.012
  215    HB2  LYS  29           HB2      LYS  29  64.026  13.559  -9.096
  216    HB3  LYS  29           HB1      LYS  29  64.105  11.804  -8.943
  217    HG2  LYS  29           HG2      LYS  29  65.031  12.197  -6.589
  218    HG3  LYS  29           HG1      LYS  29  64.529  13.877  -6.784
  219    HD2  LYS  29           HD2      LYS  29  62.215  13.137  -7.224
  220    HD3  LYS  29           HD1      LYS  29  62.715  11.457  -7.023
  221    HE2  LYS  29           HE2      LYS  29  61.732  12.252  -4.936
  222    HE3  LYS  29           HE1      LYS  29  63.461  11.999  -4.702
  223    HZ1  LYS  29           HZ1      LYS  29  62.696  14.116  -3.780
  224    HZ2  LYS  29           HZ2      LYS  29  62.189  14.609  -5.325
  225    HZ3  LYS  29           HZ3      LYS  29  63.838  14.344  -5.014
  226    H1U  RCY  30           H1U      RCY  30  69.354   7.902  -6.498
  227    H1S  RCY  30           H1S      RCY  30  68.701  11.926  -5.164
  228    HB1  RCY  30           HB1      RCY  30  67.684  14.315  -4.905
  229    HB2  RCY  30           HB2      RCY  30  68.699  15.755  -4.847
  230    HA   RCY  30           HA       RCY  30  67.521  15.949  -6.895
  231    HN1  RCY  30           HN1      RCY  30  67.819  13.011  -7.146
  232    H    LYS  31           HN       LYS  31  70.411  16.006  -5.927
  233    HA   LYS  31           HA       LYS  31  71.568  16.681  -8.534
  234    HB2  LYS  31           HB2      LYS  31  73.129  16.651  -5.961
  235    HB3  LYS  31           HB1      LYS  31  73.263  17.756  -7.330
  236    HG2  LYS  31           HG2      LYS  31  70.982  18.637  -6.765
  237    HG3  LYS  31           HG1      LYS  31  71.005  17.636  -5.313
  238    HD2  LYS  31           HD2      LYS  31  71.834  19.633  -4.464
  239    HD3  LYS  31           HD1      LYS  31  73.336  18.824  -4.915
  240    HE2  LYS  31           HE2      LYS  31  73.406  20.029  -7.029
  241    HE3  LYS  31           HE1      LYS  31  71.832  20.756  -6.704
  242    HZ1  LYS  31           HZ1      LYS  31  74.198  21.115  -4.952
  243    HZ2  LYS  31           HZ2      LYS  31  72.720  21.951  -4.877
  244    HZ3  LYS  31           HZ3      LYS  31  73.775  22.199  -6.186
  245    H    GLN  32           HN       GLN  32  73.559  15.720  -9.343
  246    HA   GLN  32           HA       GLN  32  74.745  13.399  -8.112
  247    HB2  GLN  32           HB2      GLN  32  72.615  12.361  -8.779
  248    HB3  GLN  32           HB1      GLN  32  72.858  12.906 -10.437
  249    HG2  GLN  32           HG2      GLN  32  75.207  11.499  -9.499
  250    HG3  GLN  32           HG1      GLN  32  73.773  10.492  -9.297
  251   HE21  GLN  32          HE21      GLN  32  72.796   9.629 -11.188
  252   HE22  GLN  32          HE22      GLN  32  73.361   9.940 -12.758
  253    H    ARG  33           HN       ARG  33  76.647  14.579  -8.704
  254    HA   ARG  33           HA       ARG  33  77.141  14.949 -11.615
  255    HE   ARG  33           HE       ARG  33  78.530  16.262  -6.101
  256    HB2  ARG  33           HB2      ARG  33  79.284  16.062 -10.712
  257    HB3  ARG  33           HB1      ARG  33  77.759  16.892 -10.415
  258    HG2  ARG  33           HG2      ARG  33  78.350  14.952  -8.318
  259    HG3  ARG  33           HG1      ARG  33  79.632  16.154  -8.475
  260    HD2  ARG  33           HD2      ARG  33  77.867  17.945  -8.412
  261    HD3  ARG  33           HD1      ARG  33  76.678  16.691  -8.059
  262   HH11  ARG  33          HH21      ARG  33  76.983  19.079  -7.349
  263   HH12  ARG  33          HH22      ARG  33  77.028  19.933  -5.844
  264   HH21  ARG  33          HH11      ARG  33  78.598  17.361  -4.127
  265   HH22  ARG  33          HH12      ARG  33  77.943  18.961  -4.019
  266    H    GLN  34           HN       GLN  34  77.293  12.403  -9.722
  267    HA   GLN  34           HA       GLN  34  78.495  10.393  -9.892
  268    HB2  GLN  34           HB2      GLN  34  78.753  11.381 -12.354
  269    HB3  GLN  34           HB1      GLN  34  80.430  11.583 -11.847
  270    HG2  GLN  34           HG2      GLN  34  80.295   9.407 -12.834
  271    HG3  GLN  34           HG1      GLN  34  80.361   9.149 -11.091
  272   HE21  GLN  34          HE21      GLN  34  77.350  10.434 -11.619
  273   HE22  GLN  34          HE22      GLN  34  76.460   9.003 -11.819
  274    H    THR  35           HN       THR  35  79.919  13.421  -9.183
  275    HA   THR  35           HA       THR  35  81.699  14.004  -7.774
  276    HB   THR  35           HB       THR  35  81.858  11.124  -6.902
  277    HG1  THR  35           HG1      THR  35  79.924  11.221  -6.112
  278   HG21  THR  35          HG21      THR  35  81.892  13.651  -5.252
  279   HG22  THR  35          HG22      THR  35  83.349  13.027  -6.026
  280   HG23  THR  35          HG23      THR  35  82.506  12.056  -4.819
  281    H    ARG  36           HN       ARG  36  82.221  13.056 -10.504
  282    HA   ARG  36           HA       ARG  36  84.067  12.524 -11.844
  283    HE   ARG  36           HE       ARG  36  86.252  14.356 -12.536
  284    HB2  ARG  36           HB2      ARG  36  85.704  12.926  -9.333
  285    HB3  ARG  36           HB1      ARG  36  86.224  13.137 -11.005
  286    HG2  ARG  36           HG2      ARG  36  84.147  14.803  -9.556
  287    HG3  ARG  36           HG1      ARG  36  85.773  15.322 -10.003
  288    HD2  ARG  36           HD2      ARG  36  83.417  14.761 -11.792
  289    HD3  ARG  36           HD1      ARG  36  84.457  16.184 -11.748
  290   HH11  ARG  36          HH21      ARG  36  82.942  14.782 -13.402
  291   HH12  ARG  36          HH22      ARG  36  83.136  14.127 -14.994
  292   HH21  ARG  36          HH11      ARG  36  86.524  13.498 -14.609
  293   HH22  ARG  36          HH12      ARG  36  85.164  13.400 -15.677
  294    H    GLN  37           HN       GLN  37  82.674  10.387 -10.504
  295    HA   GLN  37           HA       GLN  37  82.893   8.063 -10.296
  296    HB2  GLN  37           HB2      GLN  37  85.768   8.406 -11.179
  297    HB3  GLN  37           HB1      GLN  37  84.759   6.971 -11.323
  298    HG2  GLN  37           HG2      GLN  37  83.499   7.865 -13.076
  299    HG3  GLN  37           HG1      GLN  37  83.876   9.530 -12.630
  300   HE21  GLN  37          HE21      GLN  37  84.438   7.552 -15.113
  301   HE22  GLN  37          HE22      GLN  37  86.033   7.968 -15.516
  302    H1U  RCY  38           H1U      RCY  38  86.191   4.260  -0.771
  303    H1S  RCY  38           H1S      RCY  38  84.325   7.788  -3.542
  304    HB1  RCY  38           HB1      RCY  38  84.325   8.500  -6.140
  305    HB2  RCY  38           HB2      RCY  38  84.780  10.204  -6.171
  306    HA   RCY  38           HA       RCY  38  86.984   9.580  -7.131
  307    HN1  RCY  38           HN1      RCY  38  85.775   9.827  -9.128
  308    H    LYS  39           HN       LYS  39  86.103   7.082  -8.988
  309    HA   LYS  39           HA       LYS  39  86.114   4.652  -7.860
  310    HB2  LYS  39           HB2      LYS  39  86.683   5.231 -10.290
  311    HB3  LYS  39           HB1      LYS  39  88.366   5.297  -9.765
  312    HG2  LYS  39           HG2      LYS  39  87.824   2.950  -8.702
  313    HG3  LYS  39           HG1      LYS  39  86.512   2.939  -9.881
  314    HD2  LYS  39           HD2      LYS  39  88.199   1.988 -11.152
  315    HD3  LYS  39           HD1      LYS  39  88.452   3.692 -11.534
  316    HE2  LYS  39           HE2      LYS  39  90.583   2.597 -10.939
  317    HE3  LYS  39           HE1      LYS  39  90.161   3.839  -9.761
  318    HZ1  LYS  39           HZ1      LYS  39  89.089   1.235  -9.158
  319    HZ2  LYS  39           HZ2      LYS  39  89.906   2.334  -8.153
  320    HZ3  LYS  39           HZ3      LYS  39  90.784   1.286  -9.161
  321    H    SER  40           HN       SER  40  89.048   6.693  -7.841
  322    HA   SER  40           HA       SER  40  90.906   5.045  -6.647
  323    HG   SER  40           HG       SER  40  91.007   8.372  -4.673
  324    HB2  SER  40           HB2      SER  40  91.993   6.966  -5.867
  325    HB3  SER  40           HB1      SER  40  90.974   7.621  -7.146
  326    H    LYS  41           HN       LYS  41  90.841   3.754  -4.876
  327    HA   LYS  41           HA       LYS  41  88.950   4.471  -2.664
  328    HB2  LYS  41           HB2      LYS  41  89.195   1.928  -2.181
  329    HB3  LYS  41           HB1      LYS  41  88.198   2.423  -3.550
  330    HG2  LYS  41           HG2      LYS  41  89.848   1.839  -5.123
  331    HG3  LYS  41           HG1      LYS  41  91.134   1.852  -3.915
  332    HD2  LYS  41           HD2      LYS  41  88.873  -0.074  -3.550
  333    HD3  LYS  41           HD1      LYS  41  90.090  -0.439  -4.773
  334    HE2  LYS  41           HE2      LYS  41  91.853  -0.431  -3.167
  335    HE3  LYS  41           HE1      LYS  41  90.829   0.316  -1.941
  336    HZ1  LYS  41           HZ1      LYS  41  89.678  -1.628  -1.586
  337    HZ2  LYS  41           HZ2      LYS  41  91.246  -2.216  -1.875
  338    HZ3  LYS  41           HZ3      LYS  41  90.072  -2.280  -3.102
  339    HA   PRO  42           HA       PRO  42  93.205   4.595  -0.863
  340    HB2  PRO  42           HB2      PRO  42  92.914   6.919   0.529
  341    HB3  PRO  42           HB1      PRO  42  93.349   6.881  -1.191
  342    HG2  PRO  42           HG2      PRO  42  90.737   7.471   0.085
  343    HG3  PRO  42           HG1      PRO  42  91.468   8.164  -1.370
  344    HD2  PRO  42           HD2      PRO  42  89.493   6.197  -1.366
  345    HD3  PRO  42           HD1      PRO  42  90.581   6.543  -2.728
  346    HA   PRO  43           HA       PRO  43  92.296   2.785   3.053
  347    HB2  PRO  43           HB2      PRO  43  94.058   4.226   4.720
  348    HB3  PRO  43           HB1      PRO  43  94.444   2.751   3.816
  349    HG2  PRO  43           HG2      PRO  43  95.023   5.578   3.152
  350    HG3  PRO  43           HG1      PRO  43  95.962   4.115   2.809
  351    HD2  PRO  43           HD2      PRO  43  94.538   5.372   0.878
  352    HD3  PRO  43           HD1      PRO  43  94.722   3.602   0.900
  353    H    LYS  44           HN       LYS  44  91.349   3.220   5.192
  354    HA   LYS  44           HA       LYS  44  89.748   4.314   6.511
  355    HB2  LYS  44           HB2      LYS  44  91.738   6.483   5.845
  356    HB3  LYS  44           HB1      LYS  44  90.332   6.822   6.853
  357    HG2  LYS  44           HG2      LYS  44  92.005   4.426   7.507
  358    HG3  LYS  44           HG1      LYS  44  92.615   6.023   7.945
  359    HD2  LYS  44           HD2      LYS  44  90.640   6.496   9.251
  360    HD3  LYS  44           HD1      LYS  44  89.849   5.028   8.677
  361    HE2  LYS  44           HE2      LYS  44  91.398   3.627   9.855
  362    HE3  LYS  44           HE1      LYS  44  92.453   4.993  10.218
  363    HZ1  LYS  44           HZ1      LYS  44  91.191   5.609  11.937
  364    HZ2  LYS  44           HZ2      LYS  44  90.544   4.040  11.860
  365    HZ3  LYS  44           HZ3      LYS  44  89.735   5.333  11.111
  366    H    LYS  45           HN       LYS  45  88.654   6.907   6.293
  367    HA   LYS  45           HA       LYS  45  86.550   6.598   4.522
  368    HB2  LYS  45           HB2      LYS  45  87.022   9.367   4.431
  369    HB3  LYS  45           HB1      LYS  45  86.003   8.517   5.587
  370    HG2  LYS  45           HG2      LYS  45  87.606   9.827   6.843
  371    HG3  LYS  45           HG1      LYS  45  88.059   8.129   6.999
  372    HD2  LYS  45           HD2      LYS  45  90.116   9.047   6.454
  373    HD3  LYS  45           HD1      LYS  45  89.509   8.668   4.841
  374    HE2  LYS  45           HE2      LYS  45  90.266  10.915   4.690
  375    HE3  LYS  45           HE1      LYS  45  88.513  11.038   4.839
  376    HZ1  LYS  45           HZ1      LYS  45  90.594  11.782   6.725
  377    HZ2  LYS  45           HZ2      LYS  45  89.218  11.043   7.396
  378    HZ3  LYS  45           HZ3      LYS  45  89.060  12.462   6.475
  379    H    GLY  46           HN       GLY  46  86.093   7.544   2.402
  380    HA2  GLY  46           HA2      GLY  46  88.503   7.480   0.661
  381    HA3  GLY  46           HA1      GLY  46  86.840   7.265   0.111
  382    H    VAL  47           HN       VAL  47  89.262   9.337  -0.230
  383    HA   VAL  47           HA       VAL  47  89.467  11.700  -0.383
  384    HB   VAL  47           HB       VAL  47  87.864  12.567  -2.080
  385   HG11  VAL  47          HG11      VAL  47  89.823  11.261  -2.795
  386   HG12  VAL  47          HG12      VAL  47  88.445  10.926  -3.844
  387   HG13  VAL  47          HG13      VAL  47  88.908   9.766  -2.599
  388   HG21  VAL  47          HG21      VAL  47  86.062  11.178  -2.886
  389   HG22  VAL  47          HG22      VAL  47  85.903  11.270  -1.132
  390   HG23  VAL  47          HG23      VAL  47  86.584   9.826  -1.882
  391    H    GLN  48           HN       GLN  48  86.847  13.275  -0.858
  392    HA   GLN  48           HA       GLN  48  85.571  13.214   1.778
  393    HB2  GLN  48           HB2      GLN  48  86.179  15.714   2.112
  394    HB3  GLN  48           HB1      GLN  48  87.404  14.510   2.507
  395    HG2  GLN  48           HG2      GLN  48  88.423  16.294   1.183
  396    HG3  GLN  48           HG1      GLN  48  88.385  14.808   0.233
  397   HE21  GLN  48          HE21      GLN  48  87.109  18.074   0.466
  398   HE22  GLN  48          HE22      GLN  48  86.234  18.039  -0.988
  399    H    GLY  49           HN       GLY  49  84.422  12.822  -0.700
  400    HA2  GLY  49           HA2      GLY  49  82.934  15.381  -1.150
  401    HA3  GLY  49           HA1      GLY  49  83.287  14.246  -2.454
  402    H1U  RCY  50           H1U      RCY  50  81.953   5.771   4.112
  403    H1S  RCY  50           H1S      RCY  50  80.608   8.928   1.974
  404    HB1  RCY  50           HB1      RCY  50  80.495  11.044  -1.170
  405    HB2  RCY  50           HB2      RCY  50  79.540  10.444   0.185
  406    HA   RCY  50           HA       RCY  50  79.498  12.918   0.073
  407    HN1  RCY  50           HN1      RCY  50  82.277  13.325   0.810
  408    H    GLY  51           HN       GLY  51  82.032  11.534   2.200
  409    HA2  GLY  51           HA2      GLY  51  80.432  10.992   4.436
  410    HA3  GLY  51           HA1      GLY  51  82.129  11.461   4.547
  411    H    ASP  52           HN       ASP  52  81.098  14.025   3.025
  412    HA   ASP  52           HA       ASP  52  80.894  15.645   5.423
  413    HB2  ASP  52           HB2      ASP  52  81.903  16.359   3.188
  414    HB3  ASP  52           HB1      ASP  52  80.248  16.522   2.599
  415    H    ASP  53           HN       ASP  53  78.601  14.694   2.859
  416    HA   ASP  53           HA       ASP  53  76.378  15.899   4.417
  417    HB2  ASP  53           HB2      ASP  53  75.013  15.394   2.429
  418    HB3  ASP  53           HB1      ASP  53  76.462  16.292   1.973
  419    H    ILE  54           HN       ILE  54  75.758  14.539   6.062
  420    HA   ILE  54           HA       ILE  54  76.074  11.749   6.149
  421    HB   ILE  54           HB       ILE  54  73.836  12.019   7.657
  422   HG12  ILE  54          HG12      ILE  54  73.819  14.305   8.610
  423   HG13  ILE  54          HG11      ILE  54  75.048  14.795   7.442
  424   HG21  ILE  54          HG21      ILE  54  75.922  11.337   8.611
  425   HG22  ILE  54          HG22      ILE  54  75.427  12.775   9.504
  426   HG23  ILE  54          HG23      ILE  54  76.669  12.895   8.258
  427   HD11  ILE  54          HD11      ILE  54  72.485  13.544   6.487
  428   HD12  ILE  54          HD12      ILE  54  73.577  14.630   5.628
  429   HD13  ILE  54          HD13      ILE  54  72.529  15.258   6.900
  430    HA   PRO  55           HA       PRO  55  73.058  10.360   3.193
  431    HB2  PRO  55           HB2      PRO  55  72.805   7.761   3.976
  432    HB3  PRO  55           HB1      PRO  55  74.247   8.378   3.147
  433    HG2  PRO  55           HG2      PRO  55  73.824   7.838   6.042
  434    HG3  PRO  55           HG1      PRO  55  75.253   7.551   5.036
  435    HD2  PRO  55           HD2      PRO  55  75.002   9.704   6.735
  436    HD3  PRO  55           HD1      PRO  55  76.021   9.715   5.279
  437    H    GLY  56           HN       GLY  56  72.287   8.668   6.257
  438    HA2  GLY  56           HA2      GLY  56  69.673  10.052   6.363
  439    HA3  GLY  56           HA1      GLY  56  69.636   8.298   6.179
  440    H    MET  57           HN       MET  57  72.366   8.798   7.872
  441    HA   MET  57           HA       MET  57  72.951   8.572  10.127
  442    HB2  MET  57           HB2      MET  57  70.258   9.798  10.765
  443    HB3  MET  57           HB1      MET  57  71.720   9.831  11.746
  444    HG2  MET  57           HG2      MET  57  72.836  11.279  10.182
  445    HG3  MET  57           HG1      MET  57  71.551  11.078   8.992
  446    HE1  MET  57           HE1      MET  57  72.127  12.053  12.760
  447    HE2  MET  57           HE2      MET  57  71.739  13.767  12.645
  448    HE3  MET  57           HE3      MET  57  73.038  13.097  11.662
  449    H    GLU  58           HN       GLU  58  70.002   7.252   8.912
  450    HA   GLU  58           HA       GLU  58  69.521   5.588  11.293
  451    HB2  GLU  58           HB2      GLU  58  68.241   5.563   8.541
  452    HB3  GLU  58           HB1      GLU  58  67.698   4.609   9.922
  453    HG2  GLU  58           HG2      GLU  58  67.955   7.617  10.057
  454    HG3  GLU  58           HG1      GLU  58  66.472   6.827   9.517
  455    H    GLY  59           HN       GLY  59  68.757   3.430   9.122
  456    HA2  GLY  59           HA2      GLY  59  70.929   1.678   9.593
  457    HA3  GLY  59           HA1      GLY  59  69.769   1.485   8.278
  458    H1U  RCY  60           H1U      RCY  60  71.527   8.378   0.178
  459    H1S  RCY  60           H1S      RCY  60  69.940   5.309   2.931
  460    HB1  RCY  60           HB1      RCY  60  72.571   5.541   4.648
  461    HB2  RCY  60           HB2      RCY  60  72.039   6.355   6.119
  462    HA   RCY  60           HA       RCY  60  72.877   3.482   5.755
  463    HN1  RCY  60           HN1      RCY  60  70.932   4.467   7.762
  464    H    GLY  61           HN       GLY  61  74.776   5.237   5.463
  465    HA2  GLY  61           HA2      GLY  61  76.662   6.296   6.406
  466    HA3  GLY  61           HA1      GLY  61  75.779   6.405   7.929
  467    H    THR  62           HN       THR  62  75.345   3.991   8.817
  468    HA   THR  62           HA       THR  62  77.748   2.981   9.802
  469    HB   THR  62           HB       THR  62  76.525   1.140  10.586
  470    HG1  THR  62           HG1      THR  62  74.782   0.285   9.429
  471   HG21  THR  62          HG21      THR  62  75.470   3.431  11.077
  472   HG22  THR  62          HG22      THR  62  74.445   2.017  11.320
  473   HG23  THR  62          HG23      THR  62  74.259   3.002   9.869
  474    H    ASP  63           HN       ASP  63  79.470   2.314   8.613
  475    HA   ASP  63           HA       ASP  63  79.503   1.577   5.917
  476    HB2  ASP  63           HB2      ASP  63  81.547   2.015   7.226
  477    HB3  ASP  63           HB1      ASP  63  81.300   0.514   8.119
  478    H    ILE  64           HN       ILE  64  78.070  -0.134   8.465
  479    HA   ILE  64           HA       ILE  64  78.304  -2.748   7.058
  480    HB   ILE  64           HB       ILE  64  77.156  -2.030   9.771
  481   HG12  ILE  64          HG12      ILE  64  79.614  -3.666   9.103
  482   HG13  ILE  64          HG11      ILE  64  79.685  -1.930   9.411
  483   HG21  ILE  64          HG21      ILE  64  77.239  -4.581  10.029
  484   HG22  ILE  64          HG22      ILE  64  77.399  -4.646   8.273
  485   HG23  ILE  64          HG23      ILE  64  75.956  -3.940   9.003
  486   HD11  ILE  64          HD11      ILE  64  80.108  -3.458  11.426
  487   HD12  ILE  64          HD12      ILE  64  78.391  -3.854  11.351
  488   HD13  ILE  64          HD13      ILE  64  78.901  -2.191  11.645
  489    H    THR  65           HN       THR  65  75.809  -0.581   8.409
  490    HA   THR  65           HA       THR  65  73.545  -0.333   7.859
  491    HB   THR  65           HB       THR  65  74.615  -1.213   5.163
  492    HG1  THR  65           HG1      THR  65  74.602   1.134   6.616
  493   HG21  THR  65          HG21      THR  65  71.932  -0.453   6.125
  494   HG22  THR  65          HG22      THR  65  72.399  -1.341   4.675
  495   HG23  THR  65          HG23      THR  65  72.472   0.421   4.692
  496    H    VAL  66           HN       VAL  66  74.471  -2.941   8.849
  497    HA   VAL  66           HA       VAL  66  73.520  -5.029   9.283
  498    HB   VAL  66           HB       VAL  66  71.157  -4.135   7.626
  499   HG11  VAL  66          HG11      VAL  66  71.122  -6.464   8.348
  500   HG12  VAL  66          HG12      VAL  66  69.951  -5.549   9.298
  501   HG13  VAL  66          HG13      VAL  66  71.507  -5.988  10.002
  502   HG21  VAL  66          HG21      VAL  66  70.298  -3.312   9.900
  503   HG22  VAL  66          HG22      VAL  66  71.521  -2.309   9.119
  504   HG23  VAL  66          HG23      VAL  66  71.975  -3.385  10.441
  505    H    ILE  67           HN       ILE  67  73.283  -3.929   5.888
  506    HA   ILE  67           HA       ILE  67  73.827  -6.777   5.106
  507    HB   ILE  67           HB       ILE  67  72.423  -4.656   3.460
  508   HG12  ILE  67          HG12      ILE  67  71.240  -7.112   4.783
  509   HG13  ILE  67          HG11      ILE  67  71.167  -5.503   5.501
  510   HG21  ILE  67          HG21      ILE  67  73.048  -7.587   3.040
  511   HG22  ILE  67          HG22      ILE  67  73.494  -6.227   2.010
  512   HG23  ILE  67          HG23      ILE  67  71.810  -6.741   2.113
  513   HD11  ILE  67          HD11      ILE  67  69.871  -4.646   3.686
  514   HD12  ILE  67          HD12      ILE  67  69.136  -6.191   4.113
  515   HD13  ILE  67          HD13      ILE  67  70.183  -6.073   2.698
  516    H1U  RCY  68           H1U      RCY  68  74.626  -1.608   7.810
  517    H1S  RCY  68           H1S      RCY  68  77.908  -1.498   5.477
  518    HB1  RCY  68           HB1      RCY  68  79.105  -5.254   5.128
  519    HB2  RCY  68           HB2      RCY  68  77.652  -4.473   5.744
  520    HA   RCY  68           HA       RCY  68  77.210  -4.831   2.971
  521    HN1  RCY  68           HN1      RCY  68  76.076  -6.449   5.217
  522    HA   PRO  69           HA       PRO  69  79.369  -8.331   1.353
  523    HB2  PRO  69           HB2      PRO  69  82.045  -7.760   2.301
  524    HB3  PRO  69           HB1      PRO  69  81.395  -7.575   0.664
  525    HG2  PRO  69           HG2      PRO  69  81.797  -5.564   2.740
  526    HG3  PRO  69           HG1      PRO  69  81.587  -5.362   0.996
  527    HD2  PRO  69           HD2      PRO  69  79.674  -4.631   2.805
  528    HD3  PRO  69           HD1      PRO  69  79.278  -5.178   1.159
  529    H    TRP  70           HN       TRP  70  79.458  -7.622   4.703
  530    HA   TRP  70           HA       TRP  70  80.829 -10.087   5.493
  531    HD1  TRP  70           HD1      TRP  70  79.222  -6.172   7.920
  532    HE1  TRP  70           HE1      TRP  70  80.675  -4.226   7.060
  533    HE3  TRP  70           HE3      TRP  70  82.569  -8.766   5.068
  534    HZ2  TRP  70           HZ2      TRP  70  82.960  -3.821   5.380
  535    HZ3  TRP  70           HZ3      TRP  70  84.369  -7.580   3.851
  536    HH2  TRP  70           HH2      TRP  70  84.571  -5.115   4.002
  537    HB2  TRP  70           HB2      TRP  70  79.065  -8.674   7.436
  538    HB3  TRP  70           HB1      TRP  70  80.704  -9.284   7.646
  539    H    GLU  71           HN       GLU  71  77.693  -9.255   4.446
  540    HA   GLU  71           HA       GLU  71  76.748 -11.980   5.087
  541    HB2  GLU  71           HB2      GLU  71  75.249  -9.487   5.956
  542    HB3  GLU  71           HB1      GLU  71  74.633 -11.137   6.062
  543    HG2  GLU  71           HG2      GLU  71  76.698 -11.679   7.461
  544    HG3  GLU  71           HG1      GLU  71  76.981  -9.940   7.546
  545    H    ALA  72           HN       ALA  72  76.674  -9.082   3.219
  546    HA   ALA  72           HA       ALA  72  74.295  -9.758   1.678
  547    HB1  ALA  72           HB1      ALA  72  76.421  -7.929   0.616
  548    HB2  ALA  72           HB2      ALA  72  75.517  -7.433   2.046
  549    HB3  ALA  72           HB3      ALA  72  74.666  -7.770   0.539
  550    H1U  RCY  73           H1U      RCY  73  76.352  -5.839   1.639
  551    H1S  RCY  73           H1S      RCY  73  77.384  -6.530  -2.485
  552    HB1  RCY  73           HB1      RCY  73  75.621  -9.622  -3.308
  553    HB2  RCY  73           HB2      RCY  73  76.886 -10.688  -3.919
  554    HA   RCY  73           HA       RCY  73  75.920 -11.726  -1.958
  555    HN1  RCY  73           HN1      RCY  73  75.543  -9.148  -0.939
  556    H    ASN  74           HN       ASN  74  78.039  -9.928   0.029
  557    HA   ASN  74           HA       ASN  74  80.110 -10.521   0.946
  558    HB2  ASN  74           HB2      ASN  74  80.186 -13.053  -0.658
  559    HB3  ASN  74           HB1      ASN  74  80.705 -12.766   1.002
  560   HD21  ASN  74          HD21      ASN  74  78.175 -14.057  -0.874
  561   HD22  ASN  74          HD22      ASN  74  76.985 -14.120   0.335
  562    H    HIS  75           HN       HIS  75  82.260 -10.205   0.369
  563    HA   HIS  75           HA       HIS  75  84.019  -9.484  -0.991
  564    HD1  HIS  75           HD1      HIS  75  84.911 -10.674   0.056
  565    HD2  HIS  75           HD2      HIS  75  84.612 -13.876  -2.600
  566    HE1  HIS  75           HE1      HIS  75  86.282 -12.558   1.049
  567    HE2  HIS  75           HE2      HIS  75  86.108 -14.513  -0.558
  568    HB2  HIS  75           HB2      HIS  75  82.706 -11.590  -2.712
  569    HB3  HIS  75           HB1      HIS  75  84.136 -10.715  -3.256
  570    H1U  RCY  76           H1U      RCY  76  82.895  -5.744   2.287
  571    H1S  RCY  76           H1S      RCY  76  81.760  -3.347  -1.032
  572    HB1  RCY  76           HB1      RCY  76  83.830  -4.621  -3.109
  573    HB2  RCY  76           HB2      RCY  76  83.227  -5.517  -1.716
  574    HA   RCY  76           HA       RCY  76  82.115  -6.782  -3.991
  575    HN1  RCY  76           HN1      RCY  76  84.372  -7.721  -2.260
  576    H    GLU  77           HN       GLU  77  85.474  -5.675  -3.491
  577    HA   GLU  77           HA       GLU  77  85.930  -5.217  -6.278
  578    HB2  GLU  77           HB2      GLU  77  87.932  -5.731  -4.053
  579    HB3  GLU  77           HB1      GLU  77  88.323  -5.066  -5.639
  580    HG2  GLU  77           HG2      GLU  77  86.265  -3.784  -3.836
  581    HG3  GLU  77           HG1      GLU  77  87.978  -3.372  -3.739
  582    H    LEU  78           HN       LEU  78  88.617  -6.751  -6.088
  583    HA   LEU  78           HA       LEU  78  89.431  -8.860  -6.713
  584    HG   LEU  78           HG       LEU  78  88.296 -11.770  -5.011
  585    HB2  LEU  78           HB2      LEU  78  87.452  -9.437  -4.900
  586    HB3  LEU  78           HB1      LEU  78  86.851 -10.275  -6.327
  587   HD11  LEU  78          HD11      LEU  78  88.290 -11.801  -7.555
  588   HD12  LEU  78          HD12      LEU  78  89.720 -12.502  -6.798
  589   HD13  LEU  78          HD13      LEU  78  89.793 -10.881  -7.488
  590   HD21  LEU  78          HD21      LEU  78  90.328 -11.152  -4.174
  591   HD22  LEU  78          HD22      LEU  78  89.711  -9.515  -4.401
  592   HD23  LEU  78          HD23      LEU  78  90.755 -10.240  -5.623
  593    H    HIS  79           HN       HIS  79  86.941  -7.198  -8.160
  594    HA   HIS  79           HA       HIS  79  86.347  -7.105 -10.441
  595    HD1  HIS  79           HD1      HIS  79  86.346  -9.606 -13.233
  596    HD2  HIS  79           HD2      HIS  79  88.652  -6.194 -12.568
  597    HE1  HIS  79           HE1      HIS  79  86.330  -8.297 -15.402
  598    HE2  HIS  79           HE2      HIS  79  87.730  -6.218 -15.010
  599    HB2  HIS  79           HB2      HIS  79  88.723  -8.300 -10.640
  600    HB3  HIS  79           HB1      HIS  79  87.730  -9.700 -11.040
  601    H    GLU  80           HN       GLU  80  85.667  -9.527  -8.241
  602    HA   GLU  80           HA       GLU  80  83.989 -11.196  -9.940
  603    HB2  GLU  80           HB2      GLU  80  84.966 -12.144  -7.915
  604    HB3  GLU  80           HB1      GLU  80  84.172 -10.922  -6.923
  605    HG2  GLU  80           HG2      GLU  80  82.974 -13.134  -6.940
  606    HG3  GLU  80           HG1      GLU  80  81.981 -11.789  -7.502
  607    H    LEU  81           HN       LEU  81  83.631  -8.142  -8.443
  608    HA   LEU  81           HA       LEU  81  80.920  -8.026  -7.724
  609    HG   LEU  81           HG       LEU  81  83.166  -6.688 -10.067
  610    HB2  LEU  81           HB2      LEU  81  81.050  -5.614  -8.578
  611    HB3  LEU  81           HB1      LEU  81  82.252  -6.075  -7.371
  612   HD11  LEU  81          HD11      LEU  81  82.448  -3.817  -9.405
  613   HD12  LEU  81          HD12      LEU  81  81.803  -4.781 -10.733
  614   HD13  LEU  81          HD13      LEU  81  83.500  -4.299 -10.736
  615   HD21  LEU  81          HD21      LEU  81  84.199  -4.861  -7.873
  616   HD22  LEU  81          HD22      LEU  81  85.126  -5.401  -9.273
  617   HD23  LEU  81          HD23      LEU  81  84.599  -6.568  -8.061
  618    H    ALA  82           HN       ALA  82  82.320  -8.528 -10.836
  619    HA   ALA  82           HA       ALA  82  80.242  -7.531 -12.510
  620    HB1  ALA  82           HB1      ALA  82  82.509  -8.342 -13.268
  621    HB2  ALA  82           HB2      ALA  82  81.164  -8.958 -14.227
  622    HB3  ALA  82           HB3      ALA  82  81.934  -9.991 -13.023
  623    H    GLN  83           HN       GLN  83  78.426  -8.208 -10.991
  624    HA   GLN  83           HA       GLN  83  77.585 -11.032 -11.528
  625    HB2  GLN  83           HB2      GLN  83  77.892 -10.446  -9.124
  626    HB3  GLN  83           HB1      GLN  83  76.683  -9.175  -9.305
  627    HG2  GLN  83           HG2      GLN  83  74.949 -10.652  -9.307
  628    HG3  GLN  83           HG1      GLN  83  75.827 -11.826 -10.288
  629   HE21  GLN  83          HE21      GLN  83  75.530 -13.688  -8.959
  630   HE22  GLN  83          HE22      GLN  83  76.120 -13.799  -7.371
  631    H    TYR  84           HN       TYR  84  77.222  -8.335 -13.036
  632    HA   TYR  84           HA       TYR  84  74.577  -8.908 -14.017
  633    HD1  TYR  84           HD1      TYR  84  72.730  -9.259 -11.765
  634    HD2  TYR  84           HD2      TYR  84  72.624  -5.776 -14.278
  635    HE1  TYR  84           HE1      TYR  84  70.335  -9.682 -12.251
  636    HE2  TYR  84           HE2      TYR  84  70.229  -6.200 -14.764
  637    HH   TYR  84           HH       TYR  84  68.401  -8.605 -13.032
  638    HB2  TYR  84           HB2      TYR  84  74.500  -7.487 -11.666
  639    HB3  TYR  84           HB1      TYR  84  74.510  -6.186 -12.854
  640    H    GLY  85           HN       GLY  85  76.803  -6.134 -13.551
  641    HA2  GLY  85           HA2      GLY  85  77.866  -5.944 -16.089
  642    HA3  GLY  85           HA1      GLY  85  76.302  -5.142 -16.248
  643    H    ILE  86           HN       ILE  86  76.375  -4.192 -13.432
  644    HA   ILE  86           HA       ILE  86  78.037  -1.800 -13.925
  645    HB   ILE  86           HB       ILE  86  76.206  -2.442 -11.586
  646   HG12  ILE  86          HG12      ILE  86  75.619  -0.692 -13.987
  647   HG13  ILE  86          HG11      ILE  86  75.130  -2.385 -13.900
  648   HG21  ILE  86          HG21      ILE  86  77.830  -0.083 -12.425
  649   HG22  ILE  86          HG22      ILE  86  77.439  -0.658 -10.804
  650   HG23  ILE  86          HG23      ILE  86  76.237   0.233 -11.737
  651   HD11  ILE  86          HD11      ILE  86  74.373  -0.260 -11.872
  652   HD12  ILE  86          HD12      ILE  86  73.832  -1.939 -11.874
  653   HD13  ILE  86          HD13      ILE  86  73.319  -0.845 -13.159
  654    H1U  RCY  87           H1U      RCY  87  79.603   2.014  -3.298
  655    H1S  RCY  87           H1S      RCY  87  81.158   0.425  -6.967
  656    HB1  RCY  87           HB1      RCY  87  79.811  -0.407  -9.611
  657    HB2  RCY  87           HB2      RCY  87  81.525  -0.544  -9.994
  658    HA   RCY  87           HA       RCY  87  81.257  -2.551 -11.051
  659    HN1  RCY  87           HN1      RCY  87  78.924  -1.035 -11.485
  Start of MODEL   81
    1    HA   MET   1           HA       MET   1  51.896  13.859  -5.574
    2    HB2  MET   1           HB2      MET   1  50.929  11.530  -5.964
    3    HB3  MET   1           HB1      MET   1  52.118  12.069  -7.149
    4    HG2  MET   1           HG2      MET   1  53.816  10.699  -6.249
    5    HG3  MET   1           HG1      MET   1  52.956  10.485  -4.724
    6    HE1  MET   1           HE1      MET   1  52.691  10.209  -8.459
    7    HE2  MET   1           HE2      MET   1  50.956  10.311  -8.171
    8    HE3  MET   1           HE3      MET   1  51.653   8.817  -8.791
    9    H    ASN   2           HN       ASN   2  53.687  12.275  -3.140
   10    HA   ASN   2           HA       ASN   2  51.511  12.713  -1.214
   11    HB2  ASN   2           HB2      ASN   2  52.603   9.948  -1.807
   12    HB3  ASN   2           HB1      ASN   2  51.699  10.346  -0.345
   13   HD21  ASN   2          HD21      ASN   2  51.419   9.792  -3.807
   14   HD22  ASN   2          HD22      ASN   2  49.726   9.888  -3.876
   15    H    LEU   3           HN       LEU   3  52.345  13.083   0.847
   16    HA   LEU   3           HA       LEU   3  55.155  12.344   1.408
   17    HG   LEU   3           HG       LEU   3  56.829  13.758   2.040
   18    HB2  LEU   3           HB2      LEU   3  54.548  14.882   0.415
   19    HB3  LEU   3           HB1      LEU   3  54.630  15.134   2.156
   20   HD11  LEU   3          HD11      LEU   3  56.387  14.504  -0.862
   21   HD12  LEU   3          HD12      LEU   3  56.658  12.893  -0.198
   22   HD13  LEU   3          HD13      LEU   3  57.967  14.075  -0.206
   23   HD21  LEU   3          HD21      LEU   3  56.950  16.080   2.574
   24   HD22  LEU   3          HD22      LEU   3  56.477  16.555   0.943
   25   HD23  LEU   3          HD23      LEU   3  58.071  15.857   1.230
   26    H    GLU   4           HN       GLU   4  52.086  12.277   2.377
   27    HA   GLU   4           HA       GLU   4  51.989  13.329   4.992
   28    HB2  GLU   4           HB2      GLU   4  50.239  11.656   5.426
   29    HB3  GLU   4           HB1      GLU   4  50.038  12.344   3.816
   30    HG2  GLU   4           HG2      GLU   4  49.828  10.053   3.389
   31    HG3  GLU   4           HG1      GLU   4  51.538  10.331   3.056
   32    HA   PRO   5           HA       PRO   5  54.928  11.316   7.603
   33    HB2  PRO   5           HB2      PRO   5  52.488  10.336   9.057
   34    HB3  PRO   5           HB1      PRO   5  53.977  11.046   9.713
   35    HG2  PRO   5           HG2      PRO   5  51.710  12.461   9.407
   36    HG3  PRO   5           HG1      PRO   5  53.318  13.183   9.258
   37    HD2  PRO   5           HD2      PRO   5  51.309  12.729   7.167
   38    HD3  PRO   5           HD1      PRO   5  52.776  13.730   7.111
   39    HA   PRO   6           HA       PRO   6  54.233   7.158   5.781
   40    HB2  PRO   6           HB2      PRO   6  56.690   6.824   4.714
   41    HB3  PRO   6           HB1      PRO   6  55.469   7.852   3.939
   42    HG2  PRO   6           HG2      PRO   6  57.857   8.623   5.513
   43    HG3  PRO   6           HG1      PRO   6  57.094   9.439   4.141
   44    HD2  PRO   6           HD2      PRO   6  56.768  10.115   6.864
   45    HD3  PRO   6           HD1      PRO   6  55.774  10.701   5.513
   46    H    LYS   7           HN       LYS   7  54.486   5.308   6.985
   47    HA   LYS   7           HA       LYS   7  56.666   5.257   9.030
   48    HB2  LYS   7           HB2      LYS   7  54.342   5.083   9.888
   49    HB3  LYS   7           HB1      LYS   7  54.105   3.639   8.904
   50    HG2  LYS   7           HG2      LYS   7  55.731   2.407  10.138
   51    HG3  LYS   7           HG1      LYS   7  56.347   3.863  10.920
   52    HD2  LYS   7           HD2      LYS   7  54.903   2.568  12.453
   53    HD3  LYS   7           HD1      LYS   7  54.205   4.149  12.100
   54    HE2  LYS   7           HE2      LYS   7  52.583   3.245  10.648
   55    HE3  LYS   7           HE1      LYS   7  53.470   1.733  10.454
   56    HZ1  LYS   7           HZ1      LYS   7  52.199   2.661  12.973
   57    HZ2  LYS   7           HZ2      LYS   7  53.012   1.187  12.746
   58    HZ3  LYS   7           HZ3      LYS   7  51.555   1.491  11.927
   59    H    ALA   8           HN       ALA   8  55.514   3.746   6.156
   60    HA   ALA   8           HA       ALA   8  56.281   1.882   4.954
   61    HB1  ALA   8           HB1      ALA   8  58.673   1.488   5.030
   62    HB2  ALA   8           HB2      ALA   8  58.800   2.296   6.592
   63    HB3  ALA   8           HB3      ALA   8  58.399   3.225   5.148
   64    H    GLU   9           HN       GLU   9  55.167   0.074   5.595
   65    HA   GLU   9           HA       GLU   9  55.628  -1.114   8.244
   66    HB2  GLU   9           HB2      GLU   9  54.009  -2.288   5.973
   67    HB3  GLU   9           HB1      GLU   9  53.839  -2.603   7.699
   68    HG2  GLU   9           HG2      GLU   9  52.081  -1.092   7.211
   69    HG3  GLU   9           HG1      GLU   9  53.338  -0.080   7.924
   70    H1U  RCY  10           H1U      RCY  10  59.287  -6.434   1.115
   71    H1S  RCY  10           H1S      RCY  10  58.568  -4.385   5.169
   72    HB1  RCY  10           HB1      RCY  10  57.643  -5.717   8.161
   73    HB2  RCY  10           HB2      RCY  10  58.246  -4.067   8.005
   74    HA   RCY  10           HA       RCY  10  57.571  -4.412   5.462
   75    HN1  RCY  10           HN1      RCY  10  55.191  -3.863   7.043
   76    H    ARG  11           HN       ARG  11  55.012  -5.039   4.836
   77    HA   ARG  11           HA       ARG  11  54.391  -7.764   5.763
   78    HE   ARG  11           HE       ARG  11  50.316  -9.068   2.257
   79    HB2  ARG  11           HB2      ARG  11  52.646  -5.974   5.228
   80    HB3  ARG  11           HB1      ARG  11  53.039  -6.225   3.530
   81    HG2  ARG  11           HG2      ARG  11  52.378  -8.591   5.262
   82    HG3  ARG  11           HG1      ARG  11  51.075  -7.598   4.609
   83    HD2  ARG  11           HD2      ARG  11  52.361  -7.878   2.340
   84    HD3  ARG  11           HD1      ARG  11  53.098  -9.267   3.139
   85   HH11  ARG  11          HH21      ARG  11  52.613 -10.518   4.380
   86   HH12  ARG  11          HH22      ARG  11  51.678 -11.955   4.626
   87   HH21  ARG  11          HH11      ARG  11  49.081 -10.936   2.566
   88   HH22  ARG  11          HH12      ARG  11  49.678 -12.192   3.599
   89    H    SER  12           HN       SER  12  54.720  -6.369   2.475
   90    HA   SER  12           HA       SER  12  56.765  -8.213   1.661
   91    HG   SER  12           HG       SER  12  56.167 -10.375   0.102
   92    HB2  SER  12           HB2      SER  12  55.012  -9.898   1.829
   93    HB3  SER  12           HB1      SER  12  53.918  -8.902   0.875
   94    H    ALA  13           HN       ALA  13  54.163  -6.020   0.873
   95    HA   ALA  13           HA       ALA  13  55.350  -5.479  -1.801
   96    HB1  ALA  13           HB1      ALA  13  53.311  -4.241  -2.262
   97    HB2  ALA  13           HB2      ALA  13  52.808  -4.365  -0.576
   98    HB3  ALA  13           HB3      ALA  13  52.869  -5.810  -1.587
   99    H    THR  14           HN       THR  14  54.362  -2.732  -1.840
  100    HA   THR  14           HA       THR  14  55.322  -1.153   0.304
  101    HB   THR  14           HB       THR  14  57.547  -1.804   0.071
  102    HG1  THR  14           HG1      THR  14  57.707   0.023  -2.016
  103   HG21  THR  14          HG21      THR  14  57.647  -3.328  -1.653
  104   HG22  THR  14          HG22      THR  14  58.442  -1.965  -2.442
  105   HG23  THR  14          HG23      THR  14  56.739  -2.297  -2.758
  106    H    ARG  15           HN       ARG  15  53.344  -0.186  -0.607
  107    HA   ARG  15           HA       ARG  15  53.569   1.129  -3.229
  108    HE   ARG  15           HE       ARG  15  49.690   0.318  -5.171
  109    HB2  ARG  15           HB2      ARG  15  51.431   0.895  -1.120
  110    HB3  ARG  15           HB1      ARG  15  51.294   2.121  -2.380
  111    HG2  ARG  15           HG2      ARG  15  51.524   0.370  -4.109
  112    HG3  ARG  15           HG1      ARG  15  51.642  -0.856  -2.846
  113    HD2  ARG  15           HD2      ARG  15  49.404  -0.884  -2.532
  114    HD3  ARG  15           HD1      ARG  15  49.316   0.877  -2.492
  115   HH11  ARG  15          HH21      ARG  15  47.541  -0.740  -2.692
  116   HH12  ARG  15          HH22      ARG  15  46.221  -1.031  -3.776
  117   HH21  ARG  15          HH11      ARG  15  47.979  -0.055  -6.601
  118   HH22  ARG  15          HH12      ARG  15  46.469  -0.643  -5.989
  119    H    VAL  16           HN       VAL  16  55.523   1.912  -1.251
  120    HA   VAL  16           HA       VAL  16  54.758   4.399  -0.002
  121    HB   VAL  16           HB       VAL  16  57.527   3.429  -0.775
  122   HG11  VAL  16          HG11      VAL  16  58.096   4.881   1.272
  123   HG12  VAL  16          HG12      VAL  16  56.484   5.570   1.084
  124   HG13  VAL  16          HG13      VAL  16  57.669   5.734  -0.212
  125   HG21  VAL  16          HG21      VAL  16  55.800   2.962   1.669
  126   HG22  VAL  16          HG22      VAL  16  57.546   2.715   1.675
  127   HG23  VAL  16          HG23      VAL  16  56.523   1.749   0.612
  128    H    MET  17           HN       MET  17  57.575   4.670  -1.990
  129    HA   MET  17           HA       MET  17  56.292   6.900  -3.451
  130    HB2  MET  17           HB2      MET  17  58.594   7.064  -2.359
  131    HB3  MET  17           HB1      MET  17  59.173   5.992  -3.634
  132    HG2  MET  17           HG2      MET  17  58.530   7.571  -5.349
  133    HG3  MET  17           HG1      MET  17  57.718   8.596  -4.166
  134    HE1  MET  17           HE1      MET  17  58.677  10.717  -4.160
  135    HE2  MET  17           HE2      MET  17  60.159  11.075  -3.276
  136    HE3  MET  17           HE3      MET  17  58.868  10.170  -2.490
  137    H    GLY  18           HN       GLY  18  58.699   4.523  -4.594
  138    HA2  GLY  18           HA2      GLY  18  57.289   4.419  -7.186
  139    HA3  GLY  18           HA1      GLY  18  58.858   3.693  -6.831
  140    H    GLY  19           HN       GLY  19  56.049   2.696  -7.853
  141    HA2  GLY  19           HA2      GLY  19  55.547   0.556  -5.873
  142    HA3  GLY  19           HA1      GLY  19  54.580   0.877  -7.313
  143    HA   PRO  20           HA       PRO  20  56.482  -2.303  -9.680
  144    HB2  PRO  20           HB2      PRO  20  57.455  -0.296 -11.660
  145    HB3  PRO  20           HB1      PRO  20  56.431  -1.722 -11.909
  146    HG2  PRO  20           HG2      PRO  20  55.436   0.759 -11.940
  147    HG3  PRO  20           HG1      PRO  20  54.515  -0.619 -11.314
  148    HD2  PRO  20           HD2      PRO  20  55.843   1.593  -9.813
  149    HD3  PRO  20           HD1      PRO  20  54.394   0.654  -9.394
  150    H1U  RCY  21           H1U      RCY  21  59.148  -0.083  -3.980
  151    H1S  RCY  21           H1S      RCY  21  61.373  -1.337  -7.839
  152    HB1  RCY  21           HB1      RCY  21  61.885  -3.533 -10.880
  153    HB2  RCY  21           HB2      RCY  21  60.248  -3.930 -10.360
  154    HA   RCY  21           HA       RCY  21  60.959  -1.224  -9.563
  155    HN1  RCY  21           HN1      RCY  21  58.775  -2.020 -11.427
  156    H    THR  22           HN       THR  22  61.557   0.524 -10.867
  157    HA   THR  22           HA       THR  22  62.733  -0.202 -13.509
  158    HB   THR  22           HB       THR  22  61.839   2.038 -14.355
  159    HG1  THR  22           HG1      THR  22  61.045   3.100 -12.698
  160   HG21  THR  22          HG21      THR  22  59.535   1.073 -14.753
  161   HG22  THR  22          HG22      THR  22  59.973  -0.243 -13.665
  162   HG23  THR  22          HG23      THR  22  60.866  -0.007 -15.167
  163    HA   PRO  23           HA       PRO  23  65.959   1.859 -10.956
  164    HB2  PRO  23           HB2      PRO  23  67.415   1.227 -13.497
  165    HB3  PRO  23           HB1      PRO  23  67.928   0.987 -11.815
  166    HG2  PRO  23           HG2      PRO  23  67.092  -1.047 -13.309
  167    HG3  PRO  23           HG1      PRO  23  66.704  -0.952 -11.583
  168    HD2  PRO  23           HD2      PRO  23  64.926  -0.496 -13.938
  169    HD3  PRO  23           HD1      PRO  23  64.521  -1.105 -12.317
  170    H    ARG  24           HN       ARG  24  66.217   4.054 -10.921
  171    HA   ARG  24           HA       ARG  24  66.773   5.561 -13.357
  172    HE   ARG  24           HE       ARG  24  62.536   7.528  -9.322
  173    HB2  ARG  24           HB2      ARG  24  64.787   7.064 -13.111
  174    HB3  ARG  24           HB1      ARG  24  64.356   5.423 -13.588
  175    HG2  ARG  24           HG2      ARG  24  63.210   5.052 -11.668
  176    HG3  ARG  24           HG1      ARG  24  64.483   5.766 -10.677
  177    HD2  ARG  24           HD2      ARG  24  63.683   8.031 -11.335
  178    HD3  ARG  24           HD1      ARG  24  62.366   7.279 -12.236
  179   HH11  ARG  24          HH21      ARG  24  61.232   5.877 -12.054
  180   HH12  ARG  24          HH22      ARG  24  59.836   5.300 -11.206
  181   HH21  ARG  24          HH11      ARG  24  60.721   6.784  -8.199
  182   HH22  ARG  24          HH12      ARG  24  59.547   5.813  -9.024
  183    H    LYS  25           HN       LYS  25  68.582   5.662 -11.609
  184    HA   LYS  25           HA       LYS  25  69.738   6.915  -9.994
  185    HB2  LYS  25           HB2      LYS  25  67.776   9.050 -10.895
  186    HB3  LYS  25           HB1      LYS  25  69.270   9.335 -10.007
  187    HG2  LYS  25           HG2      LYS  25  69.940   9.711 -12.221
  188    HG3  LYS  25           HG1      LYS  25  70.391   8.022 -11.979
  189    HD2  LYS  25           HD2      LYS  25  68.563   7.223 -13.218
  190    HD3  LYS  25           HD1      LYS  25  67.662   8.730 -13.038
  191    HE2  LYS  25           HE2      LYS  25  70.284   8.636 -14.531
  192    HE3  LYS  25           HE1      LYS  25  68.755   8.276 -15.333
  193    HZ1  LYS  25           HZ1      LYS  25  69.050  10.725 -13.723
  194    HZ2  LYS  25           HZ2      LYS  25  67.975  10.404 -14.999
  195    HZ3  LYS  25           HZ3      LYS  25  69.620  10.683 -15.321
  196    H    GLY  26           HN       GLY  26  66.716   8.674  -9.509
  197    HA2  GLY  26           HA2      GLY  26  65.083   8.274  -7.767
  198    HA3  GLY  26           HA1      GLY  26  66.230   7.189  -6.980
  199    HA   PRO  27           HA       PRO  27  66.039  11.807  -5.332
  200    HB2  PRO  27           HB2      PRO  27  65.407  10.152  -2.915
  201    HB3  PRO  27           HB1      PRO  27  64.811  11.762  -3.363
  202    HG2  PRO  27           HG2      PRO  27  63.324   9.559  -3.672
  203    HG3  PRO  27           HG1      PRO  27  63.229  10.929  -4.790
  204    HD2  PRO  27           HD2      PRO  27  64.388   8.238  -5.230
  205    HD3  PRO  27           HD1      PRO  27  63.804   9.423  -6.419
  206    HA   PRO  28           HA       PRO  28  70.351  11.453  -4.239
  207    HB2  PRO  28           HB2      PRO  28  69.563  13.288  -2.000
  208    HB3  PRO  28           HB1      PRO  28  70.921  13.417  -3.135
  209    HG2  PRO  28           HG2      PRO  28  68.684  14.873  -3.406
  210    HG3  PRO  28           HG1      PRO  28  69.628  14.310  -4.794
  211    HD2  PRO  28           HD2      PRO  28  66.964  13.423  -3.876
  212    HD3  PRO  28           HD1      PRO  28  67.726  13.234  -5.469
  213    H    LYS  29           HN       LYS  29  71.320   9.845  -3.052
  214    HA   LYS  29           HA       LYS  29  69.861   8.705  -0.748
  215    HB2  LYS  29           HB2      LYS  29  71.029   7.365  -2.652
  216    HB3  LYS  29           HB1      LYS  29  72.521   7.731  -1.788
  217    HG2  LYS  29           HG2      LYS  29  71.942   5.728  -0.769
  218    HG3  LYS  29           HG1      LYS  29  71.131   6.869   0.304
  219    HD2  LYS  29           HD2      LYS  29  69.097   6.610  -1.267
  220    HD3  LYS  29           HD1      LYS  29  69.927   5.184  -1.891
  221    HE2  LYS  29           HE2      LYS  29  68.807   5.672   0.851
  222    HE3  LYS  29           HE1      LYS  29  68.644   4.252  -0.182
  223    HZ1  LYS  29           HZ1      LYS  29  70.806   5.003   1.619
  224    HZ2  LYS  29           HZ2      LYS  29  71.257   4.257   0.161
  225    HZ3  LYS  29           HZ3      LYS  29  70.201   3.467   1.232
  226    H1U  RCY  30           H1U      RCY  30  73.084   7.983   3.884
  227    H1S  RCY  30           H1S      RCY  30  75.627  11.821   2.336
  228    HB1  RCY  30           HB1      RCY  30  72.545  13.407   0.066
  229    HB2  RCY  30           HB2      RCY  30  73.950  12.484  -0.468
  230    HA   RCY  30           HA       RCY  30  73.505  10.784   1.252
  231    HN1  RCY  30           HN1      RCY  30  71.364  11.367  -0.711
  232    H    LYS  31           HN       LYS  31  71.029  10.023   2.219
  233    HA   LYS  31           HA       LYS  31  70.489  12.128   4.279
  234    HB2  LYS  31           HB2      LYS  31  68.672  11.000   2.363
  235    HB3  LYS  31           HB1      LYS  31  68.193  10.435   3.961
  236    HG2  LYS  31           HG2      LYS  31  67.059  12.503   3.698
  237    HG3  LYS  31           HG1      LYS  31  68.450  12.888   4.713
  238    HD2  LYS  31           HD2      LYS  31  69.689  13.497   2.575
  239    HD3  LYS  31           HD1      LYS  31  68.137  13.385   1.744
  240    HE2  LYS  31           HE2      LYS  31  68.344  15.679   2.320
  241    HE3  LYS  31           HE1      LYS  31  67.254  15.009   3.534
  242    HZ1  LYS  31           HZ1      LYS  31  70.088  14.872   4.153
  243    HZ2  LYS  31           HZ2      LYS  31  68.769  15.241   5.159
  244    HZ3  LYS  31           HZ3      LYS  31  69.416  16.430   4.132
  245    H    GLN  32           HN       GLN  32  72.145   9.502   4.053
  246    HA   GLN  32           HA       GLN  32  70.842   7.862   6.133
  247    HB2  GLN  32           HB2      GLN  32  73.422   7.553   4.581
  248    HB3  GLN  32           HB1      GLN  32  72.917   6.435   5.848
  249    HG2  GLN  32           HG2      GLN  32  71.184   7.117   3.461
  250    HG3  GLN  32           HG1      GLN  32  72.280   5.735   3.493
  251   HE21  GLN  32          HE21      GLN  32  69.219   6.967   4.685
  252   HE22  GLN  32          HE22      GLN  32  68.758   5.561   5.517
  253    H    ARG  33           HN       ARG  33  73.509  10.100   5.765
  254    HA   ARG  33           HA       ARG  33  74.963  11.046   7.348
  255    HE   ARG  33           HE       ARG  33  74.126  14.809  11.149
  256    HB2  ARG  33           HB2      ARG  33  72.491  11.560   8.171
  257    HB3  ARG  33           HB1      ARG  33  72.937  10.475   9.487
  258    HG2  ARG  33           HG2      ARG  33  74.934  11.855   9.950
  259    HG3  ARG  33           HG1      ARG  33  74.479  12.947   8.641
  260    HD2  ARG  33           HD2      ARG  33  72.168  12.970  10.007
  261    HD3  ARG  33           HD1      ARG  33  73.263  12.615  11.342
  262   HH11  ARG  33          HH21      ARG  33  72.287  13.867   8.389
  263   HH12  ARG  33          HH22      ARG  33  72.304  15.444   7.673
  264   HH21  ARG  33          HH11      ARG  33  74.159  16.874  10.230
  265   HH22  ARG  33          HH12      ARG  33  73.365  17.146   8.716
  266    H    GLN  34           HN       GLN  34  74.340   7.879   7.254
  267    HA   GLN  34           HA       GLN  34  74.931   6.005   8.625
  268    HB2  GLN  34           HB2      GLN  34  77.392   5.808   8.595
  269    HB3  GLN  34           HB1      GLN  34  76.774   6.400   7.054
  270    HG2  GLN  34           HG2      GLN  34  77.247   8.740   7.823
  271    HG3  GLN  34           HG1      GLN  34  77.999   8.070   9.271
  272   HE21  GLN  34          HE21      GLN  34  79.825   9.459   7.974
  273   HE22  GLN  34          HE22      GLN  34  80.828   8.513   6.985
  274    H    THR  35           HN       THR  35  73.886   7.925  10.386
  275    HA   THR  35           HA       THR  35  75.674   8.645  12.502
  276    HB   THR  35           HB       THR  35  73.421   8.595  13.854
  277    HG1  THR  35           HG1      THR  35  72.033   8.886  11.576
  278   HG21  THR  35          HG21      THR  35  74.285  10.698  13.223
  279   HG22  THR  35          HG22      THR  35  72.676  10.673  12.503
  280   HG23  THR  35          HG23      THR  35  74.094  10.358  11.503
  281    H    ARG  36           HN       ARG  36  74.344   5.620  11.567
  282    HA   ARG  36           HA       ARG  36  74.618   4.424  14.250
  283    HE   ARG  36           HE       ARG  36  70.428   5.072  13.902
  284    HB2  ARG  36           HB2      ARG  36  74.012   3.129  11.573
  285    HB3  ARG  36           HB1      ARG  36  73.880   2.351  13.149
  286    HG2  ARG  36           HG2      ARG  36  72.402   4.919  12.686
  287    HG3  ARG  36           HG1      ARG  36  71.744   3.428  12.009
  288    HD2  ARG  36           HD2      ARG  36  71.538   2.418  14.145
  289    HD3  ARG  36           HD1      ARG  36  72.595   3.610  14.901
  290   HH11  ARG  36          HH21      ARG  36  70.991   2.434  16.049
  291   HH12  ARG  36          HH22      ARG  36  69.626   2.789  17.055
  292   HH21  ARG  36          HH11      ARG  36  68.643   5.551  15.203
  293   HH22  ARG  36          HH12      ARG  36  68.297   4.553  16.576
  294    H    GLN  37           HN       GLN  37  76.476   4.788  11.327
  295    HA   GLN  37           HA       GLN  37  78.629   4.049  10.762
  296    HB2  GLN  37           HB2      GLN  37  78.945   5.159  13.093
  297    HB3  GLN  37           HB1      GLN  37  79.065   3.508  13.699
  298    HG2  GLN  37           HG2      GLN  37  80.842   3.103  11.930
  299    HG3  GLN  37           HG1      GLN  37  80.829   4.842  11.633
  300   HE21  GLN  37          HE21      GLN  37  80.807   6.055  14.028
  301   HE22  GLN  37          HE22      GLN  37  82.067   5.527  15.036
  302    H1U  RCY  38           H1U      RCY  38  84.103  -0.845   5.524
  303    H1S  RCY  38           H1S      RCY  38  82.664  -0.128   9.547
  304    HB1  RCY  38           HB1      RCY  38  80.111  -1.407  11.097
  305    HB2  RCY  38           HB2      RCY  38  81.219  -0.602  12.207
  306    HA   RCY  38           HA       RCY  38  78.250  -0.379  11.988
  307    HN1  RCY  38           HN1      RCY  38  79.744   2.005  12.976
  308    H    LYS  39           HN       LYS  39  81.250  -0.072  13.892
  309    HA   LYS  39           HA       LYS  39  79.985  -0.401  16.447
  310    HB2  LYS  39           HB2      LYS  39  79.558  -2.676  15.408
  311    HB3  LYS  39           HB1      LYS  39  81.303  -2.916  15.383
  312    HG2  LYS  39           HG2      LYS  39  81.465  -2.916  17.731
  313    HG3  LYS  39           HG1      LYS  39  79.902  -2.121  17.929
  314    HD2  LYS  39           HD2      LYS  39  80.179  -4.880  16.721
  315    HD3  LYS  39           HD1      LYS  39  79.945  -4.620  18.450
  316    HE2  LYS  39           HE2      LYS  39  77.731  -4.718  17.897
  317    HE3  LYS  39           HE1      LYS  39  77.980  -3.030  17.450
  318    HZ1  LYS  39           HZ1      LYS  39  78.644  -5.043  15.449
  319    HZ2  LYS  39           HZ2      LYS  39  77.951  -3.504  15.256
  320    HZ3  LYS  39           HZ3      LYS  39  76.996  -4.810  15.776
  321    H    SER  40           HN       SER  40  82.887  -2.172  15.412
  322    HA   SER  40           HA       SER  40  84.886  -0.282  15.693
  323    HG   SER  40           HG       SER  40  86.448  -0.771  17.847
  324    HB2  SER  40           HB2      SER  40  84.477   0.492  17.820
  325    HB3  SER  40           HB1      SER  40  83.655  -0.987  18.309
  326    H    LYS  41           HN       LYS  41  85.659  -2.000  14.253
  327    HA   LYS  41           HA       LYS  41  86.955  -4.223  15.786
  328    HB2  LYS  41           HB2      LYS  41  86.648  -5.494  13.498
  329    HB3  LYS  41           HB1      LYS  41  85.313  -5.432  14.646
  330    HG2  LYS  41           HG2      LYS  41  85.568  -3.230  12.631
  331    HG3  LYS  41           HG1      LYS  41  84.927  -4.786  12.104
  332    HD2  LYS  41           HD2      LYS  41  83.008  -4.569  13.339
  333    HD3  LYS  41           HD1      LYS  41  83.821  -3.696  14.639
  334    HE2  LYS  41           HE2      LYS  41  82.241  -2.240  13.389
  335    HE3  LYS  41           HE1      LYS  41  83.905  -1.671  13.263
  336    HZ1  LYS  41           HZ1      LYS  41  82.148  -2.646  11.216
  337    HZ2  LYS  41           HZ2      LYS  41  83.669  -3.401  11.190
  338    HZ3  LYS  41           HZ3      LYS  41  83.556  -1.710  11.079
  339    HA   PRO  42           HA       PRO  42  90.635  -2.801  13.778
  340    HB2  PRO  42           HB2      PRO  42  92.130  -5.090  13.739
  341    HB3  PRO  42           HB1      PRO  42  91.800  -4.179  15.226
  342    HG2  PRO  42           HG2      PRO  42  90.495  -6.651  14.201
  343    HG3  PRO  42           HG1      PRO  42  90.960  -6.221  15.856
  344    HD2  PRO  42           HD2      PRO  42  88.386  -6.024  14.930
  345    HD3  PRO  42           HD1      PRO  42  89.036  -4.988  16.220
  346    HA   PRO  43           HA       PRO  43  90.526  -3.629   9.433
  347    HB2  PRO  43           HB2      PRO  43  93.221  -3.593   8.789
  348    HB3  PRO  43           HB1      PRO  43  92.239  -2.142   9.062
  349    HG2  PRO  43           HG2      PRO  43  94.121  -3.521  10.904
  350    HG3  PRO  43           HG1      PRO  43  93.832  -1.789  10.669
  351    HD2  PRO  43           HD2      PRO  43  92.809  -3.143  12.792
  352    HD3  PRO  43           HD1      PRO  43  91.955  -1.774  12.043
  353    H    LYS  44           HN       LYS  44  91.271  -5.188   7.731
  354    HA   LYS  44           HA       LYS  44  92.103  -7.281   6.990
  355    HB2  LYS  44           HB2      LYS  44  93.660  -7.036   9.139
  356    HB3  LYS  44           HB1      LYS  44  92.572  -8.267   9.781
  357    HG2  LYS  44           HG2      LYS  44  94.162  -9.609   8.751
  358    HG3  LYS  44           HG1      LYS  44  93.007  -9.413   7.431
  359    HD2  LYS  44           HD2      LYS  44  95.073  -8.912   6.417
  360    HD3  LYS  44           HD1      LYS  44  94.415  -7.321   6.802
  361    HE2  LYS  44           HE2      LYS  44  95.741  -7.999   9.128
  362    HE3  LYS  44           HE1      LYS  44  96.790  -8.669   7.880
  363    HZ1  LYS  44           HZ1      LYS  44  96.053  -5.885   8.395
  364    HZ2  LYS  44           HZ2      LYS  44  96.319  -6.349   6.782
  365    HZ3  LYS  44           HZ3      LYS  44  97.549  -6.542   7.939
  366    H    LYS  45           HN       LYS  45  90.628  -7.885  10.210
  367    HA   LYS  45           HA       LYS  45  88.440  -9.348   8.776
  368    HB2  LYS  45           HB2      LYS  45  88.465 -10.823  10.924
  369    HB3  LYS  45           HB1      LYS  45  89.699 -11.107   9.697
  370    HG2  LYS  45           HG2      LYS  45  91.350  -9.912  10.937
  371    HG3  LYS  45           HG1      LYS  45  90.142  -9.231  12.026
  372    HD2  LYS  45           HD2      LYS  45  90.380 -12.210  11.843
  373    HD3  LYS  45           HD1      LYS  45  91.594 -11.323  12.766
  374    HE2  LYS  45           HE2      LYS  45  88.592 -11.184  13.181
  375    HE3  LYS  45           HE1      LYS  45  89.747 -11.999  14.235
  376    HZ1  LYS  45           HZ1      LYS  45  89.133  -9.193  13.999
  377    HZ2  LYS  45           HZ2      LYS  45  90.798  -9.531  14.024
  378    HZ3  LYS  45           HZ3      LYS  45  89.803 -10.051  15.300
  379    H    GLY  46           HN       GLY  46  86.472  -8.542   9.273
  380    HA2  GLY  46           HA2      GLY  46  86.217  -6.678  11.554
  381    HA3  GLY  46           HA1      GLY  46  85.009  -6.939  10.294
  382    H    VAL  47           HN       VAL  47  85.539  -7.441  13.506
  383    HA   VAL  47           HA       VAL  47  84.708 -10.130  13.941
  384    HB   VAL  47           HB       VAL  47  84.110  -7.719  15.682
  385   HG11  VAL  47          HG11      VAL  47  82.842  -9.689  16.346
  386   HG12  VAL  47          HG12      VAL  47  84.158  -9.448  17.494
  387   HG13  VAL  47          HG13      VAL  47  84.289 -10.693  16.252
  388   HG21  VAL  47          HG21      VAL  47  86.515  -9.569  15.571
  389   HG22  VAL  47          HG22      VAL  47  86.223  -8.382  16.843
  390   HG23  VAL  47          HG23      VAL  47  86.501  -7.848  15.185
  391    H    GLN  48           HN       GLN  48  82.789  -7.130  13.648
  392    HA   GLN  48           HA       GLN  48  80.561  -8.557  12.489
  393    HB2  GLN  48           HB2      GLN  48  80.426  -9.192  14.956
  394    HB3  GLN  48           HB1      GLN  48  80.080  -7.493  15.280
  395    HG2  GLN  48           HG2      GLN  48  78.238  -7.767  13.452
  396    HG3  GLN  48           HG1      GLN  48  78.427  -9.494  13.755
  397   HE21  GLN  48          HE21      GLN  48  77.684  -6.399  15.414
  398   HE22  GLN  48          HE22      GLN  48  76.809  -7.111  16.682
  399    H    GLY  49           HN       GLY  49  81.738  -6.431  11.411
  400    HA2  GLY  49           HA2      GLY  49  79.653  -4.454  11.289
  401    HA3  GLY  49           HA1      GLY  49  81.015  -3.836  12.224
  402    H1U  RCY  50           H1U      RCY  50  82.558  -0.468   2.135
  403    H1S  RCY  50           H1S      RCY  50  83.043  -2.919   6.272
  404    HB1  RCY  50           HB1      RCY  50  81.577  -4.071   7.220
  405    HB2  RCY  50           HB2      RCY  50  81.604  -5.817   7.455
  406    HA   RCY  50           HA       RCY  50  83.969  -5.457   8.434
  407    HN1  RCY  50           HN1      RCY  50  82.584  -5.837  10.295
  408    H    GLY  51           HN       GLY  51  84.873  -3.731  10.083
  409    HA2  GLY  51           HA2      GLY  51  84.449  -0.965   9.081
  410    HA3  GLY  51           HA1      GLY  51  85.275  -1.395  10.579
  411    H    ASP  52           HN       ASP  52  86.862   0.212   9.529
  412    HA   ASP  52           HA       ASP  52  89.073  -1.316   8.413
  413    HB2  ASP  52           HB2      ASP  52  87.531  -0.748   6.425
  414    HB3  ASP  52           HB1      ASP  52  88.024   0.927   6.680
  415    H    ASP  53           HN       ASP  53  87.808   1.192  10.161
  416    HA   ASP  53           HA       ASP  53  88.789   2.983  11.310
  417    HB2  ASP  53           HB2      ASP  53  90.562   1.096  11.616
  418    HB3  ASP  53           HB1      ASP  53  91.488   1.983  10.405
  419    H    ILE  54           HN       ILE  54  88.817   2.615   8.066
  420    HA   ILE  54           HA       ILE  54  89.839   5.385   7.650
  421    HB   ILE  54           HB       ILE  54  90.481   2.980   5.919
  422   HG12  ILE  54          HG12      ILE  54  92.307   4.846   7.463
  423   HG13  ILE  54          HG11      ILE  54  91.815   3.251   8.034
  424   HG21  ILE  54          HG21      ILE  54  90.090   4.913   4.510
  425   HG22  ILE  54          HG22      ILE  54  91.832   4.667   4.628
  426   HG23  ILE  54          HG23      ILE  54  91.055   5.936   5.573
  427   HD11  ILE  54          HD11      ILE  54  92.811   2.216   6.034
  428   HD12  ILE  54          HD12      ILE  54  94.017   3.158   6.911
  429   HD13  ILE  54          HD13      ILE  54  93.289   3.807   5.442
  430    HA   PRO  55           HA       PRO  55  85.756   5.001   5.649
  431    HB2  PRO  55           HB2      PRO  55  84.974   7.579   5.999
  432    HB3  PRO  55           HB1      PRO  55  84.895   6.376   7.301
  433    HG2  PRO  55           HG2      PRO  55  86.863   8.550   6.857
  434    HG3  PRO  55           HG1      PRO  55  86.217   7.899   8.371
  435    HD2  PRO  55           HD2      PRO  55  88.715   7.263   7.285
  436    HD3  PRO  55           HD1      PRO  55  87.861   6.310   8.517
  437    H    GLY  56           HN       GLY  56  84.805   6.116   3.705
  438    HA2  GLY  56           HA2      GLY  56  85.024   7.008   1.543
  439    HA3  GLY  56           HA1      GLY  56  86.246   8.090   2.216
  440    H    MET  57           HN       MET  57  87.111   4.974   2.961
  441    HA   MET  57           HA       MET  57  89.187   3.970   2.303
  442    HB2  MET  57           HB2      MET  57  88.672   2.698   0.120
  443    HB3  MET  57           HB1      MET  57  87.597   2.423   1.489
  444    HG2  MET  57           HG2      MET  57  87.000   4.563  -0.553
  445    HG3  MET  57           HG1      MET  57  86.505   2.891  -0.812
  446    HE1  MET  57           HE1      MET  57  84.181   2.592  -0.650
  447    HE2  MET  57           HE2      MET  57  84.100   4.315  -1.008
  448    HE3  MET  57           HE3      MET  57  83.063   3.631   0.242
  449    H    GLU  58           HN       GLU  58  88.847   4.060  -1.020
  450    HA   GLU  58           HA       GLU  58  90.897   6.235  -1.219
  451    HB2  GLU  58           HB2      GLU  58  91.500   3.828  -1.884
  452    HB3  GLU  58           HB1      GLU  58  90.411   4.053  -3.253
  453    HG2  GLU  58           HG2      GLU  58  92.542   4.669  -4.090
  454    HG3  GLU  58           HG1      GLU  58  91.748   6.204  -3.734
  455    H    GLY  59           HN       GLY  59  87.816   5.062  -2.388
  456    HA2  GLY  59           HA2      GLY  59  86.880   7.543  -3.287
  457    HA3  GLY  59           HA1      GLY  59  87.642   6.792  -4.690
  458    H1U  RCY  60           H1U      RCY  60  79.401   4.410   0.558
  459    H1S  RCY  60           H1S      RCY  60  81.718   7.763  -1.289
  460    HB1  RCY  60           HB1      RCY  60  83.200   4.556  -3.158
  461    HB2  RCY  60           HB2      RCY  60  81.863   5.297  -4.039
  462    HA   RCY  60           HA       RCY  60  84.031   4.424  -5.318
  463    HN1  RCY  60           HN1      RCY  60  85.130   7.088  -5.209
  464    H    GLY  61           HN       GLY  61  84.467   7.326  -6.600
  465    HA2  GLY  61           HA2      GLY  61  83.410   8.585  -8.275
  466    HA3  GLY  61           HA1      GLY  61  82.742   7.033  -8.784
  467    H    THR  62           HN       THR  62  80.571   7.113  -8.919
  468    HA   THR  62           HA       THR  62  79.041   8.337  -6.693
  469    HB   THR  62           HB       THR  62  77.763   9.773  -8.086
  470    HG1  THR  62           HG1      THR  62  77.317   9.018  -9.977
  471   HG21  THR  62          HG21      THR  62  80.588   9.891  -9.177
  472   HG22  THR  62          HG22      THR  62  80.085  10.568  -7.628
  473   HG23  THR  62          HG23      THR  62  79.425  11.216  -9.130
  474    H    ASP  63           HN       ASP  63  77.010   7.980  -9.273
  475    HA   ASP  63           HA       ASP  63  75.820   5.574  -8.204
  476    HB2  ASP  63           HB2      ASP  63  75.328   7.061 -10.799
  477    HB3  ASP  63           HB1      ASP  63  74.331   5.734 -10.206
  478    H    ILE  64           HN       ILE  64  78.615   5.225  -9.069
  479    HA   ILE  64           HA       ILE  64  78.155   2.887 -10.820
  480    HB   ILE  64           HB       ILE  64  78.968   3.889 -12.676
  481   HG12  ILE  64          HG12      ILE  64  81.476   4.443 -11.061
  482   HG13  ILE  64          HG11      ILE  64  81.091   2.878 -11.777
  483   HG21  ILE  64          HG21      ILE  64  79.688   6.184 -10.829
  484   HG22  ILE  64          HG22      ILE  64  78.244   6.047 -11.832
  485   HG23  ILE  64          HG23      ILE  64  79.825   6.250 -12.586
  486   HD11  ILE  64          HD11      ILE  64  82.538   4.039 -13.320
  487   HD12  ILE  64          HD12      ILE  64  81.545   5.494 -13.235
  488   HD13  ILE  64          HD13      ILE  64  80.916   4.041 -14.012
  489    H    THR  65           HN       THR  65  80.527   4.797  -8.967
  490    HA   THR  65           HA       THR  65  82.525   4.053  -7.939
  491    HB   THR  65           HB       THR  65  80.769   3.597  -6.246
  492    HG1  THR  65           HG1      THR  65  82.364   1.329  -6.112
  493   HG21  THR  65          HG21      THR  65  79.984   1.189  -6.069
  494   HG22  THR  65          HG22      THR  65  80.635   0.941  -7.689
  495   HG23  THR  65          HG23      THR  65  79.325   2.093  -7.432
  496    H    VAL  66           HN       VAL  66  82.431   3.184 -10.550
  497    HA   VAL  66           HA       VAL  66  83.661   1.721 -11.910
  498    HB   VAL  66           HB       VAL  66  84.061  -0.117  -9.543
  499   HG11  VAL  66          HG11      VAL  66  86.077  -0.738 -10.747
  500   HG12  VAL  66          HG12      VAL  66  85.815   0.548 -11.925
  501   HG13  VAL  66          HG13      VAL  66  84.713  -0.827 -11.861
  502   HG21  VAL  66          HG21      VAL  66  86.328   1.314  -9.507
  503   HG22  VAL  66          HG22      VAL  66  84.926   1.777  -8.542
  504   HG23  VAL  66          HG23      VAL  66  85.238   2.575 -10.083
  505    H    ILE  67           HN       ILE  67  81.906  -0.176  -9.441
  506    HA   ILE  67           HA       ILE  67  80.185  -1.252 -11.616
  507    HB   ILE  67           HB       ILE  67  81.708  -2.891  -9.572
  508   HG12  ILE  67          HG12      ILE  67  82.865  -2.344 -11.704
  509   HG13  ILE  67          HG11      ILE  67  82.519  -4.069 -11.571
  510   HG21  ILE  67          HG21      ILE  67  79.141  -3.391 -10.964
  511   HG22  ILE  67          HG22      ILE  67  79.772  -4.100  -9.477
  512   HG23  ILE  67          HG23      ILE  67  80.313  -4.707 -11.042
  513   HD11  ILE  67          HD11      ILE  67  80.244  -3.255 -12.777
  514   HD12  ILE  67          HD12      ILE  67  81.675  -3.753 -13.679
  515   HD13  ILE  67          HD13      ILE  67  81.356  -2.040 -13.407
  516    H1U  RCY  68           H1U      RCY  68  75.813  -2.356  -3.412
  517    H1S  RCY  68           H1S      RCY  68  73.928  -0.589  -7.375
  518    HB1  RCY  68           HB1      RCY  68  76.675   1.279 -10.215
  519    HB2  RCY  68           HB2      RCY  68  77.309   1.631  -8.608
  520    HA   RCY  68           HA       RCY  68  77.529  -0.655  -8.066
  521    HN1  RCY  68           HN1      RCY  68  78.279  -0.320 -10.939
  522    HA   PRO  69           HA       PRO  69  74.748  -3.930  -9.143
  523    HB2  PRO  69           HB2      PRO  69  72.564  -3.012  -7.538
  524    HB3  PRO  69           HB1      PRO  69  73.763  -4.245  -7.119
  525    HG2  PRO  69           HG2      PRO  69  73.615  -1.428  -6.318
  526    HG3  PRO  69           HG1      PRO  69  74.425  -2.789  -5.530
  527    HD2  PRO  69           HD2      PRO  69  75.784  -0.798  -6.831
  528    HD3  PRO  69           HD1      PRO  69  76.400  -2.461  -6.696
  529    H    TRP  70           HN       TRP  70  74.177  -0.636  -9.734
  530    HA   TRP  70           HA       TRP  70  71.557  -0.743 -10.884
  531    HD1  TRP  70           HD1      TRP  70  71.437   3.343 -11.824
  532    HE1  TRP  70           HE1      TRP  70  69.867   4.072  -9.915
  533    HE3  TRP  70           HE3      TRP  70  72.283  -0.435  -8.495
  534    HZ2  TRP  70           HZ2      TRP  70  69.073   3.171  -7.314
  535    HZ3  TRP  70           HZ3      TRP  70  71.111  -0.477  -6.316
  536    HH2  TRP  70           HH2      TRP  70  69.509   1.318  -5.719
  537    HB2  TRP  70           HB2      TRP  70  73.863   1.126 -10.941
  538    HB3  TRP  70           HB1      TRP  70  72.795   1.217 -12.337
  539    H    GLU  71           HN       GLU  71  74.292  -2.357 -11.712
  540    HA   GLU  71           HA       GLU  71  73.228  -2.961 -14.407
  541    HB2  GLU  71           HB2      GLU  71  76.028  -1.931 -13.842
  542    HB3  GLU  71           HB1      GLU  71  75.579  -2.747 -15.343
  543    HG2  GLU  71           HG2      GLU  71  73.731  -1.019 -15.594
  544    HG3  GLU  71           HG1      GLU  71  74.484  -0.141 -14.263
  545    H    ALA  72           HN       ALA  72  76.370  -3.592 -12.919
  546    HA   ALA  72           HA       ALA  72  76.032  -6.479 -13.290
  547    HB1  ALA  72           HB1      ALA  72  78.299  -6.198 -11.762
  548    HB2  ALA  72           HB2      ALA  72  78.215  -4.628 -12.561
  549    HB3  ALA  72           HB3      ALA  72  78.269  -6.103 -13.523
  550    H1U  RCY  73           H1U      RCY  73  73.836  -5.143  -3.992
  551    H1S  RCY  73           H1S      RCY  73  71.707  -4.654  -7.439
  552    HB1  RCY  73           HB1      RCY  73  72.357  -7.940  -9.088
  553    HB2  RCY  73           HB2      RCY  73  72.411  -7.543 -10.805
  554    HA   RCY  73           HA       RCY  73  74.419  -6.218  -9.043
  555    HN1  RCY  73           HN1      RCY  73  74.209  -6.897 -11.880
  556    H    ASN  74           HN       ASN  74  76.481  -8.045 -10.329
  557    HA   ASN  74           HA       ASN  74  76.687  -9.888  -8.119
  558    HB2  ASN  74           HB2      ASN  74  74.873 -10.917  -9.649
  559    HB3  ASN  74           HB1      ASN  74  76.198 -11.264 -10.760
  560   HD21  ASN  74          HD21      ASN  74  74.548 -12.426  -7.991
  561   HD22  ASN  74          HD22      ASN  74  75.665 -13.623  -7.542
  562    H    HIS  75           HN       HIS  75  77.630  -9.348 -11.517
  563    HA   HIS  75           HA       HIS  75  80.050 -10.678 -11.637
  564    HD1  HIS  75           HD1      HIS  75  77.666  -9.292 -14.576
  565    HD2  HIS  75           HD2      HIS  75  81.398 -11.093 -14.107
  566    HE1  HIS  75           HE1      HIS  75  77.822 -11.088 -16.355
  567    HE2  HIS  75           HE2      HIS  75  80.089 -12.193 -16.080
  568    HB2  HIS  75           HB2      HIS  75  79.025  -8.149 -12.820
  569    HB3  HIS  75           HB1      HIS  75  80.767  -8.403 -12.914
  570    H1U  RCY  76           H1U      RCY  76  79.587  -5.948  -1.929
  571    H1S  RCY  76           H1S      RCY  76  78.480  -5.962  -6.321
  572    HB1  RCY  76           HB1      RCY  76  82.182  -7.392  -7.467
  573    HB2  RCY  76           HB2      RCY  76  80.699  -8.138  -8.061
  574    HA   RCY  76           HA       RCY  76  81.808  -5.974  -9.762
  575    HN1  RCY  76           HN1      RCY  76  80.317  -7.174 -11.119
  576    H    GLU  77           HN       GLU  77  83.629  -6.284 -11.146
  577    HA   GLU  77           HA       GLU  77  85.271  -8.631 -11.103
  578    HB2  GLU  77           HB2      GLU  77  85.201  -6.737 -12.851
  579    HB3  GLU  77           HB1      GLU  77  86.277  -5.860 -11.768
  580    HG2  GLU  77           HG2      GLU  77  86.827  -8.645 -12.832
  581    HG3  GLU  77           HG1      GLU  77  87.509  -7.167 -13.511
  582    H    LEU  78           HN       LEU  78  86.979  -5.687 -10.310
  583    HA   LEU  78           HA       LEU  78  88.434  -5.203  -8.539
  584    HG   LEU  78           HG       LEU  78  85.870  -4.241  -6.212
  585    HB2  LEU  78           HB2      LEU  78  86.041  -6.440  -7.221
  586    HB3  LEU  78           HB1      LEU  78  87.481  -6.174  -6.244
  587   HD11  LEU  78          HD11      LEU  78  88.267  -3.172  -7.600
  588   HD12  LEU  78          HD12      LEU  78  88.581  -4.218  -6.215
  589   HD13  LEU  78          HD13      LEU  78  87.606  -2.761  -6.017
  590   HD21  LEU  78          HD21      LEU  78  85.458  -2.963  -8.159
  591   HD22  LEU  78          HD22      LEU  78  85.323  -4.630  -8.718
  592   HD23  LEU  78          HD23      LEU  78  86.793  -3.710  -9.037
  593    H    HIS  79           HN       HIS  79  87.229  -8.405  -7.500
  594    HA   HIS  79           HA       HIS  79  88.417 -10.355  -6.970
  595    HD1  HIS  79           HD1      HIS  79  86.854 -10.293  -8.470
  596    HD2  HIS  79           HD2      HIS  79  89.660 -12.063 -10.998
  597    HE1  HIS  79           HE1      HIS  79  85.558 -11.821 -10.019
  598    HE2  HIS  79           HE2      HIS  79  87.254 -12.904 -11.564
  599    HB2  HIS  79           HB2      HIS  79  89.964  -9.261  -9.321
  600    HB3  HIS  79           HB1      HIS  79  90.496 -10.722  -8.493
  601    H    GLU  80           HN       GLU  80  88.830  -8.682  -5.035
  602    HA   GLU  80           HA       GLU  80  91.511  -9.188  -4.129
  603    HB2  GLU  80           HB2      GLU  80  92.252  -6.794  -4.002
  604    HB3  GLU  80           HB1      GLU  80  92.132  -7.397  -5.653
  605    HG2  GLU  80           HG2      GLU  80  91.044  -5.309  -5.763
  606    HG3  GLU  80           HG1      GLU  80  89.711  -6.452  -5.592
  607    H    LEU  81           HN       LEU  81  88.489  -7.439  -3.854
  608    HA   LEU  81           HA       LEU  81  88.882  -7.159  -0.915
  609    HG   LEU  81           HG       LEU  81  86.543  -6.454  -0.034
  610    HB2  LEU  81           HB2      LEU  81  88.117  -5.119  -1.811
  611    HB3  LEU  81           HB1      LEU  81  87.000  -5.914  -2.916
  612   HD11  LEU  81          HD11      LEU  81  87.034  -4.119   0.197
  613   HD12  LEU  81          HD12      LEU  81  85.277  -4.251   0.148
  614   HD13  LEU  81          HD13      LEU  81  86.161  -3.723  -1.284
  615   HD21  LEU  81          HD21      LEU  81  85.166  -7.097  -2.183
  616   HD22  LEU  81          HD22      LEU  81  84.542  -5.453  -2.044
  617   HD23  LEU  81          HD23      LEU  81  84.312  -6.599  -0.723
  618    H    ALA  82           HN       ALA  82  86.794  -8.659  -3.352
  619    HA   ALA  82           HA       ALA  82  84.932  -9.810  -1.471
  620    HB1  ALA  82           HB1      ALA  82  84.502 -11.403  -3.476
  621    HB2  ALA  82           HB2      ALA  82  85.639 -10.376  -4.350
  622    HB3  ALA  82           HB3      ALA  82  84.151  -9.689  -3.698
  623    H    GLN  83           HN       GLN  83  87.796 -10.216  -0.843
  624    HA   GLN  83           HA       GLN  83  88.217 -13.115  -1.233
  625    HB2  GLN  83           HB2      GLN  83  90.118 -11.547  -1.434
  626    HB3  GLN  83           HB1      GLN  83  89.862 -11.023   0.230
  627    HG2  GLN  83           HG2      GLN  83  91.656 -12.706   0.131
  628    HG3  GLN  83           HG1      GLN  83  90.266 -13.341   1.012
  629   HE21  GLN  83          HE21      GLN  83  89.036 -15.068   0.028
  630   HE22  GLN  83          HE22      GLN  83  89.565 -15.868  -1.373
  631    H    TYR  84           HN       TYR  84  86.906 -10.953   1.091
  632    HA   TYR  84           HA       TYR  84  87.328 -12.669   3.409
  633    HD1  TYR  84           HD2      TYR  84  88.479 -11.212   4.998
  634    HD2  TYR  84           HD1      TYR  84  86.618  -8.509   2.226
  635    HE1  TYR  84           HE2      TYR  84  90.476  -9.744   5.089
  636    HE2  TYR  84           HE1      TYR  84  88.615  -7.041   2.317
  637    HH   TYR  84           HH       TYR  84  91.267  -7.584   2.935
  638    HB2  TYR  84           HB2      TYR  84  85.417 -10.350   3.005
  639    HB3  TYR  84           HB1      TYR  84  85.871 -11.061   4.555
  640    H    GLY  85           HN       GLY  85  84.101 -11.489   2.738
  641    HA2  GLY  85           HA2      GLY  85  83.107 -14.144   1.958
  642    HA3  GLY  85           HA1      GLY  85  82.601 -13.596   3.558
  643    H    ILE  86           HN       ILE  86  82.340 -12.975   0.110
  644    HA   ILE  86           HA       ILE  86  80.842 -10.572   0.179
  645    HB   ILE  86           HB       ILE  86  79.934 -11.308  -2.031
  646   HG12  ILE  86          HG12      ILE  86  81.440 -13.861  -1.371
  647   HG13  ILE  86          HG11      ILE  86  79.686 -13.705  -1.478
  648   HG21  ILE  86          HG21      ILE  86  82.041 -11.256  -3.159
  649   HG22  ILE  86          HG22      ILE  86  82.873 -11.986  -1.786
  650   HG23  ILE  86          HG23      ILE  86  82.269 -10.332  -1.674
  651   HD11  ILE  86          HD11      ILE  86  79.983 -12.916  -3.856
  652   HD12  ILE  86          HD12      ILE  86  80.468 -14.590  -3.586
  653   HD13  ILE  86          HD13      ILE  86  81.692 -13.327  -3.716
  654    H1U  RCY  87           H1U      RCY  87  76.811  -5.948   1.638
  655    H1S  RCY  87           H1S      RCY  87  77.267  -9.687   0.179
  656    HB1  RCY  87           HB1      RCY  87  75.203 -10.827  -0.175
  657    HB2  RCY  87           HB2      RCY  87  75.302 -12.133  -1.355
  658    HA   RCY  87           HA       RCY  87  76.740 -11.844   1.130
  659    HN1  RCY  87           HN1      RCY  87  78.425 -11.361  -1.194
  Start of MODEL   82
    1    HA   MET   1           HA       MET   1  71.105  -1.861  29.792
    2    HB2  MET   1           HB2      MET   1  70.788  -4.093  31.108
    3    HB3  MET   1           HB1      MET   1  70.793  -4.847  29.514
    4    HG2  MET   1           HG2      MET   1  72.962  -3.536  29.082
    5    HG3  MET   1           HG1      MET   1  72.989  -3.235  30.820
    6    HE1  MET   1           HE1      MET   1  75.451  -5.043  29.290
    7    HE2  MET   1           HE2      MET   1  75.669  -5.768  30.881
    8    HE3  MET   1           HE3      MET   1  75.188  -4.078  30.748
    9    H    ASN   2           HN       ASN   2  71.779  -4.357  27.986
   10    HA   ASN   2           HA       ASN   2  71.023  -2.973  25.460
   11    HB2  ASN   2           HB2      ASN   2  73.060  -5.153  26.013
   12    HB3  ASN   2           HB1      ASN   2  72.778  -4.406  24.440
   13   HD21  ASN   2          HD21      ASN   2  72.230  -1.761  26.005
   14   HD22  ASN   2          HD22      ASN   2  73.789  -1.172  26.328
   15    H    LEU   3           HN       LEU   3  70.524  -4.503  23.582
   16    HA   LEU   3           HA       LEU   3  69.135  -6.988  24.454
   17    HG   LEU   3           HG       LEU   3  68.846  -4.222  22.226
   18    HB2  LEU   3           HB2      LEU   3  67.226  -6.289  22.876
   19    HB3  LEU   3           HB1      LEU   3  67.303  -5.476  24.439
   20   HD11  LEU   3          HD11      LEU   3  65.817  -4.239  22.356
   21   HD12  LEU   3          HD12      LEU   3  66.825  -4.779  21.013
   22   HD13  LEU   3          HD13      LEU   3  66.753  -3.067  21.429
   23   HD21  LEU   3          HD21      LEU   3  66.899  -2.978  24.173
   24   HD22  LEU   3          HD22      LEU   3  68.281  -2.224  23.379
   25   HD23  LEU   3          HD23      LEU   3  68.538  -3.411  24.658
   26    H    GLU   4           HN       GLU   4  68.209  -8.011  22.229
   27    HA   GLU   4           HA       GLU   4  70.501  -7.927  20.305
   28    HB2  GLU   4           HB2      GLU   4  68.808 -10.266  20.000
   29    HB3  GLU   4           HB1      GLU   4  70.529 -10.189  20.371
   30    HG2  GLU   4           HG2      GLU   4  69.476 -11.287  22.229
   31    HG3  GLU   4           HG1      GLU   4  69.878  -9.656  22.769
   32    HA   PRO   5           HA       PRO   5  68.157  -6.691  16.801
   33    HB2  PRO   5           HB2      PRO   5  68.254  -9.505  15.767
   34    HB3  PRO   5           HB1      PRO   5  68.637  -7.986  14.933
   35    HG2  PRO   5           HG2      PRO   5  70.550  -9.607  15.845
   36    HG3  PRO   5           HG1      PRO   5  70.729  -7.845  15.865
   37    HD2  PRO   5           HD2      PRO   5  70.296  -9.708  18.136
   38    HD3  PRO   5           HD1      PRO   5  71.035  -8.092  18.127
   39    HA   PRO   6           HA       PRO   6  64.038  -8.054  18.002
   40    HB2  PRO   6           HB2      PRO   6  62.582  -6.341  16.481
   41    HB3  PRO   6           HB1      PRO   6  63.478  -5.804  17.916
   42    HG2  PRO   6           HG2      PRO   6  64.211  -5.563  15.040
   43    HG3  PRO   6           HG1      PRO   6  64.413  -4.398  16.360
   44    HD2  PRO   6           HD2      PRO   6  66.450  -6.002  15.412
   45    HD3  PRO   6           HD1      PRO   6  66.399  -5.341  17.062
   46    H    LYS   7           HN       LYS   7  62.877  -9.777  17.244
   47    HA   LYS   7           HA       LYS   7  62.267 -11.494  15.743
   48    HB2  LYS   7           HB2      LYS   7  61.295  -8.882  14.655
   49    HB3  LYS   7           HB1      LYS   7  61.112 -10.310  13.638
   50    HG2  LYS   7           HG2      LYS   7  60.270 -10.392  16.526
   51    HG3  LYS   7           HG1      LYS   7  59.195  -9.709  15.306
   52    HD2  LYS   7           HD2      LYS   7  58.810 -11.737  14.311
   53    HD3  LYS   7           HD1      LYS   7  60.437 -12.329  14.649
   54    HE2  LYS   7           HE2      LYS   7  59.874 -12.756  16.960
   55    HE3  LYS   7           HE1      LYS   7  58.308 -11.967  16.775
   56    HZ1  LYS   7           HZ1      LYS   7  57.437 -13.842  16.021
   57    HZ2  LYS   7           HZ2      LYS   7  58.899 -14.636  16.366
   58    HZ3  LYS   7           HZ3      LYS   7  58.627 -13.985  14.821
   59    H    ALA   8           HN       ALA   8  62.201 -11.600  12.962
   60    HA   ALA   8           HA       ALA   8  64.566 -10.675  11.658
   61    HB1  ALA   8           HB1      ALA   8  65.890 -12.050  13.071
   62    HB2  ALA   8           HB2      ALA   8  65.709 -12.986  11.588
   63    HB3  ALA   8           HB3      ALA   8  64.730 -13.377  13.002
   64    H    GLU   9           HN       GLU   9  61.595 -11.887  11.616
   65    HA   GLU   9           HA       GLU   9  61.852 -13.602   9.219
   66    HB2  GLU   9           HB2      GLU   9  59.530 -12.764  10.964
   67    HB3  GLU   9           HB1      GLU   9  59.292 -13.631   9.445
   68    HG2  GLU   9           HG2      GLU   9  59.403 -15.161  11.416
   69    HG3  GLU   9           HG1      GLU   9  60.676 -15.479  10.237
   70    H1U  RCY  10           H1U      RCY  10  61.164  -7.648   1.952
   71    H1S  RCY  10           H1S      RCY  10  59.064 -10.853   3.854
   72    HB1  RCY  10           HB1      RCY  10  57.830  -9.296   6.974
   73    HB2  RCY  10           HB2      RCY  10  57.625 -10.657   8.076
   74    HA   RCY  10           HA       RCY  10  60.376  -9.644   7.368
   75    HN1  RCY  10           HN1      RCY  10  59.537 -10.973   9.900
   76    H    ARG  11           HN       ARG  11  58.653  -7.569   7.288
   77    HA   ARG  11           HA       ARG  11  58.641  -6.351  10.013
   78    HE   ARG  11           HE       ARG  11  59.607  -2.715  11.760
   79    HB2  ARG  11           HB2      ARG  11  60.677  -5.671   8.587
   80    HB3  ARG  11           HB1      ARG  11  59.524  -4.818   7.562
   81    HG2  ARG  11           HG2      ARG  11  60.077  -3.128   9.055
   82    HG3  ARG  11           HG1      ARG  11  58.688  -3.837   9.880
   83    HD2  ARG  11           HD2      ARG  11  60.443  -5.385  11.019
   84    HD3  ARG  11           HD1      ARG  11  61.616  -4.177  10.495
   85   HH11  ARG  11          HH21      ARG  11  61.704  -5.347  12.507
   86   HH12  ARG  11          HH22      ARG  11  61.800  -4.965  14.194
   87   HH21  ARG  11          HH11      ARG  11  59.719  -2.202  13.958
   88   HH22  ARG  11          HH12      ARG  11  60.676  -3.185  15.015
   89    H    SER  12           HN       SER  12  56.367  -6.493  10.095
   90    HA   SER  12           HA       SER  12  54.167  -5.798   9.680
   91    HG   SER  12           HG       SER  12  56.251  -2.767   9.723
   92    HB2  SER  12           HB2      SER  12  55.316  -3.548   8.033
   93    HB3  SER  12           HB1      SER  12  53.865  -3.549   9.031
   94    H    ALA  13           HN       ALA  13  53.744  -4.185   7.039
   95    HA   ALA  13           HA       ALA  13  54.230  -6.238   4.994
   96    HB1  ALA  13           HB1      ALA  13  51.948  -6.758   4.533
   97    HB2  ALA  13           HB2      ALA  13  51.365  -5.483   5.603
   98    HB3  ALA  13           HB3      ALA  13  52.121  -6.925   6.280
   99    H    THR  14           HN       THR  14  52.514  -3.240   5.865
  100    HA   THR  14           HA       THR  14  52.416  -2.302   3.110
  101    HB   THR  14           HB       THR  14  50.734  -1.351   4.437
  102    HG1  THR  14           HG1      THR  14  52.160   0.219   3.327
  103   HG21  THR  14          HG21      THR  14  51.402  -2.024   6.616
  104   HG22  THR  14          HG22      THR  14  51.341  -0.263   6.679
  105   HG23  THR  14          HG23      THR  14  52.893  -1.087   6.532
  106    H    ARG  15           HN       ARG  15  54.741  -2.623   2.630
  107    HA   ARG  15           HA       ARG  15  56.925  -1.471   3.904
  108    HE   ARG  15           HE       ARG  15  54.722  -3.518   0.514
  109    HB2  ARG  15           HB2      ARG  15  58.007  -1.355   1.702
  110    HB3  ARG  15           HB1      ARG  15  57.079  -2.848   1.848
  111    HG2  ARG  15           HG2      ARG  15  55.159  -1.266   0.822
  112    HG3  ARG  15           HG1      ARG  15  56.571  -0.462   0.137
  113    HD2  ARG  15           HD2      ARG  15  55.992  -2.111  -1.467
  114    HD3  ARG  15           HD1      ARG  15  57.344  -2.813  -0.579
  115   HH11  ARG  15          HH21      ARG  15  57.245  -4.224  -1.727
  116   HH12  ARG  15          HH22      ARG  15  56.847  -5.905  -1.850
  117   HH21  ARG  15          HH11      ARG  15  54.188  -5.710   0.367
  118   HH22  ARG  15          HH12      ARG  15  55.116  -6.746  -0.665
  119    H    VAL  16           HN       VAL  16  56.957   0.571   4.738
  120    HA   VAL  16           HA       VAL  16  55.522   2.770   3.481
  121    HB   VAL  16           HB       VAL  16  55.803   2.688   5.922
  122   HG11  VAL  16          HG11      VAL  16  57.906   2.734   6.987
  123   HG12  VAL  16          HG12      VAL  16  58.735   3.270   5.525
  124   HG13  VAL  16          HG13      VAL  16  58.151   1.610   5.650
  125   HG21  VAL  16          HG21      VAL  16  55.692   4.891   4.652
  126   HG22  VAL  16          HG22      VAL  16  57.447   4.976   4.807
  127   HG23  VAL  16          HG23      VAL  16  56.433   4.986   6.250
  128    H    MET  17           HN       MET  17  56.291   3.935   1.798
  129    HA   MET  17           HA       MET  17  59.020   4.870   1.676
  130    HB2  MET  17           HB2      MET  17  59.243   3.612  -0.695
  131    HB3  MET  17           HB1      MET  17  59.830   2.894   0.804
  132    HG2  MET  17           HG2      MET  17  57.972   1.469   1.000
  133    HG3  MET  17           HG1      MET  17  56.983   2.458  -0.074
  134    HE1  MET  17           HE1      MET  17  60.111   0.535   0.382
  135    HE2  MET  17           HE2      MET  17  60.832   1.429  -0.954
  136    HE3  MET  17           HE3      MET  17  60.469  -0.284  -1.143
  137    H    GLY  18           HN       GLY  18  56.324   4.000  -0.527
  138    HA2  GLY  18           HA2      GLY  18  55.340   6.562  -0.989
  139    HA3  GLY  18           HA1      GLY  18  56.679   6.392  -2.124
  140    H    GLY  19           HN       GLY  19  54.060   4.220  -0.984
  141    HA2  GLY  19           HA2      GLY  19  52.554   2.911  -2.219
  142    HA3  GLY  19           HA1      GLY  19  52.691   4.133  -3.486
  143    HA   PRO  20           HA       PRO  20  54.285   0.266  -5.440
  144    HB2  PRO  20           HB2      PRO  20  54.052   2.164  -7.747
  145    HB3  PRO  20           HB1      PRO  20  53.549   0.465  -7.629
  146    HG2  PRO  20           HG2      PRO  20  51.773   2.433  -7.519
  147    HG3  PRO  20           HG1      PRO  20  51.603   0.989  -6.505
  148    HD2  PRO  20           HD2      PRO  20  52.468   3.747  -5.725
  149    HD3  PRO  20           HD1      PRO  20  51.557   2.542  -4.787
  150    H1U  RCY  21           H1U      RCY  21  62.241   1.617  -2.037
  151    H1S  RCY  21           H1S      RCY  21  60.906   1.689  -6.220
  152    HB1  RCY  21           HB1      RCY  21  59.203   1.210  -8.711
  153    HB2  RCY  21           HB2      RCY  21  57.791   0.197  -8.411
  154    HA   RCY  21           HA       RCY  21  58.169   2.447  -6.516
  155    HN1  RCY  21           HN1      RCY  21  55.709   1.540  -7.957
  156    H    THR  22           HN       THR  22  57.920   4.624  -7.052
  157    HA   THR  22           HA       THR  22  57.441   5.360  -9.879
  158    HB   THR  22           HB       THR  22  57.714   7.738  -8.767
  159    HG1  THR  22           HG1      THR  22  56.830   6.439  -6.481
  160   HG21  THR  22          HG21      THR  22  55.583   7.071  -9.576
  161   HG22  THR  22          HG22      THR  22  55.314   7.499  -7.886
  162   HG23  THR  22          HG23      THR  22  55.431   5.803  -8.358
  163    HA   PRO  23           HA       PRO  23  61.715   5.928 -10.840
  164    HB2  PRO  23           HB2      PRO  23  61.602   8.180 -12.442
  165    HB3  PRO  23           HB1      PRO  23  61.158   6.550 -12.982
  166    HG2  PRO  23           HG2      PRO  23  59.408   8.787 -12.101
  167    HG3  PRO  23           HG1      PRO  23  59.172   7.611 -13.406
  168    HD2  PRO  23           HD2      PRO  23  57.898   7.391 -11.009
  169    HD3  PRO  23           HD1      PRO  23  58.370   5.970 -11.968
  170    H    ARG  24           HN       ARG  24  62.032   6.568  -8.477
  171    HA   ARG  24           HA       ARG  24  62.893   8.027  -6.854
  172    HE   ARG  24           HE       ARG  24  67.708   6.793  -9.585
  173    HB2  ARG  24           HB2      ARG  24  63.969   9.267  -9.402
  174    HB3  ARG  24           HB1      ARG  24  64.459   9.782  -7.787
  175    HG2  ARG  24           HG2      ARG  24  65.107   7.393  -7.308
  176    HG3  ARG  24           HG1      ARG  24  64.804   7.031  -9.008
  177    HD2  ARG  24           HD2      ARG  24  66.456   8.799  -9.634
  178    HD3  ARG  24           HD1      ARG  24  66.816   9.023  -7.922
  179   HH11  ARG  24          HH21      ARG  24  66.930   7.943  -6.429
  180   HH12  ARG  24          HH22      ARG  24  67.938   6.793  -5.617
  181   HH21  ARG  24          HH11      ARG  24  69.029   5.284  -8.542
  182   HH22  ARG  24          HH12      ARG  24  69.126   5.288  -6.813
  183    H    LYS  25           HN       LYS  25  62.946  10.484  -6.236
  184    HA   LYS  25           HA       LYS  25  60.233  11.518  -6.739
  185    HB2  LYS  25           HB2      LYS  25  62.427  12.688  -5.005
  186    HB3  LYS  25           HB1      LYS  25  60.711  13.088  -4.949
  187    HG2  LYS  25           HG2      LYS  25  61.807  10.311  -4.425
  188    HG3  LYS  25           HG1      LYS  25  61.442  11.477  -3.152
  189    HD2  LYS  25           HD2      LYS  25  59.326  10.700  -3.186
  190    HD3  LYS  25           HD1      LYS  25  59.156  11.465  -4.766
  191    HE2  LYS  25           HE2      LYS  25  58.552   9.062  -4.851
  192    HE3  LYS  25           HE1      LYS  25  59.951   9.417  -5.865
  193    HZ1  LYS  25           HZ1      LYS  25  61.390   8.433  -4.379
  194    HZ2  LYS  25           HZ2      LYS  25  60.033   7.417  -4.269
  195    HZ3  LYS  25           HZ3      LYS  25  60.326   8.581  -3.067
  196    H    GLY  26           HN       GLY  26  63.146  13.511  -6.383
  197    HA2  GLY  26           HA2      GLY  26  62.240  15.200  -8.600
  198    HA3  GLY  26           HA1      GLY  26  63.668  15.478  -7.602
  199    HA   PRO  27           HA       PRO  27  64.453  13.637 -12.062
  200    HB2  PRO  27           HB2      PRO  27  66.077  16.154 -12.054
  201    HB3  PRO  27           HB1      PRO  27  65.194  15.388 -13.389
  202    HG2  PRO  27           HG2      PRO  27  64.246  17.537 -12.111
  203    HG3  PRO  27           HG1      PRO  27  63.183  16.270 -12.744
  204    HD2  PRO  27           HD2      PRO  27  63.874  16.896  -9.927
  205    HD3  PRO  27           HD1      PRO  27  62.444  16.068 -10.581
  206    HA   PRO  28           HA       PRO  28  68.033  11.551 -10.380
  207    HB2  PRO  28           HB2      PRO  28  69.085  11.940 -13.164
  208    HB3  PRO  28           HB1      PRO  28  69.066  10.474 -12.163
  209    HG2  PRO  28           HG2      PRO  28  67.303  10.876 -14.143
  210    HG3  PRO  28           HG1      PRO  28  66.885   9.997 -12.664
  211    HD2  PRO  28           HD2      PRO  28  65.992  12.671 -13.552
  212    HD3  PRO  28           HD1      PRO  28  65.262  11.581 -12.354
  213    H    LYS  29           HN       LYS  29  69.796  12.391  -9.305
  214    HA   LYS  29           HA       LYS  29  71.198  14.739 -10.496
  215    HB2  LYS  29           HB2      LYS  29  69.387  15.070  -8.475
  216    HB3  LYS  29           HB1      LYS  29  70.858  14.790  -7.545
  217    HG2  LYS  29           HG2      LYS  29  70.940  17.104  -7.872
  218    HG3  LYS  29           HG1      LYS  29  71.917  16.519  -9.219
  219    HD2  LYS  29           HD2      LYS  29  69.721  16.493 -10.568
  220    HD3  LYS  29           HD1      LYS  29  69.054  17.478  -9.265
  221    HE2  LYS  29           HE2      LYS  29  70.773  19.172  -9.607
  222    HE3  LYS  29           HE1      LYS  29  71.560  18.169 -10.827
  223    HZ1  LYS  29           HZ1      LYS  29  69.320  19.909 -11.093
  224    HZ2  LYS  29           HZ2      LYS  29  68.949  18.341 -11.631
  225    HZ3  LYS  29           HZ3      LYS  29  70.266  19.181 -12.298
  226    H1U  RCY  30           H1U      RCY  30  77.841  12.228  -3.585
  227    H1S  RCY  30           H1S      RCY  30  74.857  15.303  -4.902
  228    HB1  RCY  30           HB1      RCY  30  75.713  13.169  -7.199
  229    HB2  RCY  30           HB2      RCY  30  74.200  12.270  -7.276
  230    HA   RCY  30           HA       RCY  30  75.503  13.978  -9.373
  231    HN1  RCY  30           HN1      RCY  30  73.409  14.798 -10.039
  232    H    LYS  31           HN       LYS  31  74.244  12.676 -11.499
  233    HA   LYS  31           HA       LYS  31  73.974   9.862 -11.240
  234    HB2  LYS  31           HB2      LYS  31  74.766   9.931 -13.738
  235    HB3  LYS  31           HB1      LYS  31  73.245  10.711 -13.302
  236    HG2  LYS  31           HG2      LYS  31  74.232  12.877 -13.305
  237    HG3  LYS  31           HG1      LYS  31  75.867  12.214 -13.317
  238    HD2  LYS  31           HD2      LYS  31  75.597  11.396 -15.570
  239    HD3  LYS  31           HD1      LYS  31  73.880  11.798 -15.565
  240    HE2  LYS  31           HE2      LYS  31  75.963  13.925 -15.094
  241    HE3  LYS  31           HE1      LYS  31  75.510  13.449 -16.731
  242    HZ1  LYS  31           HZ1      LYS  31  73.159  13.857 -16.053
  243    HZ2  LYS  31           HZ2      LYS  31  74.130  15.250 -16.110
  244    HZ3  LYS  31           HZ3      LYS  31  73.743  14.541 -14.615
  245    H    GLN  32           HN       GLN  32  76.514  10.491 -13.424
  246    HA   GLN  32           HA       GLN  32  78.464   9.213 -11.541
  247    HB2  GLN  32           HB2      GLN  32  77.618   8.044 -13.770
  248    HB3  GLN  32           HB1      GLN  32  78.809   9.104 -14.522
  249    HG2  GLN  32           HG2      GLN  32  80.551   8.230 -13.010
  250    HG3  GLN  32           HG1      GLN  32  79.363   7.171 -12.249
  251   HE21  GLN  32          HE21      GLN  32  78.532   7.385 -15.491
  252   HE22  GLN  32          HE22      GLN  32  79.336   6.004 -16.064
  253    H    ARG  33           HN       ARG  33  80.473   9.771 -13.806
  254    HA   ARG  33           HA       ARG  33  82.043  11.431 -14.316
  255    HE   ARG  33           HE       ARG  33  77.584  13.061 -17.694
  256    HB2  ARG  33           HB2      ARG  33  79.909  13.450 -13.595
  257    HB3  ARG  33           HB1      ARG  33  81.259  13.649 -14.711
  258    HG2  ARG  33           HG2      ARG  33  80.264  11.845 -16.144
  259    HG3  ARG  33           HG1      ARG  33  78.861  11.829 -15.075
  260    HD2  ARG  33           HD2      ARG  33  78.254  14.049 -15.659
  261    HD3  ARG  33           HD1      ARG  33  79.827  14.373 -16.387
  262   HH11  ARG  33          HH21      ARG  33  81.012  13.331 -17.444
  263   HH12  ARG  33          HH22      ARG  33  81.305  12.810 -19.070
  264   HH21  ARG  33          HH11      ARG  33  77.947  12.379 -19.818
  265   HH22  ARG  33          HH12      ARG  33  79.569  12.271 -20.414
  266    H    GLN  34           HN       GLN  34  80.329  11.545 -11.290
  267    HA   GLN  34           HA       GLN  34  82.405  13.266 -10.059
  268    HB2  GLN  34           HB2      GLN  34  80.019  13.620  -9.463
  269    HB3  GLN  34           HB1      GLN  34  79.949  11.975  -8.830
  270    HG2  GLN  34           HG2      GLN  34  81.535  12.472  -7.107
  271    HG3  GLN  34           HG1      GLN  34  81.951  14.019  -7.845
  272   HE21  GLN  34          HE21      GLN  34  78.613  13.500  -8.145
  273   HE22  GLN  34          HE22      GLN  34  78.100  14.397  -6.799
  274    H    THR  35           HN       THR  35  83.768  12.492  -8.370
  275    HA   THR  35           HA       THR  35  84.378   9.623  -8.560
  276    HB   THR  35           HB       THR  35  86.329  10.153  -7.213
  277    HG1  THR  35           HG1      THR  35  84.956  12.594  -6.822
  278   HG21  THR  35          HG21      THR  35  86.496  10.764  -9.563
  279   HG22  THR  35          HG22      THR  35  87.315  11.988  -8.593
  280   HG23  THR  35          HG23      THR  35  85.709  12.311  -9.249
  281    H    ARG  36           HN       ARG  36  85.357   9.622  -5.719
  282    HA   ARG  36           HA       ARG  36  83.096   9.974  -3.972
  283    HE   ARG  36           HE       ARG  36  84.767   5.020  -6.767
  284    HB2  ARG  36           HB2      ARG  36  82.668   7.520  -3.581
  285    HB3  ARG  36           HB1      ARG  36  82.133   8.097  -5.160
  286    HG2  ARG  36           HG2      ARG  36  84.313   7.307  -6.121
  287    HG3  ARG  36           HG1      ARG  36  84.697   6.598  -4.552
  288    HD2  ARG  36           HD2      ARG  36  82.776   5.130  -4.675
  289    HD3  ARG  36           HD1      ARG  36  82.202   5.931  -6.137
  290   HH11  ARG  36          HH21      ARG  36  81.786   3.718  -5.626
  291   HH12  ARG  36          HH22      ARG  36  82.022   2.173  -6.373
  292   HH21  ARG  36          HH11      ARG  36  85.092   3.011  -7.750
  293   HH22  ARG  36          HH12      ARG  36  83.893   1.773  -7.576
  294    H    GLN  37           HN       GLN  37  86.079  10.273  -4.191
  295    HA   GLN  37           HA       GLN  37  87.813  10.292  -2.604
  296    HB2  GLN  37           HB2      GLN  37  85.771  10.265  -0.967
  297    HB3  GLN  37           HB1      GLN  37  86.176   8.563  -0.756
  298    HG2  GLN  37           HG2      GLN  37  87.360   9.775   0.949
  299    HG3  GLN  37           HG1      GLN  37  88.552   9.297  -0.259
  300   HE21  GLN  37          HE21      GLN  37  86.191  11.967  -0.587
  301   HE22  GLN  37          HE22      GLN  37  87.356  13.198  -0.675
  302    H1U  RCY  38           H1U      RCY  38  84.862   1.588  -1.113
  303    H1S  RCY  38           H1S      RCY  38  86.229   4.590   1.608
  304    HB1  RCY  38           HB1      RCY  38  89.299   4.725  -0.265
  305    HB2  RCY  38           HB2      RCY  38  87.721   4.359  -0.960
  306    HA   RCY  38           HA       RCY  38  89.770   6.222  -1.898
  307    HN1  RCY  38           HN1      RCY  38  87.720   7.662  -0.788
  308    H    LYS  39           HN       LYS  39  89.789   6.080  -4.155
  309    HA   LYS  39           HA       LYS  39  87.510   4.680  -5.471
  310    HB2  LYS  39           HB2      LYS  39  88.563   5.430  -7.583
  311    HB3  LYS  39           HB1      LYS  39  88.227   6.785  -6.509
  312    HG2  LYS  39           HG2      LYS  39  90.860   5.631  -6.005
  313    HG3  LYS  39           HG1      LYS  39  90.695   6.192  -7.669
  314    HD2  LYS  39           HD2      LYS  39  90.007   7.848  -5.224
  315    HD3  LYS  39           HD1      LYS  39  91.517   7.979  -6.127
  316    HE2  LYS  39           HE2      LYS  39  90.445   9.506  -7.406
  317    HE3  LYS  39           HE1      LYS  39  89.586   8.135  -8.110
  318    HZ1  LYS  39           HZ1      LYS  39  88.456   8.910  -5.615
  319    HZ2  LYS  39           HZ2      LYS  39  87.712   8.760  -7.135
  320    HZ3  LYS  39           HZ3      LYS  39  88.480  10.212  -6.701
  321    H    SER  40           HN       SER  40  90.731   4.193  -4.377
  322    HA   SER  40           HA       SER  40  91.575   2.170  -6.219
  323    HG   SER  40           HG       SER  40  94.070   1.492  -5.156
  324    HB2  SER  40           HB2      SER  40  93.114   3.291  -4.636
  325    HB3  SER  40           HB1      SER  40  92.294   2.504  -3.290
  326    H    LYS  41           HN       LYS  41  92.095  -0.130  -4.981
  327    HA   LYS  41           HA       LYS  41  89.555  -1.098  -3.751
  328    HB2  LYS  41           HB2      LYS  41  91.006  -2.619  -5.926
  329    HB3  LYS  41           HB1      LYS  41  89.411  -2.952  -5.250
  330    HG2  LYS  41           HG2      LYS  41  88.539  -0.871  -6.199
  331    HG3  LYS  41           HG1      LYS  41  90.140  -0.457  -6.815
  332    HD2  LYS  41           HD2      LYS  41  90.077  -2.638  -8.118
  333    HD3  LYS  41           HD1      LYS  41  88.376  -2.765  -7.668
  334    HE2  LYS  41           HE2      LYS  41  87.937  -0.570  -8.716
  335    HE3  LYS  41           HE1      LYS  41  89.636  -0.454  -9.178
  336    HZ1  LYS  41           HZ1      LYS  41  87.898  -1.389 -10.841
  337    HZ2  LYS  41           HZ2      LYS  41  88.089  -2.827  -9.957
  338    HZ3  LYS  41           HZ3      LYS  41  89.427  -2.113 -10.724
  339    HA   PRO  42           HA       PRO  42  93.303  -2.679  -1.557
  340    HB2  PRO  42           HB2      PRO  42  92.416  -2.206   0.979
  341    HB3  PRO  42           HB1      PRO  42  93.206  -0.965  -0.013
  342    HG2  PRO  42           HG2      PRO  42  90.325  -1.355   0.586
  343    HG3  PRO  42           HG1      PRO  42  91.248   0.143   0.391
  344    HD2  PRO  42           HD2      PRO  42  89.608  -0.954  -1.563
  345    HD3  PRO  42           HD1      PRO  42  90.935   0.182  -1.884
  346    HA   PRO  43           HA       PRO  43  91.533  -6.662  -0.702
  347    HB2  PRO  43           HB2      PRO  43  93.403  -7.718   0.986
  348    HB3  PRO  43           HB1      PRO  43  93.696  -7.478  -0.748
  349    HG2  PRO  43           HG2      PRO  43  94.561  -5.804   1.557
  350    HG3  PRO  43           HG1      PRO  43  95.451  -6.257   0.093
  351    HD2  PRO  43           HD2      PRO  43  94.257  -3.810   0.413
  352    HD3  PRO  43           HD1      PRO  43  94.489  -4.576  -1.175
  353    H    LYS  44           HN       LYS  44  89.798  -7.076   0.596
  354    HA   LYS  44           HA       LYS  44  88.365  -6.930   2.466
  355    HB2  LYS  44           HB2      LYS  44  90.914  -7.639   3.945
  356    HB3  LYS  44           HB1      LYS  44  89.263  -8.022   4.427
  357    HG2  LYS  44           HG2      LYS  44  90.361  -8.985   1.789
  358    HG3  LYS  44           HG1      LYS  44  90.657  -9.889   3.274
  359    HD2  LYS  44           HD2      LYS  44  87.904  -9.074   2.301
  360    HD3  LYS  44           HD1      LYS  44  88.619 -10.664   2.033
  361    HE2  LYS  44           HE2      LYS  44  87.652 -11.212   4.013
  362    HE3  LYS  44           HE1      LYS  44  88.995 -10.326   4.735
  363    HZ1  LYS  44           HZ1      LYS  44  86.217  -9.639   4.605
  364    HZ2  LYS  44           HZ2      LYS  44  87.221  -8.381   4.061
  365    HZ3  LYS  44           HZ3      LYS  44  87.435  -9.030   5.616
  366    H    LYS  45           HN       LYS  45  90.409  -6.296   4.994
  367    HA   LYS  45           HA       LYS  45  90.783  -4.397   6.312
  368    HB2  LYS  45           HB2      LYS  45  91.891  -3.728   4.039
  369    HB3  LYS  45           HB1      LYS  45  90.479  -2.688   3.848
  370    HG2  LYS  45           HG2      LYS  45  90.965  -1.650   6.048
  371    HG3  LYS  45           HG1      LYS  45  92.405  -2.659   6.192
  372    HD2  LYS  45           HD2      LYS  45  93.420  -1.623   4.272
  373    HD3  LYS  45           HD1      LYS  45  91.926  -0.774   3.870
  374    HE2  LYS  45           HE2      LYS  45  93.329  -0.361   6.513
  375    HE3  LYS  45           HE1      LYS  45  93.735   0.591   5.085
  376    HZ1  LYS  45           HZ1      LYS  45  91.317   1.126   4.924
  377    HZ2  LYS  45           HZ2      LYS  45  92.099   1.781   6.283
  378    HZ3  LYS  45           HZ3      LYS  45  91.109   0.411   6.448
  379    H    GLY  46           HN       GLY  46  88.141  -5.346   6.153
  380    HA2  GLY  46           HA2      GLY  46  86.422  -2.958   5.810
  381    HA3  GLY  46           HA1      GLY  46  85.854  -4.599   6.122
  382    H    VAL  47           HN       VAL  47  88.341  -2.795   7.908
  383    HA   VAL  47           HA       VAL  47  87.306  -3.565  10.458
  384    HB   VAL  47           HB       VAL  47  88.784  -1.636  11.283
  385   HG11  VAL  47          HG11      VAL  47  89.813  -3.860   9.510
  386   HG12  VAL  47          HG12      VAL  47  89.707  -3.837  11.270
  387   HG13  VAL  47          HG13      VAL  47  90.892  -2.825  10.445
  388   HG21  VAL  47          HG21      VAL  47  89.709  -1.580   8.407
  389   HG22  VAL  47          HG22      VAL  47  90.123  -0.466   9.710
  390   HG23  VAL  47          HG23      VAL  47  88.505  -0.440   9.009
  391    H    GLN  48           HN       GLN  48  87.734  -0.300  10.823
  392    HA   GLN  48           HA       GLN  48  84.828   0.314  10.477
  393    HB2  GLN  48           HB2      GLN  48  84.876   1.503  12.652
  394    HB3  GLN  48           HB1      GLN  48  85.223  -0.215  12.849
  395    HG2  GLN  48           HG2      GLN  48  87.697   0.409  12.703
  396    HG3  GLN  48           HG1      GLN  48  87.184   2.088  12.878
  397   HE21  GLN  48          HE21      GLN  48  87.146   2.793  15.011
  398   HE22  GLN  48          HE22      GLN  48  86.908   1.799  16.366
  399    H    GLY  49           HN       GLY  49  84.474   2.304   9.564
  400    HA2  GLY  49           HA2      GLY  49  85.018   4.302   8.451
  401    HA3  GLY  49           HA1      GLY  49  85.989   4.643   9.884
  402    H1U  RCY  50           H1U      RCY  50  86.126  -2.237  -0.217
  403    H1S  RCY  50           H1S      RCY  50  88.503   0.712   2.558
  404    HB1  RCY  50           HB1      RCY  50  87.415   0.592   6.183
  405    HB2  RCY  50           HB2      RCY  50  89.058   0.741   5.564
  406    HA   RCY  50           HA       RCY  50  89.212   2.178   7.367
  407    HN1  RCY  50           HN1      RCY  50  86.427   2.033   7.506
  408    H    GLY  51           HN       GLY  51  86.828   4.058   5.521
  409    HA2  GLY  51           HA2      GLY  51  89.027   5.587   4.238
  410    HA3  GLY  51           HA1      GLY  51  87.320   5.683   3.802
  411    H    ASP  52           HN       ASP  52  89.780   7.276   5.427
  412    HA   ASP  52           HA       ASP  52  89.803   9.099   6.908
  413    HB2  ASP  52           HB2      ASP  52  87.015   9.463   5.764
  414    HB3  ASP  52           HB1      ASP  52  87.955  10.699   6.601
  415    H    ASP  53           HN       ASP  53  86.321   8.819   7.259
  416    HA   ASP  53           HA       ASP  53  86.250   7.082   9.516
  417    HB2  ASP  53           HB2      ASP  53  85.817   9.021  11.218
  418    HB3  ASP  53           HB1      ASP  53  87.482   8.584  10.834
  419    H    ILE  54           HN       ILE  54  84.165   7.899  10.962
  420    HA   ILE  54           HA       ILE  54  81.906   7.561   9.372
  421    HB   ILE  54           HB       ILE  54  80.718   8.870  11.302
  422   HG12  ILE  54          HG12      ILE  54  83.436   8.460  12.568
  423   HG13  ILE  54          HG11      ILE  54  82.937  10.012  11.893
  424   HG21  ILE  54          HG21      ILE  54  81.027   6.923  12.802
  425   HG22  ILE  54          HG22      ILE  54  82.414   6.412  11.840
  426   HG23  ILE  54          HG23      ILE  54  80.800   6.416  11.128
  427   HD11  ILE  54          HD11      ILE  54  81.532   8.479  14.100
  428   HD12  ILE  54          HD12      ILE  54  80.929   9.969  13.374
  429   HD13  ILE  54          HD13      ILE  54  82.440   9.979  14.283
  430    HA   PRO  55           HA       PRO  55  81.870  11.583   7.333
  431    HB2  PRO  55           HB2      PRO  55  79.820  11.121   5.625
  432    HB3  PRO  55           HB1      PRO  55  81.413  10.368   5.404
  433    HG2  PRO  55           HG2      PRO  55  78.921   9.198   6.535
  434    HG3  PRO  55           HG1      PRO  55  80.127   8.467   5.463
  435    HD2  PRO  55           HD2      PRO  55  80.027   8.040   8.198
  436    HD3  PRO  55           HD1      PRO  55  81.494   7.851   7.212
  437    H    GLY  56           HN       GLY  56  78.706  10.141   8.196
  438    HA2  GLY  56           HA2      GLY  56  78.007  12.475   9.805
  439    HA3  GLY  56           HA1      GLY  56  77.079  12.359   8.308
  440    H    MET  57           HN       MET  57  77.835   9.259   9.087
  441    HA   MET  57           HA       MET  57  76.491   7.487   9.852
  442    HB2  MET  57           HB2      MET  57  76.184   9.564  12.030
  443    HB3  MET  57           HB1      MET  57  75.489   7.949  12.162
  444    HG2  MET  57           HG2      MET  57  78.362   8.148  11.376
  445    HG3  MET  57           HG1      MET  57  77.953   8.491  13.057
  446    HE1  MET  57           HE1      MET  57  76.277   6.970  14.406
  447    HE2  MET  57           HE2      MET  57  77.989   6.755  14.764
  448    HE3  MET  57           HE3      MET  57  76.936   5.347  14.650
  449    H    GLU  58           HN       GLU  58  74.859   7.380   8.283
  450    HA   GLU  58           HA       GLU  58  72.686   7.550   7.433
  451    HB2  GLU  58           HB2      GLU  58  71.265   6.967   9.090
  452    HB3  GLU  58           HB1      GLU  58  72.488   7.418  10.273
  453    HG2  GLU  58           HG2      GLU  58  71.702   9.769  10.181
  454    HG3  GLU  58           HG1      GLU  58  70.457   9.299   9.023
  455    H    GLY  59           HN       GLY  59  71.198   9.162   6.615
  456    HA2  GLY  59           HA2      GLY  59  71.317  11.921   7.450
  457    HA3  GLY  59           HA1      GLY  59  72.304  11.666   6.011
  458    H1U  RCY  60           H1U      RCY  60  72.051   4.795   1.217
  459    H1S  RCY  60           H1S      RCY  60  72.016   9.359   2.608
  460    HB1  RCY  60           HB1      RCY  60  67.680   9.935   2.842
  461    HB2  RCY  60           HB2      RCY  60  68.581   8.634   3.619
  462    HA   RCY  60           HA       RCY  60  67.813  11.321   4.773
  463    HN1  RCY  60           HN1      RCY  60  69.625   9.548   6.296
  464    H    GLY  61           HN       GLY  61  68.451   8.253   6.383
  465    HA2  GLY  61           HA2      GLY  61  66.377   7.939   8.027
  466    HA3  GLY  61           HA1      GLY  61  65.550   7.643   6.496
  467    H    THR  62           HN       THR  62  68.887   6.719   7.169
  468    HA   THR  62           HA       THR  62  68.213   3.926   6.507
  469    HB   THR  62           HB       THR  62  70.577   3.572   6.364
  470    HG1  THR  62           HG1      THR  62  72.027   4.938   7.289
  471   HG21  THR  62          HG21      THR  62  69.616   4.955   4.552
  472   HG22  THR  62          HG22      THR  62  71.297   5.386   4.870
  473   HG23  THR  62          HG23      THR  62  69.994   6.411   5.473
  474    H    ASP  63           HN       ASP  63  66.864   4.018   8.655
  475    HA   ASP  63           HA       ASP  63  68.284   3.923  11.164
  476    HB2  ASP  63           HB2      ASP  63  65.561   2.839  10.381
  477    HB3  ASP  63           HB1      ASP  63  66.161   2.940  12.037
  478    H    ILE  64           HN       ILE  64  68.634   1.916   8.640
  479    HA   ILE  64           HA       ILE  64  68.906  -0.530  10.347
  480    HB   ILE  64           HB       ILE  64  68.782  -0.481   7.325
  481   HG12  ILE  64          HG12      ILE  64  66.323  -1.353   8.035
  482   HG13  ILE  64          HG11      ILE  64  66.610  -0.200   9.339
  483   HG21  ILE  64          HG21      ILE  64  69.535  -2.473   8.950
  484   HG22  ILE  64          HG22      ILE  64  68.600  -2.775   7.485
  485   HG23  ILE  64          HG23      ILE  64  67.790  -2.706   9.051
  486   HD11  ILE  64          HD11      ILE  64  67.326   1.442   7.483
  487   HD12  ILE  64          HD12      ILE  64  65.603   1.093   7.627
  488   HD13  ILE  64          HD13      ILE  64  66.558   0.315   6.365
  489    H    THR  65           HN       THR  65  70.790   1.819   9.808
  490    HA   THR  65           HA       THR  65  72.914   0.816   8.147
  491    HB   THR  65           HB       THR  65  72.938   2.884  10.368
  492    HG1  THR  65           HG1      THR  65  72.868   4.304   8.602
  493   HG21  THR  65          HG21      THR  65  75.194   2.155  10.087
  494   HG22  THR  65          HG22      THR  65  75.047   3.635   9.140
  495   HG23  THR  65          HG23      THR  65  75.021   2.067   8.334
  496    H    VAL  66           HN       VAL  66  72.547   0.940  11.710
  497    HA   VAL  66           HA       VAL  66  74.915  -0.249  12.513
  498    HB   VAL  66           HB       VAL  66  72.218  -1.068  13.622
  499   HG11  VAL  66          HG11      VAL  66  74.320  -2.227  14.423
  500   HG12  VAL  66          HG12      VAL  66  73.430  -1.375  15.685
  501   HG13  VAL  66          HG13      VAL  66  74.887  -0.659  14.997
  502   HG21  VAL  66          HG21      VAL  66  72.141   1.316  13.520
  503   HG22  VAL  66          HG22      VAL  66  73.838   1.463  13.978
  504   HG23  VAL  66          HG23      VAL  66  72.647   0.936  15.167
  505    H    ILE  67           HN       ILE  67  71.963  -2.058  11.573
  506    HA   ILE  67           HA       ILE  67  73.750  -4.297  10.722
  507    HB   ILE  67           HB       ILE  67  71.233  -4.513  12.404
  508   HG12  ILE  67          HG12      ILE  67  73.379  -6.023  13.444
  509   HG13  ILE  67          HG11      ILE  67  74.071  -4.469  12.976
  510   HG21  ILE  67          HG21      ILE  67  72.827  -6.573  10.874
  511   HG22  ILE  67          HG22      ILE  67  71.084  -6.303  10.854
  512   HG23  ILE  67          HG23      ILE  67  71.849  -7.014  12.274
  513   HD11  ILE  67          HD11      ILE  67  71.685  -4.916  14.791
  514   HD12  ILE  67          HD12      ILE  67  72.211  -3.333  14.219
  515   HD13  ILE  67          HD13      ILE  67  73.266  -4.290  15.260
  516    H1U  RCY  68           H1U      RCY  68  77.499   0.230   3.984
  517    H1S  RCY  68           H1S      RCY  68  73.462  -1.221   4.998
  518    HB1  RCY  68           HB1      RCY  68  71.038  -1.983   6.544
  519    HB2  RCY  68           HB2      RCY  68  72.111  -2.883   5.479
  520    HA   RCY  68           HA       RCY  68  70.597  -3.958   7.557
  521    HN1  RCY  68           HN1      RCY  68  73.413  -3.696   8.535
  522    HA   PRO  69           HA       PRO  69  71.051  -7.551   5.080
  523    HB2  PRO  69           HB2      PRO  69  71.404  -5.713   2.727
  524    HB3  PRO  69           HB1      PRO  69  70.410  -7.177   2.868
  525    HG2  PRO  69           HG2      PRO  69  69.389  -4.693   3.097
  526    HG3  PRO  69           HG1      PRO  69  68.725  -6.090   3.958
  527    HD2  PRO  69           HD2      PRO  69  70.127  -3.764   5.055
  528    HD3  PRO  69           HD1      PRO  69  69.221  -5.029   5.914
  529    H    TRP  70           HN       TRP  70  73.393  -4.949   4.477
  530    HA   TRP  70           HA       TRP  70  75.377  -6.498   3.141
  531    HD1  TRP  70           HD1      TRP  70  77.916  -5.898   2.492
  532    HE1  TRP  70           HE1      TRP  70  80.284  -5.820   3.504
  533    HE3  TRP  70           HE3      TRP  70  76.934  -3.401   6.836
  534    HZ2  TRP  70           HZ2      TRP  70  81.592  -4.829   5.852
  535    HZ3  TRP  70           HZ3      TRP  70  78.754  -2.904   8.439
  536    HH2  TRP  70           HH2      TRP  70  81.079  -3.613   7.956
  537    HB2  TRP  70           HB2      TRP  70  75.733  -4.150   3.169
  538    HB3  TRP  70           HB1      TRP  70  75.514  -4.056   4.916
  539    H    GLU  71           HN       GLU  71  74.643  -6.045   6.567
  540    HA   GLU  71           HA       GLU  71  76.928  -7.526   7.538
  541    HB2  GLU  71           HB2      GLU  71  74.318  -6.587   8.722
  542    HB3  GLU  71           HB1      GLU  71  75.360  -7.684   9.635
  543    HG2  GLU  71           HG2      GLU  71  77.257  -5.996   9.066
  544    HG3  GLU  71           HG1      GLU  71  75.942  -4.877   8.703
  545    H    ALA  72           HN       ALA  72  73.865  -8.418   6.208
  546    HA   ALA  72           HA       ALA  72  73.744 -11.052   7.446
  547    HB1  ALA  72           HB1      ALA  72  71.753  -9.784   6.535
  548    HB2  ALA  72           HB2      ALA  72  71.878 -11.451   5.973
  549    HB3  ALA  72           HB3      ALA  72  72.362 -10.125   4.916
  550    H1U  RCY  73           H1U      RCY  73  76.979  -6.074   2.368
  551    H1S  RCY  73           H1S      RCY  73  74.433  -8.297   3.535
  552    HB1  RCY  73           HB1      RCY  73  75.461 -11.586   1.283
  553    HB2  RCY  73           HB2      RCY  73  76.567 -10.300   1.765
  554    HA   RCY  73           HA       RCY  73  75.499 -12.508   3.348
  555    HN1  RCY  73           HN1      RCY  73  74.646  -9.848   4.200
  556    H    ASN  74           HN       ASN  74  77.223  -9.432   3.993
  557    HA   ASN  74           HA       ASN  74  79.410  -9.071   4.753
  558    HB2  ASN  74           HB2      ASN  74  79.891 -10.379   6.536
  559    HB3  ASN  74           HB1      ASN  74  78.506 -11.377   6.104
  560   HD21  ASN  74          HD21      ASN  74  78.914 -13.370   4.906
  561   HD22  ASN  74          HD22      ASN  74  80.479 -14.010   4.754
  562    H    HIS  75           HN       HIS  75  78.573 -10.682   2.107
  563    HA   HIS  75           HA       HIS  75  81.207 -11.797   1.385
  564    HD1  HIS  75           HD1      HIS  75  76.770 -12.553   0.478
  565    HD2  HIS  75           HD2      HIS  75  80.243 -14.385   1.884
  566    HE1  HIS  75           HE1      HIS  75  76.020 -14.467   1.957
  567    HE2  HIS  75           HE2      HIS  75  78.125 -15.591   2.819
  568    HB2  HIS  75           HB2      HIS  75  78.802 -11.441  -0.417
  569    HB3  HIS  75           HB1      HIS  75  80.148 -12.562  -0.620
  570    H1U  RCY  76           H1U      RCY  76  82.397  -1.421   1.420
  571    H1S  RCY  76           H1S      RCY  76  83.521  -6.015   1.325
  572    HB1  RCY  76           HB1      RCY  76  80.787  -7.342   0.684
  573    HB2  RCY  76           HB2      RCY  76  80.827  -6.153  -0.616
  574    HA   RCY  76           HA       RCY  76  79.590  -7.712  -1.734
  575    HN1  RCY  76           HN1      RCY  76  79.108  -9.695  -0.579
  576    H    GLU  77           HN       GLU  77  82.176 -10.055  -1.249
  577    HA   GLU  77           HA       GLU  77  83.799  -9.202  -3.472
  578    HB2  GLU  77           HB2      GLU  77  83.559 -11.910  -2.125
  579    HB3  GLU  77           HB1      GLU  77  84.822 -11.466  -3.274
  580    HG2  GLU  77           HG2      GLU  77  85.386  -9.526  -1.732
  581    HG3  GLU  77           HG1      GLU  77  84.307 -10.261  -0.546
  582    H    LEU  78           HN       LEU  78  81.989 -12.280  -3.281
  583    HA   LEU  78           HA       LEU  78  80.495 -11.774  -5.705
  584    HG   LEU  78           HG       LEU  78  81.199 -14.772  -6.878
  585    HB2  LEU  78           HB2      LEU  78  82.602 -12.084  -6.832
  586    HB3  LEU  78           HB1      LEU  78  82.981 -13.502  -5.856
  587   HD11  LEU  78          HD11      LEU  78  80.436 -12.088  -8.024
  588   HD12  LEU  78          HD12      LEU  78  79.430 -13.230  -7.133
  589   HD13  LEU  78          HD13      LEU  78  79.908 -13.585  -8.793
  590   HD21  LEU  78          HD21      LEU  78  81.889 -14.671  -9.286
  591   HD22  LEU  78          HD22      LEU  78  83.261 -14.701  -8.179
  592   HD23  LEU  78          HD23      LEU  78  82.770 -13.184  -8.933
  593    H    HIS  79           HN       HIS  79  78.658 -12.862  -5.186
  594    HA   HIS  79           HA       HIS  79  78.696 -15.711  -4.678
  595    HD1  HIS  79           HD1      HIS  79  78.419 -17.389  -3.870
  596    HD2  HIS  79           HD2      HIS  79  76.932 -15.818  -0.303
  597    HE1  HIS  79           HE1      HIS  79  77.416 -19.334  -2.595
  598    HE2  HIS  79           HE2      HIS  79  76.507 -18.392  -0.422
  599    HB2  HIS  79           HB2      HIS  79  79.370 -14.662  -2.437
  600    HB3  HIS  79           HB1      HIS  79  77.730 -14.018  -2.367
  601    H    GLU  80           HN       GLU  80  76.490 -13.215  -3.402
  602    HA   GLU  80           HA       GLU  80  74.227 -14.516  -4.705
  603    HB2  GLU  80           HB2      GLU  80  72.994 -12.461  -3.770
  604    HB3  GLU  80           HB1      GLU  80  73.749 -13.533  -2.595
  605    HG2  GLU  80           HG2      GLU  80  75.436 -11.324  -3.663
  606    HG3  GLU  80           HG1      GLU  80  74.136 -10.869  -2.561
  607    H    LEU  81           HN       LEU  81  73.236 -11.505  -5.075
  608    HA   LEU  81           HA       LEU  81  73.524 -11.522  -7.930
  609    HG   LEU  81           HG       LEU  81  73.695  -8.161  -6.493
  610    HB2  LEU  81           HB2      LEU  81  72.263  -9.515  -7.930
  611    HB3  LEU  81           HB1      LEU  81  71.666 -10.416  -6.540
  612   HD11  LEU  81          HD11      LEU  81  70.851  -8.449  -5.488
  613   HD12  LEU  81          HD12      LEU  81  71.444  -7.321  -6.707
  614   HD13  LEU  81          HD13      LEU  81  71.917  -7.125  -5.019
  615   HD21  LEU  81          HD21      LEU  81  72.738 -10.089  -4.370
  616   HD22  LEU  81          HD22      LEU  81  73.400  -8.508  -3.954
  617   HD23  LEU  81          HD23      LEU  81  74.398  -9.684  -4.809
  618    H    ALA  82           HN       ALA  82  75.848 -10.943  -5.702
  619    HA   ALA  82           HA       ALA  82  77.096  -8.545  -6.713
  620    HB1  ALA  82           HB1      ALA  82  79.091  -9.338  -5.495
  621    HB2  ALA  82           HB2      ALA  82  78.332 -10.915  -5.276
  622    HB3  ALA  82           HB3      ALA  82  77.645  -9.491  -4.496
  623    H    GLN  83           HN       GLN  83  76.275 -10.633  -8.721
  624    HA   GLN  83           HA       GLN  83  78.582 -11.928  -9.794
  625    HB2  GLN  83           HB2      GLN  83  75.990 -11.010 -11.058
  626    HB3  GLN  83           HB1      GLN  83  77.219 -11.907 -11.952
  627    HG2  GLN  83           HG2      GLN  83  76.157 -12.925  -9.319
  628    HG3  GLN  83           HG1      GLN  83  75.320 -13.268 -10.834
  629   HE21  GLN  83          HE21      GLN  83  76.053 -15.588 -10.032
  630   HE22  GLN  83          HE22      GLN  83  77.561 -16.120 -10.603
  631    H    TYR  84           HN       TYR  84  77.287  -8.666 -10.221
  632    HA   TYR  84           HA       TYR  84  79.797  -7.968 -11.688
  633    HD1  TYR  84           HD2      TYR  84  75.653  -6.847 -11.370
  634    HD2  TYR  84           HD1      TYR  84  77.543  -9.556 -14.117
  635    HE1  TYR  84           HE2      TYR  84  73.571  -8.191 -11.478
  636    HE2  TYR  84           HE1      TYR  84  75.462 -10.900 -14.224
  637    HH   TYR  84           HH       TYR  84  72.612 -10.031 -12.266
  638    HB2  TYR  84           HB2      TYR  84  77.750  -6.246 -12.641
  639    HB3  TYR  84           HB1      TYR  84  78.601  -7.495 -13.548
  640    H    GLY  85           HN       GLY  85  77.323  -7.142  -9.390
  641    HA2  GLY  85           HA2      GLY  85  77.568  -5.604  -7.589
  642    HA3  GLY  85           HA1      GLY  85  79.030  -4.981  -8.355
  643    H    ILE  86           HN       ILE  86  77.235  -4.911 -10.921
  644    HA   ILE  86           HA       ILE  86  76.030  -3.253 -12.057
  645    HB   ILE  86           HB       ILE  86  74.895  -2.466  -9.365
  646   HG12  ILE  86          HG12      ILE  86  74.903  -4.990  -9.768
  647   HG13  ILE  86          HG11      ILE  86  73.316  -4.261  -9.521
  648   HG21  ILE  86          HG21      ILE  86  73.922  -2.391 -12.230
  649   HG22  ILE  86          HG22      ILE  86  74.185  -1.026 -11.144
  650   HG23  ILE  86          HG23      ILE  86  72.851  -2.141 -10.851
  651   HD11  ILE  86          HD11      ILE  86  74.556  -4.830 -12.230
  652   HD12  ILE  86          HD12      ILE  86  72.939  -4.187 -11.938
  653   HD13  ILE  86          HD13      ILE  86  73.334  -5.835 -11.449
  654    H1U  RCY  87           H1U      RCY  87  78.371  -2.369  -2.075
  655    H1S  RCY  87           H1S      RCY  87  80.312  -1.725  -5.717
  656    HB1  RCY  87           HB1      RCY  87  79.654   0.410  -8.153
  657    HB2  RCY  87           HB2      RCY  87  80.645  -0.770  -9.011
  658    HA   RCY  87           HA       RCY  87  78.018   0.389  -9.747
  659    HN1  RCY  87           HN1      RCY  87  78.260  -2.508  -9.620
  Start of MODEL   83
    1    HA   MET   1           HA       MET   1  60.807   8.787 -10.451
    2    HB2  MET   1           HB2      MET   1  63.500  10.047 -10.833
    3    HB3  MET   1           HB1      MET   1  62.530  10.559  -9.451
    4    HG2  MET   1           HG2      MET   1  62.923   7.631 -10.042
    5    HG3  MET   1           HG1      MET   1  64.143   8.536  -9.145
    6    HE1  MET   1           HE1      MET   1  61.471   6.236  -8.858
    7    HE2  MET   1           HE2      MET   1  61.296   6.231  -7.105
    8    HE3  MET   1           HE3      MET   1  62.898   6.085  -7.824
    9    H    ASN   2           HN       ASN   2  59.393  10.339  -9.668
   10    HA   ASN   2           HA       ASN   2  57.953  12.189  -9.825
   11    HB2  ASN   2           HB2      ASN   2  60.644  13.425 -10.462
   12    HB3  ASN   2           HB1      ASN   2  59.179  14.377 -10.218
   13   HD21  ASN   2          HD21      ASN   2  61.110  14.925  -8.389
   14   HD22  ASN   2          HD22      ASN   2  60.788  14.188  -6.894
   15    H    LEU   3           HN       LEU   3  57.378  10.796 -11.933
   16    HA   LEU   3           HA       LEU   3  56.777  12.714 -13.997
   17    HG   LEU   3           HG       LEU   3  57.055  12.091 -16.371
   18    HB2  LEU   3           HB2      LEU   3  59.279  12.081 -14.358
   19    HB3  LEU   3           HB1      LEU   3  58.648  10.537 -14.928
   20   HD11  LEU   3          HD11      LEU   3  58.089  14.136 -15.200
   21   HD12  LEU   3          HD12      LEU   3  57.979  14.201 -16.959
   22   HD13  LEU   3          HD13      LEU   3  59.520  13.830 -16.184
   23   HD21  LEU   3          HD21      LEU   3  59.970  11.481 -16.929
   24   HD22  LEU   3          HD22      LEU   3  58.863  12.086 -18.161
   25   HD23  LEU   3          HD23      LEU   3  58.565  10.524 -17.398
   26    H    GLU   4           HN       GLU   4  57.550   9.229 -14.223
   27    HA   GLU   4           HA       GLU   4  54.781   8.756 -15.164
   28    HB2  GLU   4           HB2      GLU   4  56.884   7.817 -16.313
   29    HB3  GLU   4           HB1      GLU   4  56.983   6.700 -14.951
   30    HG2  GLU   4           HG2      GLU   4  54.741   5.856 -15.433
   31    HG3  GLU   4           HG1      GLU   4  54.555   7.028 -16.739
   32    HA   PRO   5           HA       PRO   5  53.267   7.544 -11.144
   33    HB2  PRO   5           HB2      PRO   5  52.026   5.341 -12.761
   34    HB3  PRO   5           HB1      PRO   5  51.288   6.382 -11.527
   35    HG2  PRO   5           HG2      PRO   5  50.919   6.806 -14.143
   36    HG3  PRO   5           HG1      PRO   5  51.017   8.136 -12.979
   37    HD2  PRO   5           HD2      PRO   5  52.970   7.328 -15.052
   38    HD3  PRO   5           HD1      PRO   5  52.782   8.892 -14.229
   39    HA   PRO   6           HA       PRO   6  56.167   4.260 -10.166
   40    HB2  PRO   6           HB2      PRO   6  55.552   3.918  -7.541
   41    HB3  PRO   6           HB1      PRO   6  56.418   5.350  -8.134
   42    HG2  PRO   6           HG2      PRO   6  53.540   5.049  -7.431
   43    HG3  PRO   6           HG1      PRO   6  54.646   6.396  -7.112
   44    HD2  PRO   6           HD2      PRO   6  52.816   6.392  -9.171
   45    HD3  PRO   6           HD1      PRO   6  54.328   7.326  -9.201
   46    H    LYS   7           HN       LYS   7  56.137   1.975  -9.347
   47    HA   LYS   7           HA       LYS   7  53.430   0.722  -9.352
   48    HB2  LYS   7           HB2      LYS   7  54.567  -1.154 -10.754
   49    HB3  LYS   7           HB1      LYS   7  54.049   0.312 -11.586
   50    HG2  LYS   7           HG2      LYS   7  56.254   1.169 -11.693
   51    HG3  LYS   7           HG1      LYS   7  56.839   0.044 -10.467
   52    HD2  LYS   7           HD2      LYS   7  56.375  -1.842 -12.043
   53    HD3  LYS   7           HD1      LYS   7  55.942  -0.658 -13.277
   54    HE2  LYS   7           HE2      LYS   7  58.197   0.339 -13.110
   55    HE3  LYS   7           HE1      LYS   7  58.632  -0.857 -11.889
   56    HZ1  LYS   7           HZ1      LYS   7  59.377  -1.928 -13.722
   57    HZ2  LYS   7           HZ2      LYS   7  58.264  -1.180 -14.765
   58    HZ3  LYS   7           HZ3      LYS   7  57.771  -2.470 -13.776
   59    H    ALA   8           HN       ALA   8  56.095  -1.389  -9.660
   60    HA   ALA   8           HA       ALA   8  57.139  -2.829  -8.132
   61    HB1  ALA   8           HB1      ALA   8  57.953  -1.891  -6.146
   62    HB2  ALA   8           HB2      ALA   8  56.525  -0.882  -5.919
   63    HB3  ALA   8           HB3      ALA   8  57.712  -0.464  -7.154
   64    H    GLU   9           HN       GLU   9  56.237  -2.754  -5.202
   65    HA   GLU   9           HA       GLU   9  53.432  -3.626  -5.377
   66    HB2  GLU   9           HB2      GLU   9  55.308  -5.543  -5.894
   67    HB3  GLU   9           HB1      GLU   9  55.180  -5.685  -4.142
   68    HG2  GLU   9           HG2      GLU   9  53.503  -7.144  -4.920
   69    HG3  GLU   9           HG1      GLU   9  52.611  -5.669  -4.548
   70    H1U  RCY  10           H1U      RCY  10  52.423 -10.436   0.499
   71    H1S  RCY  10           H1S      RCY  10  50.583  -6.294  -0.260
   72    HB1  RCY  10           HB1      RCY  10  51.834  -3.345  -0.098
   73    HB2  RCY  10           HB2      RCY  10  52.498  -4.950   0.169
   74    HA   RCY  10           HA       RCY  10  53.729  -2.652  -1.104
   75    HN1  RCY  10           HN1      RCY  10  53.168  -4.878  -2.948
   76    H    ARG  11           HN       ARG  11  53.682  -5.219   0.916
   77    HA   ARG  11           HA       ARG  11  55.333  -6.487   2.010
   78    HE   ARG  11           HE       ARG  11  59.198  -7.012  -1.321
   79    HB2  ARG  11           HB2      ARG  11  56.115  -6.745  -0.538
   80    HB3  ARG  11           HB1      ARG  11  57.440  -5.726   0.020
   81    HG2  ARG  11           HG2      ARG  11  57.987  -7.307   1.782
   82    HG3  ARG  11           HG1      ARG  11  56.573  -8.288   1.391
   83    HD2  ARG  11           HD2      ARG  11  58.533  -9.316   0.384
   84    HD3  ARG  11           HD1      ARG  11  57.522  -8.651  -0.898
   85   HH11  ARG  11          HH21      ARG  11  59.768  -8.854   1.537
   86   HH12  ARG  11          HH22      ARG  11  61.390  -8.282   1.743
   87   HH21  ARG  11          HH11      ARG  11  61.313  -6.253  -1.069
   88   HH22  ARG  11          HH12      ARG  11  62.264  -6.809   0.267
   89    H    SER  12           HN       SER  12  54.996  -3.386   1.930
   90    HA   SER  12           HA       SER  12  57.065  -2.874   3.927
   91    HG   SER  12           HG       SER  12  57.560  -0.558   0.640
   92    HB2  SER  12           HB2      SER  12  58.147  -1.034   2.748
   93    HB3  SER  12           HB1      SER  12  58.276  -2.493   1.769
   94    H    ALA  13           HN       ALA  13  56.211  -0.044   2.294
   95    HA   ALA  13           HA       ALA  13  54.833   1.737   2.980
   96    HB1  ALA  13           HB1      ALA  13  52.477   1.210   3.004
   97    HB2  ALA  13           HB2      ALA  13  52.808  -0.484   3.369
   98    HB3  ALA  13           HB3      ALA  13  53.238   0.179   1.792
   99    H    THR  14           HN       THR  14  55.756   2.396   4.942
  100    HA   THR  14           HA       THR  14  54.440   1.306   7.403
  101    HB   THR  14           HB       THR  14  56.590   1.706   8.598
  102    HG1  THR  14           HG1      THR  14  58.217   2.574   7.584
  103   HG21  THR  14          HG21      THR  14  56.059  -0.536   7.727
  104   HG22  THR  14          HG22      THR  14  57.793  -0.223   7.639
  105   HG23  THR  14          HG23      THR  14  56.802  -0.115   6.184
  106    H    ARG  15           HN       ARG  15  56.362   4.059   6.149
  107    HA   ARG  15           HA       ARG  15  54.356   5.935   7.167
  108    HE   ARG  15           HE       ARG  15  56.444   6.100  11.041
  109    HB2  ARG  15           HB2      ARG  15  56.014   5.287   9.095
  110    HB3  ARG  15           HB1      ARG  15  57.150   6.319   8.226
  111    HG2  ARG  15           HG2      ARG  15  55.223   8.063   8.219
  112    HG3  ARG  15           HG1      ARG  15  54.524   7.071   9.499
  113    HD2  ARG  15           HD2      ARG  15  57.331   8.217   9.551
  114    HD3  ARG  15           HD1      ARG  15  55.948   8.914  10.393
  115   HH11  ARG  15          HH21      ARG  15  57.073   9.423  11.712
  116   HH12  ARG  15          HH22      ARG  15  57.529   9.142  13.359
  117   HH21  ARG  15          HH11      ARG  15  57.036   5.714  13.188
  118   HH22  ARG  15          HH12      ARG  15  57.508   7.042  14.195
  119    H    VAL  16           HN       VAL  16  56.223   5.038   4.771
  120    HA   VAL  16           HA       VAL  16  57.156   6.115   2.910
  121    HB   VAL  16           HB       VAL  16  55.812   8.628   3.914
  122   HG11  VAL  16          HG11      VAL  16  57.256   8.737   1.887
  123   HG12  VAL  16          HG12      VAL  16  55.564   9.071   1.519
  124   HG13  VAL  16          HG13      VAL  16  56.256   7.494   1.135
  125   HG21  VAL  16          HG21      VAL  16  54.585   6.196   2.584
  126   HG22  VAL  16          HG22      VAL  16  53.799   7.774   2.629
  127   HG23  VAL  16          HG23      VAL  16  54.131   6.911   4.131
  128    H    MET  17           HN       MET  17  59.123   5.830   4.526
  129    HA   MET  17           HA       MET  17  61.117   6.727   5.383
  130    HB2  MET  17           HB2      MET  17  60.556   9.140   3.657
  131    HB3  MET  17           HB1      MET  17  62.113   8.412   4.056
  132    HG2  MET  17           HG2      MET  17  61.494   6.398   2.754
  133    HG3  MET  17           HG1      MET  17  59.959   7.154   2.330
  134    HE1  MET  17           HE1      MET  17  59.809   8.543  -0.099
  135    HE2  MET  17           HE2      MET  17  60.670  10.054   0.186
  136    HE3  MET  17           HE3      MET  17  59.710   9.337   1.478
  137    H    GLY  18           HN       GLY  18  61.948   9.208   6.106
  138    HA2  GLY  18           HA2      GLY  18  61.582  11.007   7.591
  139    HA3  GLY  18           HA1      GLY  18  59.846  10.735   7.427
  140    H    GLY  19           HN       GLY  19  59.846  11.071   9.821
  141    HA2  GLY  19           HA2      GLY  19  59.273   9.846  11.810
  142    HA3  GLY  19           HA1      GLY  19  60.175   8.463  11.188
  143    HA   PRO  20           HA       PRO  20  62.595  10.496  14.680
  144    HB2  PRO  20           HB2      PRO  20  63.509   7.641  14.662
  145    HB3  PRO  20           HB1      PRO  20  63.154   8.702  16.040
  146    HG2  PRO  20           HG2      PRO  20  61.450   6.810  15.275
  147    HG3  PRO  20           HG1      PRO  20  60.882   8.379  15.871
  148    HD2  PRO  20           HD2      PRO  20  60.897   7.322  13.082
  149    HD3  PRO  20           HD1      PRO  20  59.793   8.489  13.842
  150    H1U  RCY  21           H1U      RCY  21  63.377   3.615   6.670
  151    H1S  RCY  21           H1S      RCY  21  65.793   4.711  10.428
  152    HB1  RCY  21           HB1      RCY  21  66.199   8.424   9.589
  153    HB2  RCY  21           HB2      RCY  21  64.501   8.050   9.882
  154    HA   RCY  21           HA       RCY  21  66.208   9.485  11.925
  155    HN1  RCY  21           HN1      RCY  21  63.289   8.975  11.690
  156    H    THR  22           HN       THR  22  67.261  10.981  10.551
  157    HA   THR  22           HA       THR  22  65.550  12.641   8.767
  158    HB   THR  22           HB       THR  22  65.471  14.040  10.636
  159    HG1  THR  22           HG1      THR  22  67.986  14.850   9.685
  160   HG21  THR  22          HG21      THR  22  67.565  14.389  12.069
  161   HG22  THR  22          HG22      THR  22  68.246  12.999  11.224
  162   HG23  THR  22          HG23      THR  22  66.785  12.812  12.195
  163    HA   PRO  23           HA       PRO  23  69.419  11.426   6.587
  164    HB2  PRO  23           HB2      PRO  23  67.862  12.645   4.353
  165    HB3  PRO  23           HB1      PRO  23  68.704  11.085   4.423
  166    HG2  PRO  23           HG2      PRO  23  66.044  11.252   4.544
  167    HG3  PRO  23           HG1      PRO  23  66.946  10.033   5.459
  168    HD2  PRO  23           HD2      PRO  23  65.636  12.536   6.442
  169    HD3  PRO  23           HD1      PRO  23  65.846  10.974   7.264
  170    H    ARG  24           HN       ARG  24  71.072  12.731   5.515
  171    HA   ARG  24           HA       ARG  24  70.666  15.588   5.141
  172    HE   ARG  24           HE       ARG  24  73.155  12.388   9.977
  173    HB2  ARG  24           HB2      ARG  24  72.217  16.353   6.872
  174    HB3  ARG  24           HB1      ARG  24  70.887  15.470   7.615
  175    HG2  ARG  24           HG2      ARG  24  73.303  13.900   6.830
  176    HG3  ARG  24           HG1      ARG  24  73.439  14.947   8.243
  177    HD2  ARG  24           HD2      ARG  24  71.480  13.875   9.257
  178    HD3  ARG  24           HD1      ARG  24  71.279  12.859   7.829
  179   HH11  ARG  24          HH21      ARG  24  72.644  12.189   6.573
  180   HH12  ARG  24          HH22      ARG  24  73.742  10.868   6.351
  181   HH21  ARG  24          HH11      ARG  24  74.592  10.664   9.707
  182   HH22  ARG  24          HH12      ARG  24  74.845  10.005   8.125
  183    H    LYS  25           HN       LYS  25  71.770  13.083   3.834
  184    HA   LYS  25           HA       LYS  25  74.623  13.455   3.575
  185    HB2  LYS  25           HB2      LYS  25  73.509  12.193   1.229
  186    HB3  LYS  25           HB1      LYS  25  74.456  11.462   2.522
  187    HG2  LYS  25           HG2      LYS  25  72.365  10.309   2.526
  188    HG3  LYS  25           HG1      LYS  25  72.298  11.420   3.894
  189    HD2  LYS  25           HD2      LYS  25  70.293  12.000   2.955
  190    HD3  LYS  25           HD1      LYS  25  71.316  13.028   1.951
  191    HE2  LYS  25           HE2      LYS  25  70.125  10.339   1.278
  192    HE3  LYS  25           HE1      LYS  25  69.984  11.855   0.389
  193    HZ1  LYS  25           HZ1      LYS  25  72.360  11.735  -0.091
  194    HZ2  LYS  25           HZ2      LYS  25  71.536  10.378  -0.695
  195    HZ3  LYS  25           HZ3      LYS  25  72.461  10.251   0.725
  196    H    GLY  26           HN       GLY  26  75.753  14.347   1.746
  197    HA2  GLY  26           HA2      GLY  26  74.827  16.846   0.827
  198    HA3  GLY  26           HA1      GLY  26  76.121  15.929   0.053
  199    HA   PRO  27           HA       PRO  27  72.617  16.546  -3.008
  200    HB2  PRO  27           HB2      PRO  27  75.047  16.051  -4.692
  201    HB3  PRO  27           HB1      PRO  27  73.724  17.209  -4.937
  202    HG2  PRO  27           HG2      PRO  27  76.093  17.988  -4.014
  203    HG3  PRO  27           HG1      PRO  27  74.588  18.715  -3.426
  204    HD2  PRO  27           HD2      PRO  27  76.419  16.811  -2.045
  205    HD3  PRO  27           HD1      PRO  27  75.343  18.045  -1.354
  206    HA   PRO  28           HA       PRO  28  71.619  12.215  -3.404
  207    HB2  PRO  28           HB2      PRO  28  70.970  13.029  -6.220
  208    HB3  PRO  28           HB1      PRO  28  70.014  12.062  -5.079
  209    HG2  PRO  28           HG2      PRO  28  69.481  14.644  -5.552
  210    HG3  PRO  28           HG1      PRO  28  69.233  13.902  -3.964
  211    HD2  PRO  28           HD2      PRO  28  71.273  15.873  -4.795
  212    HD3  PRO  28           HD1      PRO  28  70.696  15.470  -3.164
  213    H    LYS  29           HN       LYS  29  72.237  10.309  -4.760
  214    HA   LYS  29           HA       LYS  29  73.835   9.014  -5.873
  215    HB2  LYS  29           HB2      LYS  29  74.605  11.561  -7.317
  216    HB3  LYS  29           HB1      LYS  29  74.784   9.901  -7.883
  217    HG2  LYS  29           HG2      LYS  29  72.292   9.666  -7.828
  218    HG3  LYS  29           HG1      LYS  29  72.178  11.377  -7.414
  219    HD2  LYS  29           HD2      LYS  29  73.530  10.296  -9.904
  220    HD3  LYS  29           HD1      LYS  29  71.898  10.965  -9.860
  221    HE2  LYS  29           HE2      LYS  29  73.071  13.030  -8.741
  222    HE3  LYS  29           HE1      LYS  29  74.527  12.370  -9.485
  223    HZ1  LYS  29           HZ1      LYS  29  72.888  12.223 -11.537
  224    HZ2  LYS  29           HZ2      LYS  29  73.791  13.623 -11.199
  225    HZ3  LYS  29           HZ3      LYS  29  72.159  13.528 -10.734
  226    H1U  RCY  30           H1U      RCY  30  75.813   7.299 -11.056
  227    H1S  RCY  30           H1S      RCY  30  78.381   8.899  -8.390
  228    HB1  RCY  30           HB1      RCY  30  79.860  10.319  -5.880
  229    HB2  RCY  30           HB2      RCY  30  78.660  10.334  -7.173
  230    HA   RCY  30           HA       RCY  30  77.918   9.546  -4.355
  231    HN1  RCY  30           HN1      RCY  30  76.428   9.723  -6.760
  232    H    LYS  31           HN       LYS  31  77.535  11.162  -2.845
  233    HA   LYS  31           HA       LYS  31  77.253  13.944  -3.479
  234    HB2  LYS  31           HB2      LYS  31  77.854  14.222  -0.990
  235    HB3  LYS  31           HB1      LYS  31  76.424  13.258  -1.360
  236    HG2  LYS  31           HG2      LYS  31  77.437  11.270  -0.766
  237    HG3  LYS  31           HG1      LYS  31  79.048  11.838  -1.206
  238    HD2  LYS  31           HD2      LYS  31  79.186  13.202   0.782
  239    HD3  LYS  31           HD1      LYS  31  77.498  12.879   1.180
  240    HE2  LYS  31           HE2      LYS  31  79.235  10.496   0.819
  241    HE3  LYS  31           HE1      LYS  31  79.549  11.478   2.250
  242    HZ1  LYS  31           HZ1      LYS  31  77.400  11.162   3.035
  243    HZ2  LYS  31           HZ2      LYS  31  77.822   9.633   2.428
  244    HZ3  LYS  31           HZ3      LYS  31  76.806  10.656   1.529
  245    H    GLN  32           HN       GLN  32  79.610  13.769  -1.097
  246    HA   GLN  32           HA       GLN  32  81.759  14.507  -3.055
  247    HB2  GLN  32           HB2      GLN  32  80.746  16.329  -1.483
  248    HB3  GLN  32           HB1      GLN  32  81.660  15.515  -0.213
  249    HG2  GLN  32           HG2      GLN  32  83.691  15.703  -1.774
  250    HG3  GLN  32           HG1      GLN  32  82.721  16.839  -2.714
  251   HE21  GLN  32          HE21      GLN  32  85.079  16.888  -0.451
  252   HE22  GLN  32          HE22      GLN  32  84.648  18.281   0.417
  253    H    ARG  33           HN       ARG  33  80.759  12.281  -0.769
  254    HA   ARG  33           HA       ARG  33  81.942  10.858   0.737
  255    HE   ARG  33           HE       ARG  33  81.431   9.657  -4.503
  256    HB2  ARG  33           HB2      ARG  33  83.380   9.330  -0.624
  257    HB3  ARG  33           HB1      ARG  33  81.803   9.625  -1.348
  258    HG2  ARG  33           HG2      ARG  33  84.128  11.384  -2.085
  259    HG3  ARG  33           HG1      ARG  33  83.952   9.803  -2.847
  260    HD2  ARG  33           HD2      ARG  33  81.428  11.268  -2.773
  261    HD3  ARG  33           HD1      ARG  33  82.682  12.151  -3.645
  262   HH11  ARG  33          HH21      ARG  33  84.209  11.698  -4.598
  263   HH12  ARG  33          HH22      ARG  33  84.765  11.093  -6.123
  264   HH21  ARG  33          HH11      ARG  33  82.142   8.856  -6.494
  265   HH22  ARG  33          HH12      ARG  33  83.595   9.484  -7.196
  266    H    GLN  34           HN       GLN  34  84.790  10.059  -0.001
  267    HA   GLN  34           HA       GLN  34  86.933  10.632   0.759
  268    HB2  GLN  34           HB2      GLN  34  86.415  12.456  -1.034
  269    HB3  GLN  34           HB1      GLN  34  86.189  13.526   0.350
  270    HG2  GLN  34           HG2      GLN  34  88.450  12.956   1.163
  271    HG3  GLN  34           HG1      GLN  34  88.679  11.892  -0.225
  272   HE21  GLN  34          HE21      GLN  34  87.341  15.236   0.094
  273   HE22  GLN  34          HE22      GLN  34  88.353  15.907  -1.092
  274    H    THR  35           HN       THR  35  84.716  10.474   2.675
  275    HA   THR  35           HA       THR  35  84.748  12.591   4.570
  276    HB   THR  35           HB       THR  35  84.496   9.676   5.326
  277    HG1  THR  35           HG1      THR  35  82.620  11.368   4.042
  278   HG21  THR  35          HG21      THR  35  82.892  12.050   6.273
  279   HG22  THR  35          HG22      THR  35  84.435  11.621   7.011
  280   HG23  THR  35          HG23      THR  35  83.090  10.481   7.054
  281    H    ARG  36           HN       ARG  36  86.376   9.438   5.052
  282    HA   ARG  36           HA       ARG  36  88.949  10.597   5.595
  283    HE   ARG  36           HE       ARG  36  85.024   9.218  10.598
  284    HB2  ARG  36           HB2      ARG  36  88.966  10.134   8.068
  285    HB3  ARG  36           HB1      ARG  36  87.914  11.472   7.605
  286    HG2  ARG  36           HG2      ARG  36  85.964   9.963   7.644
  287    HG3  ARG  36           HG1      ARG  36  87.011   8.619   8.101
  288    HD2  ARG  36           HD2      ARG  36  87.732  10.170  10.074
  289    HD3  ARG  36           HD1      ARG  36  86.241  11.041   9.713
  290   HH11  ARG  36          HH21      ARG  36  88.308   8.408   9.931
  291   HH12  ARG  36          HH22      ARG  36  88.217   6.854  10.690
  292   HH21  ARG  36          HH11      ARG  36  84.887   7.193  11.593
  293   HH22  ARG  36          HH12      ARG  36  86.281   6.166  11.630
  294    H    GLN  37           HN       GLN  37  88.244   8.472   4.026
  295    HA   GLN  37           HA       GLN  37  88.791   6.232   3.612
  296    HB2  GLN  37           HB2      GLN  37  90.410   6.300   6.160
  297    HB3  GLN  37           HB1      GLN  37  90.717   5.375   4.690
  298    HG2  GLN  37           HG2      GLN  37  90.962   7.633   3.503
  299    HG3  GLN  37           HG1      GLN  37  91.026   8.352   5.113
  300   HE21  GLN  37          HE21      GLN  37  92.334   5.384   5.617
  301   HE22  GLN  37          HE22      GLN  37  93.972   5.721   5.324
  302    H1U  RCY  38           H1U      RCY  38  87.812  -3.249   3.109
  303    H1S  RCY  38           H1S      RCY  38  86.388  -0.312   5.556
  304    HB1  RCY  38           HB1      RCY  38  87.426   1.477   5.852
  305    HB2  RCY  38           HB2      RCY  38  87.247   2.198   4.253
  306    HA   RCY  38           HA       RCY  38  85.826   3.943   5.870
  307    HN1  RCY  38           HN1      RCY  38  88.113   4.124   4.245
  308    H    LYS  39           HN       LYS  39  89.032   2.603   6.750
  309    HA   LYS  39           HA       LYS  39  89.191   3.819   9.308
  310    HB2  LYS  39           HB2      LYS  39  88.663   1.641  10.633
  311    HB3  LYS  39           HB1      LYS  39  87.309   2.639  10.104
  312    HG2  LYS  39           HG2      LYS  39  86.634   1.125   8.505
  313    HG3  LYS  39           HG1      LYS  39  88.275   0.548   8.208
  314    HD2  LYS  39           HD2      LYS  39  88.253  -0.647  10.364
  315    HD3  LYS  39           HD1      LYS  39  86.616  -0.066  10.673
  316    HE2  LYS  39           HE2      LYS  39  85.758  -1.275   8.759
  317    HE3  LYS  39           HE1      LYS  39  87.388  -1.727   8.259
  318    HZ1  LYS  39           HZ1      LYS  39  86.069  -2.537  10.794
  319    HZ2  LYS  39           HZ2      LYS  39  87.637  -2.975  10.307
  320    HZ3  LYS  39           HZ3      LYS  39  86.289  -3.529   9.435
  321    H    SER  40           HN       SER  40  91.246   3.653   7.839
  322    HA   SER  40           HA       SER  40  93.400   2.770   7.537
  323    HG   SER  40           HG       SER  40  94.948   0.995  10.040
  324    HB2  SER  40           HB2      SER  40  93.198   2.865  10.096
  325    HB3  SER  40           HB1      SER  40  92.842   1.142  10.025
  326    H    LYS  41           HN       LYS  41  91.866   1.596   5.805
  327    HA   LYS  41           HA       LYS  41  91.020  -0.993   5.807
  328    HB2  LYS  41           HB2      LYS  41  92.267  -1.107   3.456
  329    HB3  LYS  41           HB1      LYS  41  90.883  -0.042   3.704
  330    HG2  LYS  41           HG2      LYS  41  92.321   1.855   4.100
  331    HG3  LYS  41           HG1      LYS  41  93.755   0.828   4.118
  332    HD2  LYS  41           HD2      LYS  41  93.209   0.178   1.737
  333    HD3  LYS  41           HD1      LYS  41  91.958   1.422   1.753
  334    HE2  LYS  41           HE2      LYS  41  94.103   2.246   0.785
  335    HE3  LYS  41           HE1      LYS  41  93.626   3.143   2.226
  336    HZ1  LYS  41           HZ1      LYS  41  95.158   0.887   2.955
  337    HZ2  LYS  41           HZ2      LYS  41  95.483   2.531   3.231
  338    HZ3  LYS  41           HZ3      LYS  41  96.004   1.790   1.794
  339    HA   PRO  42           HA       PRO  42  94.939  -2.924   7.116
  340    HB2  PRO  42           HB2      PRO  42  93.865  -4.897   8.615
  341    HB3  PRO  42           HB1      PRO  42  93.943  -3.223   9.199
  342    HG2  PRO  42           HG2      PRO  42  91.631  -4.740   8.128
  343    HG3  PRO  42           HG1      PRO  42  91.687  -3.512   9.401
  344    HD2  PRO  42           HD2      PRO  42  90.908  -3.070   6.734
  345    HD3  PRO  42           HD1      PRO  42  91.337  -1.812   7.912
  346    HA   PRO  43           HA       PRO  43  95.187  -6.186   4.127
  347    HB2  PRO  43           HB2      PRO  43  96.855  -7.984   5.404
  348    HB3  PRO  43           HB1      PRO  43  97.412  -6.499   4.611
  349    HG2  PRO  43           HG2      PRO  43  96.936  -7.034   7.495
  350    HG3  PRO  43           HG1      PRO  43  98.211  -6.082   6.716
  351    HD2  PRO  43           HD2      PRO  43  96.056  -4.924   7.920
  352    HD3  PRO  43           HD1      PRO  43  96.871  -4.196   6.517
  353    H    LYS  44           HN       LYS  44  93.592  -7.648   3.679
  354    HA   LYS  44           HA       LYS  44  93.102  -9.924   5.429
  355    HB2  LYS  44           HB2      LYS  44  91.793  -7.870   6.383
  356    HB3  LYS  44           HB1      LYS  44  90.719  -8.127   5.009
  357    HG2  LYS  44           HG2      LYS  44  89.707  -9.477   6.615
  358    HG3  LYS  44           HG1      LYS  44  90.773 -10.640   5.824
  359    HD2  LYS  44           HD2      LYS  44  91.397 -11.040   8.002
  360    HD3  LYS  44           HD1      LYS  44  92.492  -9.700   7.660
  361    HE2  LYS  44           HE2      LYS  44  89.895  -9.662   9.188
  362    HE3  LYS  44           HE1      LYS  44  91.475  -9.058   9.684
  363    HZ1  LYS  44           HZ1      LYS  44  89.972  -7.261   9.065
  364    HZ2  LYS  44           HZ2      LYS  44  89.806  -7.920   7.508
  365    HZ3  LYS  44           HZ3      LYS  44  91.311  -7.325   8.025
  366    H    LYS  45           HN       LYS  45  93.060 -11.445   3.836
  367    HA   LYS  45           HA       LYS  45  92.573 -12.468   1.771
  368    HB2  LYS  45           HB2      LYS  45  89.935 -11.051   2.268
  369    HB3  LYS  45           HB1      LYS  45  90.183 -12.429   1.193
  370    HG2  LYS  45           HG2      LYS  45  91.113 -13.651   3.261
  371    HG3  LYS  45           HG1      LYS  45  90.388 -12.350   4.205
  372    HD2  LYS  45           HD2      LYS  45  88.217 -12.852   2.921
  373    HD3  LYS  45           HD1      LYS  45  89.002 -14.348   2.414
  374    HE2  LYS  45           HE2      LYS  45  87.829 -14.955   4.377
  375    HE3  LYS  45           HE1      LYS  45  89.489 -14.721   4.924
  376    HZ1  LYS  45           HZ1      LYS  45  87.118 -13.101   5.427
  377    HZ2  LYS  45           HZ2      LYS  45  88.581 -12.265   5.208
  378    HZ3  LYS  45           HZ3      LYS  45  88.442 -13.431   6.436
  379    H    GLY  46           HN       GLY  46  90.216 -10.279   0.675
  380    HA2  GLY  46           HA2      GLY  46  91.477  -9.611  -1.721
  381    HA3  GLY  46           HA1      GLY  46  90.251  -8.592  -0.966
  382    H    VAL  47           HN       VAL  47  93.538  -8.807  -1.811
  383    HA   VAL  47           HA       VAL  47  94.734  -7.136   0.171
  384    HB   VAL  47           HB       VAL  47  95.589  -7.027  -2.711
  385   HG11  VAL  47          HG11      VAL  47  97.748  -6.790  -1.793
  386   HG12  VAL  47          HG12      VAL  47  97.267  -7.497  -0.251
  387   HG13  VAL  47          HG13      VAL  47  96.731  -5.873  -0.682
  388   HG21  VAL  47          HG21      VAL  47  95.110  -9.354  -2.506
  389   HG22  VAL  47          HG22      VAL  47  95.704  -9.406  -0.846
  390   HG23  VAL  47          HG23      VAL  47  96.838  -9.211  -2.183
  391    H    GLN  48           HN       GLN  48  95.143  -4.847   0.117
  392    HA   GLN  48           HA       GLN  48  94.339  -2.641  -0.093
  393    HB2  GLN  48           HB2      GLN  48  94.444  -3.614  -2.960
  394    HB3  GLN  48           HB1      GLN  48  94.090  -1.942  -2.534
  395    HG2  GLN  48           HG2      GLN  48  96.396  -1.824  -2.789
  396    HG3  GLN  48           HG1      GLN  48  96.286  -2.192  -1.067
  397   HE21  GLN  48          HE21      GLN  48  98.581  -3.103  -1.593
  398   HE22  GLN  48          HE22      GLN  48  98.658  -4.719  -2.107
  399    H    GLY  49           HN       GLY  49  92.331  -5.037  -0.047
  400    HA2  GLY  49           HA2      GLY  49  89.999  -5.295  -0.174
  401    HA3  GLY  49           HA1      GLY  49  89.950  -3.558   0.137
  402    H1U  RCY  50           H1U      RCY  50  84.148  -2.454  -3.379
  403    H1S  RCY  50           H1S      RCY  50  87.908  -2.877  -5.529
  404    HB1  RCY  50           HB1      RCY  50  88.679  -5.175  -4.110
  405    HB2  RCY  50           HB2      RCY  50  90.093  -5.963  -4.804
  406    HA   RCY  50           HA       RCY  50  91.282  -3.845  -4.916
  407    HN1  RCY  50           HN1      RCY  50  91.718  -4.327  -2.660
  408    H    GLY  51           HN       GLY  51  89.999  -2.124  -2.513
  409    HA2  GLY  51           HA2      GLY  51  88.230  -0.472  -4.265
  410    HA3  GLY  51           HA1      GLY  51  88.191  -0.453  -2.501
  411    H    ASP  52           HN       ASP  52  90.723  -0.074  -1.718
  412    HA   ASP  52           HA       ASP  52  92.331   1.612  -1.434
  413    HB2  ASP  52           HB2      ASP  52  92.104   2.042  -4.417
  414    HB3  ASP  52           HB1      ASP  52  93.521   2.263  -3.389
  415    H    ASP  53           HN       ASP  53  89.259   2.229  -1.965
  416    HA   ASP  53           HA       ASP  53  89.418   5.013  -1.293
  417    HB2  ASP  53           HB2      ASP  53  90.041   5.366  -3.608
  418    HB3  ASP  53           HB1      ASP  53  88.721   4.339  -4.167
  419    H    ILE  54           HN       ILE  54  87.608   5.258  -0.069
  420    HA   ILE  54           HA       ILE  54  85.391   3.380  -0.378
  421    HB   ILE  54           HB       ILE  54  84.504   4.323   1.643
  422   HG12  ILE  54          HG12      ILE  54  84.724   6.696   1.019
  423   HG13  ILE  54          HG11      ILE  54  85.437   6.411   2.608
  424   HG21  ILE  54          HG21      ILE  54  86.618   2.965   1.817
  425   HG22  ILE  54          HG22      ILE  54  86.387   4.096   3.150
  426   HG23  ILE  54          HG23      ILE  54  87.524   4.478   1.857
  427   HD11  ILE  54          HD11      ILE  54  87.661   6.070   1.340
  428   HD12  ILE  54          HD12      ILE  54  87.053   7.720   1.478
  429   HD13  ILE  54          HD13      ILE  54  86.846   6.827  -0.029
  430    HA   PRO  55           HA       PRO  55  83.205   6.245  -3.046
  431    HB2  PRO  55           HB2      PRO  55  80.999   4.758  -3.512
  432    HB3  PRO  55           HB1      PRO  55  82.579   4.312  -4.187
  433    HG2  PRO  55           HG2      PRO  55  81.170   3.197  -1.812
  434    HG3  PRO  55           HG1      PRO  55  82.098   2.362  -3.069
  435    HD2  PRO  55           HD2      PRO  55  83.106   3.002  -0.568
  436    HD3  PRO  55           HD1      PRO  55  84.111   2.739  -2.011
  437    H    GLY  56           HN       GLY  56  83.082   7.090  -0.431
  438    HA2  GLY  56           HA2      GLY  56  81.686   8.536   0.816
  439    HA3  GLY  56           HA1      GLY  56  80.354   8.128  -0.267
  440    H    MET  57           HN       MET  57  82.091   7.158   2.622
  441    HA   MET  57           HA       MET  57  81.102   4.699   3.313
  442    HB2  MET  57           HB2      MET  57  82.440   6.336   4.774
  443    HB3  MET  57           HB1      MET  57  80.881   6.999   5.262
  444    HG2  MET  57           HG2      MET  57  80.185   4.661   5.914
  445    HG3  MET  57           HG1      MET  57  81.848   4.151   5.622
  446    HE1  MET  57           HE1      MET  57  81.113   3.365   8.335
  447    HE2  MET  57           HE2      MET  57  82.440   4.057   9.265
  448    HE3  MET  57           HE3      MET  57  82.744   3.412   7.654
  449    H    GLU  58           HN       GLU  58  79.217   7.605   2.903
  450    HA   GLU  58           HA       GLU  58  76.748   5.992   3.236
  451    HB2  GLU  58           HB2      GLU  58  77.561   8.332   4.913
  452    HB3  GLU  58           HB1      GLU  58  75.867   8.227   4.433
  453    HG2  GLU  58           HG2      GLU  58  77.362   5.915   5.690
  454    HG3  GLU  58           HG1      GLU  58  76.443   7.088   6.634
  455    H    GLY  59           HN       GLY  59  74.826   7.739   2.698
  456    HA2  GLY  59           HA2      GLY  59  73.969   9.310   1.139
  457    HA3  GLY  59           HA1      GLY  59  75.621   9.653   0.622
  458    H1U  RCY  60           H1U      RCY  60  75.943  12.793  -3.307
  459    H1S  RCY  60           H1S      RCY  60  77.224   8.949  -4.647
  460    HB1  RCY  60           HB1      RCY  60  75.415   5.782  -2.699
  461    HB2  RCY  60           HB2      RCY  60  76.447   7.145  -2.272
  462    HA   RCY  60           HA       RCY  60  74.282   8.321  -3.593
  463    HN1  RCY  60           HN1      RCY  60  74.629   9.505  -1.596
  464    H    GLY  61           HN       GLY  61  72.749   7.643  -0.806
  465    HA2  GLY  61           HA2      GLY  61  71.493   5.104  -1.482
  466    HA3  GLY  61           HA1      GLY  61  71.008   6.181  -0.173
  467    H    THR  62           HN       THR  62  71.004   8.367  -2.436
  468    HA   THR  62           HA       THR  62  68.303   8.739  -2.767
  469    HB   THR  62           HB       THR  62  70.212  10.183  -3.684
  470    HG1  THR  62           HG1      THR  62  68.810  10.748  -5.574
  471   HG21  THR  62          HG21      THR  62  70.982   9.770  -5.911
  472   HG22  THR  62          HG22      THR  62  69.797   8.487  -6.153
  473   HG23  THR  62          HG23      THR  62  71.146   8.243  -5.045
  474    H    ASP  63           HN       ASP  63  70.265   6.335  -4.409
  475    HA   ASP  63           HA       ASP  63  68.484   5.632  -6.506
  476    HB2  ASP  63           HB2      ASP  63  69.574   3.365  -6.353
  477    HB3  ASP  63           HB1      ASP  63  70.722   4.701  -6.445
  478    H    ILE  64           HN       ILE  64  67.914   5.575  -3.217
  479    HA   ILE  64           HA       ILE  64  65.396   4.207  -3.523
  480    HB   ILE  64           HB       ILE  64  67.045   2.282  -3.469
  481   HG12  ILE  64          HG12      ILE  64  65.753   1.128  -1.536
  482   HG13  ILE  64          HG11      ILE  64  64.874   2.652  -1.406
  483   HG21  ILE  64          HG21      ILE  64  68.268   3.711  -1.504
  484   HG22  ILE  64          HG22      ILE  64  68.455   1.968  -1.698
  485   HG23  ILE  64          HG23      ILE  64  67.295   2.606  -0.533
  486   HD11  ILE  64          HD11      ILE  64  65.182   1.292  -4.075
  487   HD12  ILE  64          HD12      ILE  64  63.959   2.455  -3.562
  488   HD13  ILE  64          HD13      ILE  64  63.909   0.798  -2.960
  489    H    THR  65           HN       THR  65  67.894   5.557  -1.495
  490    HA   THR  65           HA       THR  65  67.569   7.186   0.207
  491    HB   THR  65           HB       THR  65  64.777   6.203   0.725
  492    HG1  THR  65           HG1      THR  65  64.327   6.682  -1.262
  493   HG21  THR  65          HG21      THR  65  64.442   8.539   1.355
  494   HG22  THR  65          HG22      THR  65  66.060   8.948   0.785
  495   HG23  THR  65          HG23      THR  65  65.858   7.901   2.189
  496    H    VAL  66           HN       VAL  66  66.711   3.814   0.394
  497    HA   VAL  66           HA       VAL  66  67.925   3.752   3.102
  498    HB   VAL  66           HB       VAL  66  66.102   2.250   3.924
  499   HG11  VAL  66          HG11      VAL  66  65.025   4.916   2.975
  500   HG12  VAL  66          HG12      VAL  66  66.181   4.767   4.299
  501   HG13  VAL  66          HG13      VAL  66  64.583   4.035   4.437
  502   HG21  VAL  66          HG21      VAL  66  63.923   2.782   2.404
  503   HG22  VAL  66          HG22      VAL  66  64.919   1.344   2.181
  504   HG23  VAL  66          HG23      VAL  66  65.163   2.754   1.150
  505    H    ILE  67           HN       ILE  67  66.193   1.284   1.141
  506    HA   ILE  67           HA       ILE  67  68.788  -0.187   0.920
  507    HB   ILE  67           HB       ILE  67  66.114  -1.288   1.835
  508   HG12  ILE  67          HG12      ILE  67  68.412  -1.998   3.422
  509   HG13  ILE  67          HG11      ILE  67  68.368  -0.247   3.213
  510   HG21  ILE  67          HG21      ILE  67  67.042  -2.918   0.340
  511   HG22  ILE  67          HG22      ILE  67  67.434  -3.462   1.971
  512   HG23  ILE  67          HG23      ILE  67  68.666  -2.676   0.983
  513   HD11  ILE  67          HD11      ILE  67  66.048  -1.954   4.165
  514   HD12  ILE  67          HD12      ILE  67  66.032  -0.200   3.982
  515   HD13  ILE  67          HD13      ILE  67  67.066  -0.950   5.198
  516    H1U  RCY  68           H1U      RCY  68  69.573  -1.846   2.289
  517    H1S  RCY  68           H1S      RCY  68  68.943  -1.947  -2.184
  518    HB1  RCY  68           HB1      RCY  68  69.216   0.969  -3.534
  519    HB2  RCY  68           HB2      RCY  68  68.553   0.044  -4.878
  520    HA   RCY  68           HA       RCY  68  66.866  -0.033  -3.196
  521    HN1  RCY  68           HN1      RCY  68  69.015   0.132  -1.308
  522    HA   PRO  69           HA       PRO  69  66.069  -4.360  -3.519
  523    HB2  PRO  69           HB2      PRO  69  65.979  -4.612  -6.320
  524    HB3  PRO  69           HB1      PRO  69  64.620  -4.169  -5.272
  525    HG2  PRO  69           HG2      PRO  69  66.382  -2.442  -6.910
  526    HG3  PRO  69           HG1      PRO  69  64.667  -2.258  -6.508
  527    HD2  PRO  69           HD2      PRO  69  66.591  -0.754  -5.318
  528    HD3  PRO  69           HD1      PRO  69  65.115  -1.249  -4.457
  529    H    TRP  70           HN       TRP  70  68.876  -2.940  -4.851
  530    HA   TRP  70           HA       TRP  70  70.067  -5.424  -5.839
  531    HD1  TRP  70           HD1      TRP  70  73.179  -5.587  -5.610
  532    HE1  TRP  70           HE1      TRP  70  74.219  -6.334  -7.846
  533    HE3  TRP  70           HE3      TRP  70  70.569  -2.608  -8.832
  534    HZ2  TRP  70           HZ2      TRP  70  73.975  -5.744 -10.639
  535    HZ3  TRP  70           HZ3      TRP  70  70.991  -2.720 -11.269
  536    HH2  TRP  70           HH2      TRP  70  72.687  -4.281 -12.177
  537    HB2  TRP  70           HB2      TRP  70  70.578  -2.811  -6.362
  538    HB3  TRP  70           HB1      TRP  70  71.804  -3.104  -5.132
  539    H    GLU  71           HN       GLU  71  69.732  -3.815  -2.812
  540    HA   GLU  71           HA       GLU  71  72.029  -5.181  -1.570
  541    HB2  GLU  71           HB2      GLU  71  70.049  -3.109  -0.781
  542    HB3  GLU  71           HB1      GLU  71  70.641  -4.138   0.524
  543    HG2  GLU  71           HG2      GLU  71  72.890  -3.492   0.169
  544    HG3  GLU  71           HG1      GLU  71  72.539  -2.842  -1.433
  545    H    ALA  72           HN       ALA  72  68.706  -5.815  -2.181
  546    HA   ALA  72           HA       ALA  72  68.024  -7.428   0.054
  547    HB1  ALA  72           HB1      ALA  72  66.307  -8.380  -1.341
  548    HB2  ALA  72           HB2      ALA  72  67.184  -7.951  -2.809
  549    HB3  ALA  72           HB3      ALA  72  66.471  -6.687  -1.806
  550    H1U  RCY  73           H1U      RCY  73  74.791  -6.500  -2.534
  551    H1S  RCY  73           H1S      RCY  73  72.984 -10.112  -0.562
  552    HB1  RCY  73           HB1      RCY  73  70.879 -12.217   1.191
  553    HB2  RCY  73           HB2      RCY  73  69.993 -10.874   1.906
  554    HA   RCY  73           HA       RCY  73  71.143 -10.534  -0.842
  555    HN1  RCY  73           HN1      RCY  73  69.279  -9.081   0.782
  556    H    ASN  74           HN       ASN  74  69.346 -10.880  -2.592
  557    HA   ASN  74           HA       ASN  74  68.478 -13.678  -2.361
  558    HB2  ASN  74           HB2      ASN  74  66.381 -11.596  -3.000
  559    HB3  ASN  74           HB1      ASN  74  66.145 -13.307  -2.644
  560   HD21  ASN  74          HD21      ASN  74  65.905 -13.908  -0.448
  561   HD22  ASN  74          HD22      ASN  74  66.044 -12.821   0.848
  562    H    HIS  75           HN       HIS  75  69.794 -11.249  -4.115
  563    HA   HIS  75           HA       HIS  75  69.482 -12.736  -6.621
  564    HD1  HIS  75           HD1      HIS  75  67.902 -13.373  -7.991
  565    HD2  HIS  75           HD2      HIS  75  65.549 -10.513  -6.072
  566    HE1  HIS  75           HE1      HIS  75  65.539 -14.287  -7.971
  567    HE2  HIS  75           HE2      HIS  75  64.097 -12.555  -6.805
  568    HB2  HIS  75           HB2      HIS  75  68.259 -10.005  -6.216
  569    HB3  HIS  75           HB1      HIS  75  68.772 -10.545  -7.814
  570    H1U  RCY  76           H1U      RCY  76  76.347  -7.420  -0.411
  571    H1S  RCY  76           H1S      RCY  76  75.252  -9.824  -3.530
  572    HB1  RCY  76           HB1      RCY  76  74.312 -11.483  -4.720
  573    HB2  RCY  76           HB2      RCY  76  73.022 -10.282  -4.775
  574    HA   RCY  76           HA       RCY  76  73.248 -10.615  -7.389
  575    HN1  RCY  76           HN1      RCY  76  71.824 -12.849  -6.120
  576    H    GLU  77           HN       GLU  77  75.835 -11.447  -6.600
  577    HA   GLU  77           HA       GLU  77  76.171 -13.752  -8.325
  578    HB2  GLU  77           HB2      GLU  77  77.870 -11.939  -8.131
  579    HB3  GLU  77           HB1      GLU  77  78.190 -12.450  -6.472
  580    HG2  GLU  77           HG2      GLU  77  78.900 -14.651  -7.241
  581    HG3  GLU  77           HG1      GLU  77  78.472 -14.241  -8.902
  582    H    LEU  78           HN       LEU  78  77.712 -13.536  -5.143
  583    HA   LEU  78           HA       LEU  78  76.345 -16.057  -4.326
  584    HG   LEU  78           HG       LEU  78  77.604 -16.936  -6.188
  585    HB2  LEU  78           HB2      LEU  78  79.297 -15.581  -4.654
  586    HB3  LEU  78           HB1      LEU  78  78.732 -16.709  -3.424
  587   HD11  LEU  78          HD11      LEU  78  80.005 -16.773  -6.601
  588   HD12  LEU  78          HD12      LEU  78  79.496 -18.451  -6.787
  589   HD13  LEU  78          HD13      LEU  78  80.331 -17.941  -5.320
  590   HD21  LEU  78          HD21      LEU  78  78.474 -19.081  -4.241
  591   HD22  LEU  78          HD22      LEU  78  77.312 -19.217  -5.561
  592   HD23  LEU  78          HD23      LEU  78  76.903 -18.290  -4.117
  593    H    HIS  79           HN       HIS  79  78.060 -16.299  -1.959
  594    HA   HIS  79           HA       HIS  79  78.027 -15.545   0.261
  595    HD1  HIS  79           HD1      HIS  79  79.903 -16.009  -0.519
  596    HD2  HIS  79           HD2      HIS  79  80.962 -12.152   0.667
  597    HE1  HIS  79           HE1      HIS  79  82.323 -16.127   0.220
  598    HE2  HIS  79           HE2      HIS  79  82.980 -13.786   0.945
  599    HB2  HIS  79           HB2      HIS  79  78.521 -13.091  -1.385
  600    HB3  HIS  79           HB1      HIS  79  78.143 -12.870   0.322
  601    H    GLU  80           HN       GLU  80  75.455 -15.725  -1.404
  602    HA   GLU  80           HA       GLU  80  73.762 -13.785   0.091
  603    HB2  GLU  80           HB2      GLU  80  73.261 -15.589  -2.284
  604    HB3  GLU  80           HB1      GLU  80  71.946 -14.779  -1.430
  605    HG2  GLU  80           HG2      GLU  80  73.127 -12.597  -1.803
  606    HG3  GLU  80           HG1      GLU  80  74.306 -13.456  -2.796
  607    H    LEU  81           HN       LEU  81  74.989 -16.831   0.511
  608    HA   LEU  81           HA       LEU  81  72.538 -17.968   1.741
  609    HG   LEU  81           HG       LEU  81  73.703 -21.284   1.238
  610    HB2  LEU  81           HB2      LEU  81  74.655 -19.131   0.393
  611    HB3  LEU  81           HB1      LEU  81  75.076 -19.445   2.072
  612   HD11  LEU  81          HD11      LEU  81  73.333 -20.106   3.580
  613   HD12  LEU  81          HD12      LEU  81  72.244 -21.386   3.045
  614   HD13  LEU  81          HD13      LEU  81  71.764 -19.696   2.885
  615   HD21  LEU  81          HD21      LEU  81  71.296 -19.584   0.882
  616   HD22  LEU  81          HD22      LEU  81  71.813 -21.007  -0.024
  617   HD23  LEU  81          HD23      LEU  81  72.529 -19.433  -0.370
  618    H    ALA  82           HN       ALA  82  75.569 -16.467   2.602
  619    HA   ALA  82           HA       ALA  82  75.771 -17.251   5.326
  620    HB1  ALA  82           HB1      ALA  82  76.655 -14.842   3.764
  621    HB2  ALA  82           HB2      ALA  82  77.636 -16.092   4.526
  622    HB3  ALA  82           HB3      ALA  82  76.846 -14.866   5.518
  623    H    GLN  83           HN       GLN  83  73.150 -15.870   3.932
  624    HA   GLN  83           HA       GLN  83  71.380 -14.526   4.708
  625    HB2  GLN  83           HB2      GLN  83  71.071 -16.463   6.179
  626    HB3  GLN  83           HB1      GLN  83  72.293 -15.843   7.289
  627    HG2  GLN  83           HG2      GLN  83  69.907 -15.380   7.992
  628    HG3  GLN  83           HG1      GLN  83  70.923 -13.944   7.859
  629   HE21  GLN  83          HE21      GLN  83  70.517 -12.471   6.067
  630   HE22  GLN  83          HE22      GLN  83  69.110 -12.582   5.125
  631    H    TYR  84           HN       TYR  84  73.189 -14.306   7.724
  632    HA   TYR  84           HA       TYR  84  72.926 -11.535   8.047
  633    HD1  TYR  84           HD2      TYR  84  72.595 -11.125  10.442
  634    HD2  TYR  84           HD1      TYR  84  76.808 -11.301   9.625
  635    HE1  TYR  84           HE2      TYR  84  72.944  -9.082  11.803
  636    HE2  TYR  84           HE1      TYR  84  77.157  -9.258  10.987
  637    HH   TYR  84           HH       TYR  84  75.260  -8.156  13.166
  638    HB2  TYR  84           HB2      TYR  84  73.880 -13.301   9.676
  639    HB3  TYR  84           HB1      TYR  84  75.422 -13.027   8.871
  640    H    GLY  85           HN       GLY  85  75.054 -13.379   6.011
  641    HA2  GLY  85           HA2      GLY  85  76.874 -12.722   4.648
  642    HA3  GLY  85           HA1      GLY  85  75.688 -11.529   4.118
  643    H    ILE  86           HN       ILE  86  78.443 -12.079   6.253
  644    HA   ILE  86           HA       ILE  86  78.611  -9.762   7.730
  645    HB   ILE  86           HB       ILE  86  80.412 -11.437   7.743
  646   HG12  ILE  86          HG12      ILE  86  82.383  -9.720   7.362
  647   HG13  ILE  86          HG11      ILE  86  81.066  -8.564   7.157
  648   HG21  ILE  86          HG21      ILE  86  81.633 -10.339   5.259
  649   HG22  ILE  86          HG22      ILE  86  80.251 -11.415   5.053
  650   HG23  ILE  86          HG23      ILE  86  81.686 -11.978   5.910
  651   HD11  ILE  86          HD11      ILE  86  80.162  -9.144   9.348
  652   HD12  ILE  86          HD12      ILE  86  81.860  -8.701   9.520
  653   HD13  ILE  86          HD13      ILE  86  81.384 -10.399   9.550
  654    H1U  RCY  87           H1U      RCY  87  84.391  -8.426  -1.485
  655    H1S  RCY  87           H1S      RCY  87  84.236  -7.942   2.509
  656    HB1  RCY  87           HB1      RCY  87  81.183  -6.954   2.380
  657    HB2  RCY  87           HB2      RCY  87  80.914  -8.679   2.167
  658    HA   RCY  87           HA       RCY  87  79.801  -6.883   4.327
  659    HN1  RCY  87           HN1      RCY  87  80.252  -9.784   4.527
  Start of MODEL   84
    1    HA   MET   1           HA       MET   1  68.227 -15.344  -9.078
    2    HB2  MET   1           HB2      MET   1  70.961 -14.051  -8.871
    3    HB3  MET   1           HB1      MET   1  70.508 -15.517  -8.002
    4    HG2  MET   1           HG2      MET   1  70.189 -16.739 -10.021
    5    HG3  MET   1           HG1      MET   1  70.210 -15.273 -11.000
    6    HE1  MET   1           HE1      MET   1  72.281 -17.424  -8.473
    7    HE2  MET   1           HE2      MET   1  73.633 -17.823  -9.530
    8    HE3  MET   1           HE3      MET   1  71.993 -18.252 -10.008
    9    H    ASN   2           HN       ASN   2  66.817 -14.895  -7.431
   10    HA   ASN   2           HA       ASN   2  67.856 -13.404  -5.108
   11    HB2  ASN   2           HB2      ASN   2  65.131 -12.513  -5.659
   12    HB3  ASN   2           HB1      ASN   2  66.568 -11.550  -5.322
   13   HD21  ASN   2          HD21      ASN   2  64.351 -12.388  -7.778
   14   HD22  ASN   2          HD22      ASN   2  65.239 -11.813  -9.105
   15    H    LEU   3           HN       LEU   3  66.805 -16.161  -6.017
   16    HA   LEU   3           HA       LEU   3  64.505 -16.488  -4.174
   17    HG   LEU   3           HG       LEU   3  62.998 -17.284  -5.780
   18    HB2  LEU   3           HB2      LEU   3  65.838 -18.256  -6.224
   19    HB3  LEU   3           HB1      LEU   3  64.711 -18.925  -5.043
   20   HD11  LEU   3          HD11      LEU   3  65.229 -16.489  -7.651
   21   HD12  LEU   3          HD12      LEU   3  64.261 -15.456  -6.600
   22   HD13  LEU   3          HD13      LEU   3  63.541 -16.166  -8.045
   23   HD21  LEU   3          HD21      LEU   3  62.486 -18.368  -7.897
   24   HD22  LEU   3          HD22      LEU   3  63.193 -19.566  -6.814
   25   HD23  LEU   3          HD23      LEU   3  64.169 -18.853  -8.098
   26    H    GLU   4           HN       GLU   4  67.360 -15.940  -3.289
   27    HA   GLU   4           HA       GLU   4  68.190 -18.440  -2.006
   28    HB2  GLU   4           HB2      GLU   4  69.220 -15.671  -1.371
   29    HB3  GLU   4           HB1      GLU   4  70.057 -17.212  -1.188
   30    HG2  GLU   4           HG2      GLU   4  70.980 -16.342  -3.170
   31    HG3  GLU   4           HG1      GLU   4  69.731 -17.439  -3.760
   32    HA   PRO   5           HA       PRO   5  65.129 -18.007   1.307
   33    HB2  PRO   5           HB2      PRO   5  67.336 -19.513   2.680
   34    HB3  PRO   5           HB1      PRO   5  65.584 -19.796   2.727
   35    HG2  PRO   5           HG2      PRO   5  67.195 -21.272   1.199
   36    HG3  PRO   5           HG1      PRO   5  65.565 -20.825   0.668
   37    HD2  PRO   5           HD2      PRO   5  68.184 -19.849  -0.323
   38    HD3  PRO   5           HD1      PRO   5  66.604 -19.860  -1.136
   39    HA   PRO   6           HA       PRO   6  67.592 -14.675   3.263
   40    HB2  PRO   6           HB2      PRO   6  65.708 -12.753   3.207
   41    HB3  PRO   6           HB1      PRO   6  66.592 -13.221   1.741
   42    HG2  PRO   6           HG2      PRO   6  63.827 -13.900   2.569
   43    HG3  PRO   6           HG1      PRO   6  64.483 -13.597   0.953
   44    HD2  PRO   6           HD2      PRO   6  64.008 -16.133   2.094
   45    HD3  PRO   6           HD1      PRO   6  64.972 -15.807   0.637
   46    H    LYS   7           HN       LYS   7  67.760 -14.496   5.477
   47    HA   LYS   7           HA       LYS   7  65.632 -15.538   7.181
   48    HB2  LYS   7           HB2      LYS   7  67.178 -14.834   9.041
   49    HB3  LYS   7           HB1      LYS   7  67.920 -15.924   7.871
   50    HG2  LYS   7           HG2      LYS   7  68.182 -13.095   7.131
   51    HG3  LYS   7           HG1      LYS   7  68.967 -13.485   8.662
   52    HD2  LYS   7           HD2      LYS   7  70.119 -15.394   7.540
   53    HD3  LYS   7           HD1      LYS   7  69.407 -14.885   6.008
   54    HE2  LYS   7           HE2      LYS   7  70.473 -12.598   6.441
   55    HE3  LYS   7           HE1      LYS   7  71.394 -13.384   7.723
   56    HZ1  LYS   7           HZ1      LYS   7  71.339 -14.308   4.903
   57    HZ2  LYS   7           HZ2      LYS   7  72.331 -14.893   6.152
   58    HZ3  LYS   7           HZ3      LYS   7  72.552 -13.318   5.555
   59    H    ALA   8           HN       ALA   8  65.425 -12.937   5.498
   60    HA   ALA   8           HA       ALA   8  65.223 -10.713   7.256
   61    HB1  ALA   8           HB1      ALA   8  63.642  -9.796   5.530
   62    HB2  ALA   8           HB2      ALA   8  63.694 -11.362   4.720
   63    HB3  ALA   8           HB3      ALA   8  65.159 -10.389   4.854
   64    H    GLU   9           HN       GLU   9  64.263 -11.774   9.174
   65    HA   GLU   9           HA       GLU   9  61.351 -12.364   8.939
   66    HB2  GLU   9           HB2      GLU   9  62.865 -13.967  10.158
   67    HB3  GLU   9           HB1      GLU   9  63.174 -12.696  11.342
   68    HG2  GLU   9           HG2      GLU   9  60.894 -12.649  12.038
   69    HG3  GLU   9           HG1      GLU   9  60.375 -13.605  10.649
   70    H1U  RCY  10           H1U      RCY  10  62.437 -10.354   7.386
   71    H1S  RCY  10           H1S      RCY  10  65.206 -10.721  11.324
   72    HB1  RCY  10           HB1      RCY  10  62.067  -9.286  13.842
   73    HB2  RCY  10           HB2      RCY  10  63.177  -7.963  13.494
   74    HA   RCY  10           HA       RCY  10  61.262  -8.730  11.759
   75    HN1  RCY  10           HN1      RCY  10  63.504 -10.610  11.200
   76    H    ARG  11           HN       ARG  11  63.102  -8.804   9.325
   77    HA   ARG  11           HA       ARG  11  65.024  -6.827   9.206
   78    HE   ARG  11           HE       ARG  11  65.574  -4.946   8.670
   79    HB2  ARG  11           HB2      ARG  11  63.919  -8.270   7.314
   80    HB3  ARG  11           HB1      ARG  11  62.867  -6.872   7.102
   81    HG2  ARG  11           HG2      ARG  11  65.895  -6.716   7.100
   82    HG3  ARG  11           HG1      ARG  11  64.916  -6.828   5.637
   83    HD2  ARG  11           HD2      ARG  11  65.074  -4.531   5.795
   84    HD3  ARG  11           HD1      ARG  11  63.638  -4.783   6.788
   85   HH11  ARG  11          HH21      ARG  11  65.106  -2.813   6.002
   86   HH12  ARG  11          HH22      ARG  11  65.888  -1.470   6.766
   87   HH21  ARG  11          HH11      ARG  11  66.598  -3.204   9.684
   88   HH22  ARG  11          HH12      ARG  11  66.733  -1.692   8.851
   89    H    SER  12           HN       SER  12  61.556  -6.151   8.573
   90    HA   SER  12           HA       SER  12  61.783  -3.638  10.100
   91    HG   SER  12           HG       SER  12  63.205  -3.057   7.128
   92    HB2  SER  12           HB2      SER  12  61.242  -3.733   7.125
   93    HB3  SER  12           HB1      SER  12  60.802  -2.355   8.130
   94    H    ALA  13           HN       ALA  13  60.131  -4.350  11.467
   95    HA   ALA  13           HA       ALA  13  57.601  -5.324  10.285
   96    HB1  ALA  13           HB1      ALA  13  58.671  -6.293  12.402
   97    HB2  ALA  13           HB2      ALA  13  56.959  -5.886  12.514
   98    HB3  ALA  13           HB3      ALA  13  58.169  -4.809  13.212
   99    H    THR  14           HN       THR  14  58.828  -2.386  10.427
  100    HA   THR  14           HA       THR  14  56.268  -1.059  10.420
  101    HB   THR  14           HB       THR  14  56.571  -1.379  12.881
  102    HG1  THR  14           HG1      THR  14  55.504   0.472  12.028
  103   HG21  THR  14          HG21      THR  14  58.389  -0.372  14.045
  104   HG22  THR  14          HG22      THR  14  58.909   0.516  12.613
  105   HG23  THR  14          HG23      THR  14  59.117  -1.233  12.690
  106    H    ARG  15           HN       ARG  15  59.402  -1.307   9.551
  107    HA   ARG  15           HA       ARG  15  60.927   0.127   8.484
  108    HE   ARG  15           HE       ARG  15  60.621  -2.307   5.353
  109    HB2  ARG  15           HB2      ARG  15  58.358   1.637   7.908
  110    HB3  ARG  15           HB1      ARG  15  59.889   1.867   7.063
  111    HG2  ARG  15           HG2      ARG  15  58.747  -0.899   7.223
  112    HG3  ARG  15           HG1      ARG  15  58.041   0.240   6.076
  113    HD2  ARG  15           HD2      ARG  15  60.064   0.489   4.891
  114    HD3  ARG  15           HD1      ARG  15  61.025  -0.159   6.220
  115   HH11  ARG  15          HH21      ARG  15  58.254  -0.035   4.295
  116   HH12  ARG  15          HH22      ARG  15  57.452  -1.157   3.248
  117   HH21  ARG  15          HH11      ARG  15  59.587  -3.786   3.991
  118   HH22  ARG  15          HH12      ARG  15  58.206  -3.281   3.076
  119    H    VAL  16           HN       VAL  16  61.567   2.593   8.373
  120    HA   VAL  16           HA       VAL  16  61.457   3.583  11.173
  121    HB   VAL  16           HB       VAL  16  63.314   5.100  10.369
  122   HG11  VAL  16          HG11      VAL  16  63.680   2.871  11.482
  123   HG12  VAL  16          HG12      VAL  16  64.985   3.346  10.395
  124   HG13  VAL  16          HG13      VAL  16  63.799   2.148   9.877
  125   HG21  VAL  16          HG21      VAL  16  64.278   4.749   8.207
  126   HG22  VAL  16          HG22      VAL  16  62.542   4.904   7.937
  127   HG23  VAL  16          HG23      VAL  16  63.297   3.310   7.928
  128    H    MET  17           HN       MET  17  62.010   6.299  10.644
  129    HA   MET  17           HA       MET  17  60.091   7.438   8.802
  130    HB2  MET  17           HB2      MET  17  58.641   6.499  10.695
  131    HB3  MET  17           HB1      MET  17  59.381   7.721  11.729
  132    HG2  MET  17           HG2      MET  17  57.389   8.735  10.920
  133    HG3  MET  17           HG1      MET  17  58.681   9.426   9.938
  134    HE1  MET  17           HE1      MET  17  55.340   8.896   7.824
  135    HE2  MET  17           HE2      MET  17  56.607  10.093   8.080
  136    HE3  MET  17           HE3      MET  17  55.708   9.462   9.458
  137    H    GLY  18           HN       GLY  18  62.536   8.212   8.730
  138    HA2  GLY  18           HA2      GLY  18  63.818  10.195   8.819
  139    HA3  GLY  18           HA1      GLY  18  62.550  10.923   9.807
  140    H    GLY  19           HN       GLY  19  62.382   9.677  12.063
  141    HA2  GLY  19           HA2      GLY  19  63.484   8.875  14.011
  142    HA3  GLY  19           HA1      GLY  19  64.993   8.811  13.100
  143    HA   PRO  20           HA       PRO  20  64.832  12.525  16.069
  144    HB2  PRO  20           HB2      PRO  20  67.465  11.394  16.856
  145    HB3  PRO  20           HB1      PRO  20  66.137  11.974  17.877
  146    HG2  PRO  20           HG2      PRO  20  66.695   9.372  17.611
  147    HG3  PRO  20           HG1      PRO  20  65.039   9.966  17.822
  148    HD2  PRO  20           HD2      PRO  20  66.381   8.972  15.336
  149    HD3  PRO  20           HD1      PRO  20  64.684   8.813  15.844
  150    H1U  RCY  21           H1U      RCY  21  67.326   7.221   9.541
  151    H1S  RCY  21           H1S      RCY  21  68.098   8.942  13.133
  152    HB1  RCY  21           HB1      RCY  21  69.868  13.041  12.911
  153    HB2  RCY  21           HB2      RCY  21  69.173  12.106  11.592
  154    HA   RCY  21           HA       RCY  21  67.926  14.138  13.230
  155    HN1  RCY  21           HN1      RCY  21  66.315  11.630  13.299
  156    H    THR  22           HN       THR  22  67.764  15.244  11.298
  157    HA   THR  22           HA       THR  22  65.948  14.054   9.239
  158    HB   THR  22           HB       THR  22  66.568  16.947   9.900
  159    HG1  THR  22           HG1      THR  22  64.404  16.932  10.557
  160   HG21  THR  22          HG21      THR  22  66.192  16.843   7.547
  161   HG22  THR  22          HG22      THR  22  64.653  17.333   8.254
  162   HG23  THR  22          HG23      THR  22  64.894  15.665   7.736
  163    HA   PRO  23           HA       PRO  23  69.987  13.766   7.082
  164    HB2  PRO  23           HB2      PRO  23  68.080  12.920   4.936
  165    HB3  PRO  23           HB1      PRO  23  69.600  12.166   5.456
  166    HG2  PRO  23           HG2      PRO  23  67.229  11.150   6.134
  167    HG3  PRO  23           HG1      PRO  23  68.615  11.100   7.236
  168    HD2  PRO  23           HD2      PRO  23  66.173  12.807   7.365
  169    HD3  PRO  23           HD1      PRO  23  67.207  12.212   8.683
  170    H    ARG  24           HN       ARG  24  70.481  14.483   4.622
  171    HA   ARG  24           HA       ARG  24  70.043  17.300   4.490
  172    HE   ARG  24           HE       ARG  24  70.032  17.973   1.950
  173    HB2  ARG  24           HB2      ARG  24  71.358  15.241   2.872
  174    HB3  ARG  24           HB1      ARG  24  70.631  16.495   1.872
  175    HG2  ARG  24           HG2      ARG  24  72.539  16.963   4.185
  176    HG3  ARG  24           HG1      ARG  24  72.940  17.106   2.473
  177    HD2  ARG  24           HD2      ARG  24  71.545  18.999   4.222
  178    HD3  ARG  24           HD1      ARG  24  72.348  19.281   2.678
  179   HH11  ARG  24          HH21      ARG  24  70.818  20.689   3.922
  180   HH12  ARG  24          HH22      ARG  24  69.334  21.522   3.600
  181   HH21  ARG  24          HH11      ARG  24  68.089  19.044   1.517
  182   HH22  ARG  24          HH12      ARG  24  67.789  20.590   2.238
  183    H    LYS  25           HN       LYS  25  67.810  14.936   4.114
  184    HA   LYS  25           HA       LYS  25  65.703  14.834   3.092
  185    HB2  LYS  25           HB2      LYS  25  65.590  17.064   4.307
  186    HB3  LYS  25           HB1      LYS  25  66.030  17.829   2.781
  187    HG2  LYS  25           HG2      LYS  25  63.625  17.868   2.923
  188    HG3  LYS  25           HG1      LYS  25  64.055  16.643   1.728
  189    HD2  LYS  25           HD2      LYS  25  63.470  14.880   3.120
  190    HD3  LYS  25           HD1      LYS  25  63.753  15.812   4.591
  191    HE2  LYS  25           HE2      LYS  25  61.740  17.146   4.161
  192    HE3  LYS  25           HE1      LYS  25  61.466  16.274   2.653
  193    HZ1  LYS  25           HZ1      LYS  25  60.975  15.449   5.382
  194    HZ2  LYS  25           HZ2      LYS  25  61.693  14.264   4.400
  195    HZ3  LYS  25           HZ3      LYS  25  60.213  14.963   3.947
  196    H    GLY  26           HN       GLY  26  66.109  13.752   1.162
  197    HA2  GLY  26           HA2      GLY  26  66.536  13.467  -1.133
  198    HA3  GLY  26           HA1      GLY  26  65.685  15.003  -1.304
  199    HA   PRO  27           HA       PRO  27  70.339  16.138  -0.888
  200    HB2  PRO  27           HB2      PRO  27  71.889  13.675  -0.962
  201    HB3  PRO  27           HB1      PRO  27  71.806  14.888   0.326
  202    HG2  PRO  27           HG2      PRO  27  70.814  12.353   0.522
  203    HG3  PRO  27           HG1      PRO  27  70.245  13.730   1.478
  204    HD2  PRO  27           HD2      PRO  27  68.984  12.456  -0.926
  205    HD3  PRO  27           HD1      PRO  27  68.212  13.172   0.509
  206    HA   PRO  28           HA       PRO  28  71.653  16.207  -5.102
  207    HB2  PRO  28           HB2      PRO  28  74.296  15.045  -4.284
  208    HB3  PRO  28           HB1      PRO  28  73.955  16.465  -5.293
  209    HG2  PRO  28           HG2      PRO  28  74.719  16.700  -2.746
  210    HG3  PRO  28           HG1      PRO  28  73.567  17.824  -3.486
  211    HD2  PRO  28           HD2      PRO  28  73.078  15.706  -1.466
  212    HD3  PRO  28           HD1      PRO  28  72.141  17.176  -1.809
  213    H    LYS  29           HN       LYS  29  71.627  14.797  -6.892
  214    HA   LYS  29           HA       LYS  29  71.018  12.015  -6.346
  215    HB2  LYS  29           HB2      LYS  29  71.327  13.672  -8.844
  216    HB3  LYS  29           HB1      LYS  29  71.181  11.918  -8.954
  217    HG2  LYS  29           HG2      LYS  29  69.062  11.983  -7.738
  218    HG3  LYS  29           HG1      LYS  29  69.217  13.726  -7.516
  219    HD2  LYS  29           HD2      LYS  29  67.710  13.215  -9.401
  220    HD3  LYS  29           HD1      LYS  29  69.162  14.042  -9.965
  221    HE2  LYS  29           HE2      LYS  29  70.034  12.131 -10.957
  222    HE3  LYS  29           HE1      LYS  29  69.153  11.046  -9.881
  223    HZ1  LYS  29           HZ1      LYS  29  68.257  11.076 -12.152
  224    HZ2  LYS  29           HZ2      LYS  29  67.900  12.728 -11.982
  225    HZ3  LYS  29           HZ3      LYS  29  67.116  11.582 -11.003
  226    H1U  RCY  30           H1U      RCY  30  79.625  11.552  -1.539
  227    H1S  RCY  30           H1S      RCY  30  78.430  10.484  -5.229
  228    HB1  RCY  30           HB1      RCY  30  75.024   9.855  -7.525
  229    HB2  RCY  30           HB2      RCY  30  74.242   9.768  -5.950
  230    HA   RCY  30           HA       RCY  30  75.821  11.850  -5.435
  231    HN1  RCY  30           HN1      RCY  30  73.663  12.775  -5.433
  232    H    LYS  31           HN       LYS  31  76.511  10.418  -8.193
  233    HA   LYS  31           HA       LYS  31  77.376  11.065 -10.281
  234    HB2  LYS  31           HB2      LYS  31  75.363  12.811 -10.056
  235    HB3  LYS  31           HB1      LYS  31  76.696  13.947  -9.856
  236    HG2  LYS  31           HG2      LYS  31  76.482  13.961 -12.169
  237    HG3  LYS  31           HG1      LYS  31  77.669  12.671 -11.969
  238    HD2  LYS  31           HD2      LYS  31  75.897  10.984 -12.069
  239    HD3  LYS  31           HD1      LYS  31  74.673  12.250 -12.189
  240    HE2  LYS  31           HE2      LYS  31  75.950  13.051 -14.274
  241    HE3  LYS  31           HE1      LYS  31  76.786  11.499 -14.213
  242    HZ1  LYS  31           HZ1      LYS  31  74.520  11.846 -15.516
  243    HZ2  LYS  31           HZ2      LYS  31  73.881  11.442 -13.994
  244    HZ3  LYS  31           HZ3      LYS  31  74.933  10.370 -14.789
  245    H    GLN  32           HN       GLN  32  78.028  12.846  -7.376
  246    HA   GLN  32           HA       GLN  32  79.957  14.020  -6.670
  247    HB2  GLN  32           HB2      GLN  32  81.271  11.760  -8.212
  248    HB3  GLN  32           HB1      GLN  32  82.004  12.708  -6.919
  249    HG2  GLN  32           HG2      GLN  32  81.284  10.849  -5.724
  250    HG3  GLN  32           HG1      GLN  32  79.881  11.905  -5.556
  251   HE21  GLN  32          HE21      GLN  32  81.037   8.920  -6.982
  252   HE22  GLN  32          HE22      GLN  32  79.560   8.453  -7.677
  253    H    ARG  33           HN       ARG  33  82.529  13.949  -8.135
  254    HA   ARG  33           HA       ARG  33  81.876  16.058 -10.111
  255    HE   ARG  33           HE       ARG  33  83.338  18.393 -12.629
  256    HB2  ARG  33           HB2      ARG  33  83.835  15.877  -8.178
  257    HB3  ARG  33           HB1      ARG  33  84.719  15.395  -9.622
  258    HG2  ARG  33           HG2      ARG  33  82.945  17.822  -9.711
  259    HG3  ARG  33           HG1      ARG  33  84.558  17.945  -9.008
  260    HD2  ARG  33           HD2      ARG  33  85.608  17.651 -11.022
  261    HD3  ARG  33           HD1      ARG  33  84.373  16.541 -11.619
  262   HH11  ARG  33          HH21      ARG  33  85.298  19.335  -9.953
  263   HH12  ARG  33          HH22      ARG  33  85.026  21.030 -10.180
  264   HH21  ARG  33          HH11      ARG  33  82.972  20.601 -12.940
  265   HH22  ARG  33          HH12      ARG  33  83.709  21.747 -11.871
  266    H    GLN  34           HN       GLN  34  83.125  12.805  -9.905
  267    HA   GLN  34           HA       GLN  34  83.216  12.715 -12.889
  268    HB2  GLN  34           HB2      GLN  34  85.316  11.676 -10.969
  269    HB3  GLN  34           HB1      GLN  34  85.225  11.188 -12.662
  270    HG2  GLN  34           HG2      GLN  34  85.622  13.415 -13.426
  271    HG3  GLN  34           HG1      GLN  34  85.360  14.089 -11.817
  272   HE21  GLN  34          HE21      GLN  34  87.583  15.040 -11.981
  273   HE22  GLN  34          HE22      GLN  34  88.936  14.055 -11.696
  274    H    THR  35           HN       THR  35  82.740  11.076  -9.822
  275    HA   THR  35           HA       THR  35  81.450   9.181  -9.322
  276    HB   THR  35           HB       THR  35  80.721   8.868 -12.223
  277    HG1  THR  35           HG1      THR  35  79.265  10.526 -12.020
  278   HG21  THR  35          HG21      THR  35  79.917   7.320 -10.391
  279   HG22  THR  35          HG22      THR  35  78.631   8.108 -11.306
  280   HG23  THR  35          HG23      THR  35  79.058   8.697  -9.700
  281    H    ARG  36           HN       ARG  36  83.882   9.217 -11.747
  282    HA   ARG  36           HA       ARG  36  84.139   6.240 -11.615
  283    HE   ARG  36           HE       ARG  36  81.156   5.103 -14.124
  284    HB2  ARG  36           HB2      ARG  36  84.724   8.283 -13.679
  285    HB3  ARG  36           HB1      ARG  36  85.969   7.049 -13.497
  286    HG2  ARG  36           HG2      ARG  36  84.359   6.269 -15.139
  287    HG3  ARG  36           HG1      ARG  36  84.174   5.299 -13.677
  288    HD2  ARG  36           HD2      ARG  36  82.308   6.795 -12.965
  289    HD3  ARG  36           HD1      ARG  36  82.455   7.660 -14.494
  290   HH11  ARG  36          HH21      ARG  36  83.091   7.018 -16.240
  291   HH12  ARG  36          HH22      ARG  36  82.529   6.235 -17.679
  292   HH21  ARG  36          HH11      ARG  36  80.411   4.070 -15.991
  293   HH22  ARG  36          HH12      ARG  36  81.011   4.566 -17.538
  294    H    GLN  37           HN       GLN  37  85.145   8.709  -9.839
  295    HA   GLN  37           HA       GLN  37  88.011   8.468  -9.894
  296    HB2  GLN  37           HB2      GLN  37  88.006   9.724  -7.831
  297    HB3  GLN  37           HB1      GLN  37  86.767  10.399  -8.881
  298    HG2  GLN  37           HG2      GLN  37  86.434   8.704  -6.416
  299    HG3  GLN  37           HG1      GLN  37  85.616  10.207  -6.846
  300   HE21  GLN  37          HE21      GLN  37  84.013  10.053  -8.701
  301   HE22  GLN  37          HE22      GLN  37  83.199   8.584  -8.949
  302    H1U  RCY  38           H1U      RCY  38  84.906   1.435  -3.815
  303    H1S  RCY  38           H1S      RCY  38  86.186   4.617  -6.142
  304    HB1  RCY  38           HB1      RCY  38  86.843   3.065  -7.649
  305    HB2  RCY  38           HB2      RCY  38  86.765   3.312  -9.394
  306    HA   RCY  38           HA       RCY  38  88.288   4.897  -7.330
  307    HN1  RCY  38           HN1      RCY  38  87.892   6.022 -10.051
  308    H    LYS  39           HN       LYS  39  89.041   2.370  -7.878
  309    HA   LYS  39           HA       LYS  39  90.905   2.472 -10.200
  310    HB2  LYS  39           HB2      LYS  39  91.736   1.909  -7.335
  311    HB3  LYS  39           HB1      LYS  39  92.765   1.666  -8.745
  312    HG2  LYS  39           HG2      LYS  39  93.417   3.809  -8.170
  313    HG3  LYS  39           HG1      LYS  39  92.067   4.195  -9.238
  314    HD2  LYS  39           HD2      LYS  39  91.390   5.438  -7.436
  315    HD3  LYS  39           HD1      LYS  39  90.721   3.890  -6.917
  316    HE2  LYS  39           HE2      LYS  39  92.797   3.428  -5.649
  317    HE3  LYS  39           HE1      LYS  39  93.439   4.994  -6.145
  318    HZ1  LYS  39           HZ1      LYS  39  91.635   6.088  -5.021
  319    HZ2  LYS  39           HZ2      LYS  39  92.420   5.046  -3.932
  320    HZ3  LYS  39           HZ3      LYS  39  90.927   4.602  -4.611
  321    H    SER  40           HN       SER  40  92.075   0.068  -8.423
  322    HA   SER  40           HA       SER  40  91.281  -2.073  -9.952
  323    HG   SER  40           HG       SER  40  92.737  -1.587  -6.408
  324    HB2  SER  40           HB2      SER  40  91.605  -3.484  -7.839
  325    HB3  SER  40           HB1      SER  40  92.953  -2.451  -8.303
  326    H    LYS  41           HN       LYS  41  89.689  -3.774  -9.674
  327    HA   LYS  41           HA       LYS  41  87.297  -3.042  -8.060
  328    HB2  LYS  41           HB2      LYS  41  85.942  -3.874 -10.123
  329    HB3  LYS  41           HB1      LYS  41  86.593  -2.236 -10.158
  330    HG2  LYS  41           HG2      LYS  41  88.397  -4.372 -11.164
  331    HG3  LYS  41           HG1      LYS  41  86.986  -4.017 -12.162
  332    HD2  LYS  41           HD2      LYS  41  87.590  -1.632 -12.192
  333    HD3  LYS  41           HD1      LYS  41  88.988  -1.966 -11.170
  334    HE2  LYS  41           HE2      LYS  41  89.917  -3.444 -12.909
  335    HE3  LYS  41           HE1      LYS  41  88.517  -3.126 -13.933
  336    HZ1  LYS  41           HZ1      LYS  41  90.771  -1.395 -13.273
  337    HZ2  LYS  41           HZ2      LYS  41  89.252  -0.653 -13.439
  338    HZ3  LYS  41           HZ3      LYS  41  89.908  -1.546 -14.726
  339    HA   PRO  42           HA       PRO  42  88.019  -7.439  -7.319
  340    HB2  PRO  42           HB2      PRO  42  86.274  -7.750  -5.255
  341    HB3  PRO  42           HB1      PRO  42  87.846  -6.947  -5.065
  342    HG2  PRO  42           HG2      PRO  42  85.138  -5.749  -5.332
  343    HG3  PRO  42           HG1      PRO  42  86.502  -5.245  -4.323
  344    HD2  PRO  42           HD2      PRO  42  85.827  -4.045  -6.725
  345    HD3  PRO  42           HD1      PRO  42  87.453  -4.000  -6.010
  346    HA   PRO  43           HA       PRO  43  84.667  -9.388  -9.474
  347    HB2  PRO  43           HB2      PRO  43  84.775 -11.934  -8.494
  348    HB3  PRO  43           HB1      PRO  43  86.007 -11.271  -9.586
  349    HG2  PRO  43           HG2      PRO  43  86.093 -11.600  -6.629
  350    HG3  PRO  43           HG1      PRO  43  87.362 -11.875  -7.834
  351    HD2  PRO  43           HD2      PRO  43  87.233  -9.611  -6.288
  352    HD3  PRO  43           HD1      PRO  43  87.963  -9.642  -7.908
  353    H    LYS  44           HN       LYS  44  82.450  -9.710  -9.227
  354    HA   LYS  44           HA       LYS  44  81.360  -9.368  -6.509
  355    HB2  LYS  44           HB2      LYS  44  79.603  -9.796  -8.903
  356    HB3  LYS  44           HB1      LYS  44  79.381  -8.712  -7.532
  357    HG2  LYS  44           HG2      LYS  44  81.202  -7.271  -8.372
  358    HG3  LYS  44           HG1      LYS  44  81.422  -8.353  -9.748
  359    HD2  LYS  44           HD2      LYS  44  78.691  -7.239  -9.212
  360    HD3  LYS  44           HD1      LYS  44  79.897  -6.202  -9.974
  361    HE2  LYS  44           HE2      LYS  44  80.107  -7.611 -11.848
  362    HE3  LYS  44           HE1      LYS  44  79.394  -8.988 -11.006
  363    HZ1  LYS  44           HZ1      LYS  44  77.353  -7.402 -10.857
  364    HZ2  LYS  44           HZ2      LYS  44  77.645  -8.289 -12.276
  365    HZ3  LYS  44           HZ3      LYS  44  78.078  -6.648 -12.193
  366    H    LYS  45           HN       LYS  45  80.100 -11.452  -9.100
  367    HA   LYS  45           HA       LYS  45  78.945 -13.516  -8.750
  368    HB2  LYS  45           HB2      LYS  45  80.596 -15.300  -8.690
  369    HB3  LYS  45           HB1      LYS  45  81.201 -13.980  -9.689
  370    HG2  LYS  45           HG2      LYS  45  82.407 -13.118  -7.620
  371    HG3  LYS  45           HG1      LYS  45  81.984 -14.642  -6.838
  372    HD2  LYS  45           HD2      LYS  45  83.662 -14.274  -9.334
  373    HD3  LYS  45           HD1      LYS  45  84.199 -14.892  -7.772
  374    HE2  LYS  45           HE2      LYS  45  83.867 -16.856  -9.020
  375    HE3  LYS  45           HE1      LYS  45  82.358 -16.704  -8.119
  376    HZ1  LYS  45           HZ1      LYS  45  82.321 -15.260 -10.590
  377    HZ2  LYS  45           HZ2      LYS  45  81.210 -16.391  -9.979
  378    HZ3  LYS  45           HZ3      LYS  45  82.588 -16.919 -10.821
  379    H    GLY  46           HN       GLY  46  78.676 -11.962  -6.353
  380    HA2  GLY  46           HA2      GLY  46  79.381 -13.656  -4.081
  381    HA3  GLY  46           HA1      GLY  46  78.370 -12.212  -4.019
  382    H    VAL  47           HN       VAL  47  77.290 -14.028  -2.518
  383    HA   VAL  47           HA       VAL  47  75.679 -15.992  -3.948
  384    HB   VAL  47           HB       VAL  47  75.031 -15.088  -1.159
  385   HG11  VAL  47          HG11      VAL  47  74.564 -17.438  -0.846
  386   HG12  VAL  47          HG12      VAL  47  75.330 -17.844  -2.382
  387   HG13  VAL  47          HG13      VAL  47  73.814 -16.943  -2.364
  388   HG21  VAL  47          HG21      VAL  47  76.894 -16.681  -0.412
  389   HG22  VAL  47          HG22      VAL  47  77.417 -15.113  -1.027
  390   HG23  VAL  47          HG23      VAL  47  77.529 -16.544  -2.051
  391    H    GLN  48           HN       GLN  48  75.377 -12.654  -3.237
  392    HA   GLN  48           HA       GLN  48  72.878 -12.432  -4.650
  393    HB2  GLN  48           HB2      GLN  48  71.874 -13.324  -2.639
  394    HB3  GLN  48           HB1      GLN  48  72.809 -12.227  -1.624
  395    HG2  GLN  48           HG2      GLN  48  71.551 -10.357  -2.253
  396    HG3  GLN  48           HG1      GLN  48  71.000 -11.110  -3.751
  397   HE21  GLN  48          HE21      GLN  48  70.863 -12.066  -0.263
  398   HE22  GLN  48          HE22      GLN  48  69.205 -12.429  -0.282
  399    H    GLY  49           HN       GLY  49  75.708 -11.273  -3.609
  400    HA2  GLY  49           HA2      GLY  49  75.498  -8.653  -2.774
  401    HA3  GLY  49           HA1      GLY  49  76.703  -9.165  -3.954
  402    H1U  RCY  50           H1U      RCY  50  80.746  -5.545  -3.473
  403    H1S  RCY  50           H1S      RCY  50  77.055  -6.600  -4.924
  404    HB1  RCY  50           HB1      RCY  50  74.884  -6.497  -8.603
  405    HB2  RCY  50           HB2      RCY  50  76.238  -7.468  -8.027
  406    HA   RCY  50           HA       RCY  50  73.491  -7.453  -6.745
  407    HN1  RCY  50           HN1      RCY  50  75.520  -9.549  -6.259
  408    H    GLY  51           HN       GLY  51  72.322  -7.819  -8.645
  409    HA2  GLY  51           HA2      GLY  51  72.028 -10.486  -9.532
  410    HA3  GLY  51           HA1      GLY  51  71.413  -9.079 -10.400
  411    H    ASP  52           HN       ASP  52  73.561  -7.755 -11.297
  412    HA   ASP  52           HA       ASP  52  75.721  -9.388 -12.269
  413    HB2  ASP  52           HB2      ASP  52  73.696 -10.273 -13.578
  414    HB3  ASP  52           HB1      ASP  52  73.682  -8.710 -14.394
  415    H    ASP  53           HN       ASP  53  73.854  -6.462 -12.280
  416    HA   ASP  53           HA       ASP  53  76.219  -4.856 -12.728
  417    HB2  ASP  53           HB2      ASP  53  75.817  -5.529 -15.061
  418    HB3  ASP  53           HB1      ASP  53  74.155  -4.950 -14.950
  419    H    ILE  54           HN       ILE  54  72.657  -4.910 -12.922
  420    HA   ILE  54           HA       ILE  54  72.580  -2.173 -11.768
  421    HB   ILE  54           HB       ILE  54  70.017  -2.623 -12.140
  422   HG12  ILE  54          HG12      ILE  54  71.251  -4.626 -14.054
  423   HG13  ILE  54          HG11      ILE  54  70.424  -5.079 -12.564
  424   HG21  ILE  54          HG21      ILE  54  71.337  -1.010 -13.432
  425   HG22  ILE  54          HG22      ILE  54  70.269  -1.910 -14.508
  426   HG23  ILE  54          HG23      ILE  54  71.984  -2.312 -14.429
  427   HD11  ILE  54          HD11      ILE  54  68.394  -3.866 -13.376
  428   HD12  ILE  54          HD12      ILE  54  68.846  -5.219 -14.414
  429   HD13  ILE  54          HD13      ILE  54  69.225  -3.567 -14.902
  430    HA   PRO  55           HA       PRO  55  71.817  -4.469  -7.921
  431    HB2  PRO  55           HB2      PRO  55  72.527  -2.509  -6.199
  432    HB3  PRO  55           HB1      PRO  55  73.734  -3.437  -7.111
  433    HG2  PRO  55           HG2      PRO  55  72.698  -0.696  -7.610
  434    HG3  PRO  55           HG1      PRO  55  74.338  -1.336  -7.798
  435    HD2  PRO  55           HD2      PRO  55  72.530  -0.975  -9.888
  436    HD3  PRO  55           HD1      PRO  55  73.936  -2.060  -9.939
  437    H    GLY  56           HN       GLY  56  71.213  -1.261  -6.741
  438    HA2  GLY  56           HA2      GLY  56  68.449  -1.966  -6.111
  439    HA3  GLY  56           HA1      GLY  56  69.249  -0.448  -5.701
  440    H    MET  57           HN       MET  57  69.288  -1.657  -8.983
  441    HA   MET  57           HA       MET  57  68.509  -0.616 -10.947
  442    HB2  MET  57           HB2      MET  57  66.067  -0.428  -9.157
  443    HB3  MET  57           HB1      MET  57  66.049  -0.144 -10.898
  444    HG2  MET  57           HG2      MET  57  66.546  -2.386 -11.397
  445    HG3  MET  57           HG1      MET  57  67.185  -2.701  -9.784
  446    HE1  MET  57           HE1      MET  57  63.900  -3.186 -11.993
  447    HE2  MET  57           HE2      MET  57  64.372  -1.499 -11.808
  448    HE3  MET  57           HE3      MET  57  62.874  -2.074 -11.079
  449    H    GLU  58           HN       GLU  58  69.659   1.106  -8.673
  450    HA   GLU  58           HA       GLU  58  69.951   3.395  -8.232
  451    HB2  GLU  58           HB2      GLU  58  70.512   3.193 -10.723
  452    HB3  GLU  58           HB1      GLU  58  68.887   3.805 -11.034
  453    HG2  GLU  58           HG2      GLU  58  70.322   5.719 -11.041
  454    HG3  GLU  58           HG1      GLU  58  69.469   5.757  -9.498
  455    H    GLY  59           HN       GLY  59  67.717   2.636  -7.022
  456    HA2  GLY  59           HA2      GLY  59  65.800   4.844  -7.617
  457    HA3  GLY  59           HA1      GLY  59  65.191   3.208  -7.355
  458    H1U  RCY  60           H1U      RCY  60  71.665   8.988   1.210
  459    H1S  RCY  60           H1S      RCY  60  69.868   6.418  -2.512
  460    HB1  RCY  60           HB1      RCY  60  66.609   5.511  -2.716
  461    HB2  RCY  60           HB2      RCY  60  67.822   5.257  -3.966
  462    HA   RCY  60           HA       RCY  60  67.377   2.697  -2.972
  463    HN1  RCY  60           HN1      RCY  60  67.191   2.573  -5.306
  464    H    GLY  61           HN       GLY  61  65.791   1.694  -1.890
  465    HA2  GLY  61           HA2      GLY  61  63.735   2.578  -0.456
  466    HA3  GLY  61           HA1      GLY  61  63.006   2.696  -2.062
  467    H    THR  62           HN       THR  62  65.010   0.289  -2.561
  468    HA   THR  62           HA       THR  62  63.152  -1.822  -1.511
  469    HB   THR  62           HB       THR  62  63.246  -2.969  -3.557
  470    HG1  THR  62           HG1      THR  62  65.441  -2.972  -3.878
  471   HG21  THR  62          HG21      THR  62  63.501  -0.069  -4.398
  472   HG22  THR  62          HG22      THR  62  62.034  -0.777  -3.721
  473   HG23  THR  62          HG23      THR  62  62.660  -1.353  -5.266
  474    H    ASP  63           HN       ASP  63  66.324  -1.860  -3.167
  475    HA   ASP  63           HA       ASP  63  67.320  -3.952  -1.437
  476    HB2  ASP  63           HB2      ASP  63  69.480  -3.537  -2.560
  477    HB3  ASP  63           HB1      ASP  63  68.170  -3.627  -3.738
  478    H    ILE  64           HN       ILE  64  67.779  -0.432  -1.590
  479    HA   ILE  64           HA       ILE  64  69.442  -0.516   0.852
  480    HB   ILE  64           HB       ILE  64  68.848   1.493  -1.271
  481   HG12  ILE  64          HG12      ILE  64  70.981   0.004  -0.823
  482   HG13  ILE  64          HG11      ILE  64  71.175   1.675  -1.353
  483   HG21  ILE  64          HG21      ILE  64  68.121   2.808   0.579
  484   HG22  ILE  64          HG22      ILE  64  69.798   3.281   0.304
  485   HG23  ILE  64          HG23      ILE  64  69.397   2.180   1.622
  486   HD11  ILE  64          HD11      ILE  64  72.572   0.901   0.682
  487   HD12  ILE  64          HD12      ILE  64  71.055   0.971   1.578
  488   HD13  ILE  64          HD13      ILE  64  71.702   2.428   0.825
  489    H    THR  65           HN       THR  65  66.190  -0.133  -0.066
  490    HA   THR  65           HA       THR  65  64.345   0.911   1.059
  491    HB   THR  65           HB       THR  65  64.365  -1.375   1.892
  492    HG1  THR  65           HG1      THR  65  63.389   0.638   3.158
  493   HG21  THR  65          HG21      THR  65  66.660  -1.582   2.601
  494   HG22  THR  65          HG22      THR  65  65.643  -1.878   4.010
  495   HG23  THR  65          HG23      THR  65  66.451  -0.323   3.818
  496    H    VAL  66           HN       VAL  66  66.489   2.682   1.094
  497    HA   VAL  66           HA       VAL  66  67.152   4.638   2.202
  498    HB   VAL  66           HB       VAL  66  65.297   3.884   4.466
  499   HG11  VAL  66          HG11      VAL  66  66.832   5.856   4.675
  500   HG12  VAL  66          HG12      VAL  66  65.125   6.296   4.730
  501   HG13  VAL  66          HG13      VAL  66  66.057   6.559   3.256
  502   HG21  VAL  66          HG21      VAL  66  64.656   4.900   1.701
  503   HG22  VAL  66          HG22      VAL  66  63.634   5.332   3.072
  504   HG23  VAL  66          HG23      VAL  66  63.844   3.638   2.629
  505    H    ILE  67           HN       ILE  67  66.794   1.741   4.199
  506    HA   ILE  67           HA       ILE  67  69.525   2.225   5.282
  507    HB   ILE  67           HB       ILE  67  67.064   1.471   6.892
  508   HG12  ILE  67          HG12      ILE  67  68.667   3.531   8.047
  509   HG13  ILE  67          HG11      ILE  67  68.413   3.940   6.350
  510   HG21  ILE  67          HG21      ILE  67  70.013   1.317   7.525
  511   HG22  ILE  67          HG22      ILE  67  68.783   0.070   7.734
  512   HG23  ILE  67          HG23      ILE  67  68.802   1.476   8.798
  513   HD11  ILE  67          HD11      ILE  67  65.961   3.516   6.678
  514   HD12  ILE  67          HD12      ILE  67  66.574   4.861   7.640
  515   HD13  ILE  67          HD13      ILE  67  66.274   3.298   8.400
  516    H1U  RCY  68           H1U      RCY  68  77.200  -2.355   3.247
  517    H1S  RCY  68           H1S      RCY  68  73.708  -4.156   2.381
  518    HB1  RCY  68           HB1      RCY  68  71.950  -1.095   3.264
  519    HB2  RCY  68           HB2      RCY  68  70.738  -1.363   2.016
  520    HA   RCY  68           HA       RCY  68  69.088  -2.004   3.638
  521    HN1  RCY  68           HN1      RCY  68  70.352   0.556   3.925
  522    HA   PRO  69           HA       PRO  69  69.632  -3.696   7.738
  523    HB2  PRO  69           HB2      PRO  69  70.206  -6.170   6.136
  524    HB3  PRO  69           HB1      PRO  69  69.148  -5.963   7.546
  525    HG2  PRO  69           HG2      PRO  69  68.173  -6.101   5.063
  526    HG3  PRO  69           HG1      PRO  69  67.441  -5.067   6.300
  527    HD2  PRO  69           HD2      PRO  69  69.006  -4.289   3.904
  528    HD3  PRO  69           HD1      PRO  69  67.834  -3.339   4.843
  529    H    TRP  70           HN       TRP  70  72.028  -3.642   5.279
  530    HA   TRP  70           HA       TRP  70  74.133  -4.941   6.836
  531    HD1  TRP  70           HD1      TRP  70  76.786  -5.747   4.303
  532    HE1  TRP  70           HE1      TRP  70  76.152  -8.121   3.526
  533    HE3  TRP  70           HE3      TRP  70  71.696  -5.414   4.520
  534    HZ2  TRP  70           HZ2      TRP  70  73.793  -9.676   3.058
  535    HZ3  TRP  70           HZ3      TRP  70  70.282  -7.350   3.905
  536    HH2  TRP  70           HH2      TRP  70  71.320  -9.479   3.175
  537    HB2  TRP  70           HB2      TRP  70  73.949  -3.503   4.211
  538    HB3  TRP  70           HB1      TRP  70  75.534  -3.649   4.965
  539    H    GLU  71           HN       GLU  71  72.827  -1.728   6.531
  540    HA   GLU  71           HA       GLU  71  75.021  -0.142   7.328
  541    HB2  GLU  71           HB2      GLU  71  72.071   0.150   7.942
  542    HB3  GLU  71           HB1      GLU  71  73.268   1.394   8.300
  543    HG2  GLU  71           HG2      GLU  71  73.045   0.223   5.532
  544    HG3  GLU  71           HG1      GLU  71  71.995   1.546   6.041
  545    H    ALA  72           HN       ALA  72  73.647  -2.681   9.027
  546    HA   ALA  72           HA       ALA  72  73.656  -1.734  11.713
  547    HB1  ALA  72           HB1      ALA  72  72.663  -3.877  11.174
  548    HB2  ALA  72           HB2      ALA  72  73.983  -4.152  12.312
  549    HB3  ALA  72           HB3      ALA  72  74.211  -4.496  10.596
  550    H1U  RCY  73           H1U      RCY  73  78.001  -1.911   4.859
  551    H1S  RCY  73           H1S      RCY  73  76.916  -1.900   8.039
  552    HB1  RCY  73           HB1      RCY  73  79.871  -1.961   9.776
  553    HB2  RCY  73           HB2      RCY  73  78.619  -1.032   8.954
  554    HA   RCY  73           HA       RCY  73  78.296  -2.676  11.479
  555    HN1  RCY  73           HN1      RCY  73  76.231  -1.770   9.616
  556    H    ASN  74           HN       ASN  74  76.635   0.290  10.805
  557    HA   ASN  74           HA       ASN  74  76.790   2.407  11.800
  558    HB2  ASN  74           HB2      ASN  74  76.912   0.943  13.882
  559    HB3  ASN  74           HB1      ASN  74  78.665   1.121  13.799
  560   HD21  ASN  74          HD21      ASN  74  79.583   3.197  14.334
  561   HD22  ASN  74          HD22      ASN  74  78.652   4.460  14.981
  562    H    HIS  75           HN       HIS  75  79.481   0.741  10.591
  563    HA   HIS  75           HA       HIS  75  81.625   2.530  11.085
  564    HD1  HIS  75           HD1      HIS  75  83.038   0.504   7.037
  565    HD2  HIS  75           HD2      HIS  75  83.497   3.562   9.837
  566    HE1  HIS  75           HE1      HIS  75  84.987   1.915   6.243
  567    HE2  HIS  75           HE2      HIS  75  85.277   3.780   7.939
  568    HB2  HIS  75           HB2      HIS  75  82.043   0.391  10.039
  569    HB3  HIS  75           HB1      HIS  75  80.996   0.792   8.679
  570    H1U  RCY  76           H1U      RCY  76  80.645   2.643   4.184
  571    H1S  RCY  76           H1S      RCY  76  77.704   5.136   6.894
  572    HB1  RCY  76           HB1      RCY  76  79.797   7.593   9.165
  573    HB2  RCY  76           HB2      RCY  76  79.867   6.559  10.592
  574    HA   RCY  76           HA       RCY  76  80.791   5.561   7.899
  575    HN1  RCY  76           HN1      RCY  76  81.886   4.632  10.481
  576    H    GLU  77           HN       GLU  77  82.419   6.545  10.929
  577    HA   GLU  77           HA       GLU  77  83.736   8.820   9.800
  578    HB2  GLU  77           HB2      GLU  77  84.311   7.089  12.205
  579    HB3  GLU  77           HB1      GLU  77  85.352   8.445  11.769
  580    HG2  GLU  77           HG2      GLU  77  82.360   8.742  12.088
  581    HG3  GLU  77           HG1      GLU  77  83.480   8.963  13.433
  582    H    LEU  78           HN       LEU  78  86.151   6.904  11.158
  583    HA   LEU  78           HA       LEU  78  87.516   6.722   8.555
  584    HG   LEU  78           HG       LEU  78  88.391   8.543   9.846
  585    HB2  LEU  78           HB2      LEU  78  88.326   6.417  11.428
  586    HB3  LEU  78           HB1      LEU  78  89.353   5.722  10.174
  587   HD11  LEU  78          HD11      LEU  78  90.532   9.234  11.057
  588   HD12  LEU  78          HD12      LEU  78  90.578   7.597  11.712
  589   HD13  LEU  78          HD13      LEU  78  89.220   8.659  12.086
  590   HD21  LEU  78          HD21      LEU  78  90.955   7.068   9.160
  591   HD22  LEU  78          HD22      LEU  78  90.591   8.737   8.721
  592   HD23  LEU  78          HD23      LEU  78  89.638   7.419   8.040
  593    H    HIS  79           HN       HIS  79  89.058   4.493   8.755
  594    HA   HIS  79           HA       HIS  79  87.035   2.320   8.534
  595    HD1  HIS  79           HD1      HIS  79  91.060   2.103   5.675
  596    HD2  HIS  79           HD2      HIS  79  90.491   3.637   9.512
  597    HE1  HIS  79           HE1      HIS  79  93.273   3.116   6.375
  598    HE2  HIS  79           HE2      HIS  79  92.941   4.054   8.709
  599    HB2  HIS  79           HB2      HIS  79  88.875   1.117   7.325
  600    HB3  HIS  79           HB1      HIS  79  88.405   2.632   6.555
  601    H    GLU  80           HN       GLU  80  86.954   2.088  10.913
  602    HA   GLU  80           HA       GLU  80  89.310   0.551  11.948
  603    HB2  GLU  80           HB2      GLU  80  88.077   2.910  13.012
  604    HB3  GLU  80           HB1      GLU  80  87.725   1.579  14.112
  605    HG2  GLU  80           HG2      GLU  80  89.848   2.631  14.735
  606    HG3  GLU  80           HG1      GLU  80  90.142   0.995  14.144
  607    H    LEU  81           HN       LEU  81  85.787   0.926  11.925
  608    HA   LEU  81           HA       LEU  81  85.437  -1.671  13.287
  609    HG   LEU  81           HG       LEU  81  82.973   0.987  14.288
  610    HB2  LEU  81           HB2      LEU  81  83.245  -0.052  11.972
  611    HB3  LEU  81           HB1      LEU  81  83.110  -1.195  13.303
  612   HD11  LEU  81          HD11      LEU  81  85.871   0.160  14.589
  613   HD12  LEU  81          HD12      LEU  81  84.539  -0.704  15.356
  614   HD13  LEU  81          HD13      LEU  81  84.859   0.978  15.779
  615   HD21  LEU  81          HD21      LEU  81  84.062   2.823  13.496
  616   HD22  LEU  81          HD22      LEU  81  84.387   1.820  12.083
  617   HD23  LEU  81          HD23      LEU  81  85.596   1.964  13.358
  618    H    ALA  82           HN       ALA  82  86.629  -1.103  10.469
  619    HA   ALA  82           HA       ALA  82  84.862  -2.301   8.549
  620    HB1  ALA  82           HB1      ALA  82  86.637  -1.080   7.614
  621    HB2  ALA  82           HB2      ALA  82  87.132  -2.752   7.347
  622    HB3  ALA  82           HB3      ALA  82  87.834  -1.826   8.674
  623    H    GLN  83           HN       GLN  83  84.424  -4.000  10.551
  624    HA   GLN  83           HA       GLN  83  86.073  -6.179  11.078
  625    HB2  GLN  83           HB2      GLN  83  83.090  -5.975  10.666
  626    HB3  GLN  83           HB1      GLN  83  83.835  -7.542  10.977
  627    HG2  GLN  83           HG2      GLN  83  84.301  -5.125  12.739
  628    HG3  GLN  83           HG1      GLN  83  83.024  -6.303  13.045
  629   HE21  GLN  83          HE21      GLN  83  85.964  -5.592  14.198
  630   HE22  GLN  83          HE22      GLN  83  86.581  -7.145  14.500
  631    H    TYR  84           HN       TYR  84  83.453  -6.914   8.850
  632    HA   TYR  84           HA       TYR  84  85.214  -8.608   7.265
  633    HD1  TYR  84           HD2      TYR  84  83.771  -9.770   9.111
  634    HD2  TYR  84           HD1      TYR  84  80.584  -7.573   7.250
  635    HE1  TYR  84           HE2      TYR  84  82.386 -10.053  11.149
  636    HE2  TYR  84           HE1      TYR  84  79.198  -7.856   9.288
  637    HH   TYR  84           HH       TYR  84  79.443  -8.317  11.626
  638    HB2  TYR  84           HB2      TYR  84  82.594  -7.839   6.106
  639    HB3  TYR  84           HB1      TYR  84  83.283  -9.444   6.353
  640    H    GLY  85           HN       GLY  85  83.525  -5.514   6.769
  641    HA2  GLY  85           HA2      GLY  85  84.194  -4.944   4.136
  642    HA3  GLY  85           HA1      GLY  85  84.143  -3.706   5.394
  643    H    ILE  86           HN       ILE  86  86.058  -4.114   3.102
  644    HA   ILE  86           HA       ILE  86  88.479  -3.568   4.643
  645    HB   ILE  86           HB       ILE  86  88.527  -6.014   4.661
  646   HG12  ILE  86          HG12      ILE  86  90.706  -6.349   3.605
  647   HG13  ILE  86          HG11      ILE  86  90.466  -4.920   2.598
  648   HG21  ILE  86          HG21      ILE  86  88.337  -7.341   2.714
  649   HG22  ILE  86          HG22      ILE  86  88.621  -5.967   1.646
  650   HG23  ILE  86          HG23      ILE  86  87.090  -6.111   2.509
  651   HD11  ILE  86          HD11      ILE  86  90.283  -4.661   5.583
  652   HD12  ILE  86          HD12      ILE  86  90.735  -3.448   4.386
  653   HD13  ILE  86          HD13      ILE  86  91.870  -4.727   4.817
  654    H1U  RCY  87           H1U      RCY  87  80.660  -3.907  -0.573
  655    H1S  RCY  87           H1S      RCY  87  84.395  -4.675   0.850
  656    HB1  RCY  87           HB1      RCY  87  87.698  -3.335  -1.869
  657    HB2  RCY  87           HB2      RCY  87  86.502  -2.313  -1.075
  658    HA   RCY  87           HA       RCY  87  89.171  -3.134  -0.154
  659    HN1  RCY  87           HN1      RCY  87  87.087  -4.199   1.411
  Start of MODEL   85
    1    HA   MET   1           HA       MET   1  49.715  -2.590   4.698
    2    HB2  MET   1           HB2      MET   1  51.346  -2.256   2.697
    3    HB3  MET   1           HB1      MET   1  51.095  -3.976   2.400
    4    HG2  MET   1           HG2      MET   1  49.440  -2.899   1.085
    5    HG3  MET   1           HG1      MET   1  48.575  -3.451   2.520
    6    HE1  MET   1           HE1      MET   1  47.069  -1.899   1.146
    7    HE2  MET   1           HE2      MET   1  46.784  -0.231   1.637
    8    HE3  MET   1           HE3      MET   1  46.516  -1.539   2.786
    9    H    ASN   2           HN       ASN   2  51.529  -5.543   3.773
   10    HA   ASN   2           HA       ASN   2  50.821  -7.789   3.800
   11    HB2  ASN   2           HB2      ASN   2  49.470  -7.114   6.407
   12    HB3  ASN   2           HB1      ASN   2  50.363  -8.571   5.967
   13   HD21  ASN   2          HD21      ASN   2  52.469  -6.677   4.667
   14   HD22  ASN   2          HD22      ASN   2  53.394  -6.154   5.991
   15    H    LEU   3           HN       LEU   3  48.952  -5.850   2.562
   16    HA   LEU   3           HA       LEU   3  46.464  -7.482   2.870
   17    HG   LEU   3           HG       LEU   3  44.384  -6.576   2.665
   18    HB2  LEU   3           HB2      LEU   3  46.229  -5.279   4.053
   19    HB3  LEU   3           HB1      LEU   3  46.511  -4.467   2.515
   20   HD11  LEU   3          HD11      LEU   3  43.826  -5.214   4.575
   21   HD12  LEU   3          HD12      LEU   3  42.765  -4.721   3.255
   22   HD13  LEU   3          HD13      LEU   3  44.160  -3.730   3.681
   23   HD21  LEU   3          HD21      LEU   3  43.714  -4.178   1.235
   24   HD22  LEU   3          HD22      LEU   3  44.000  -5.793   0.588
   25   HD23  LEU   3          HD23      LEU   3  45.346  -4.669   0.778
   26    H    GLU   4           HN       GLU   4  48.661  -5.685   0.854
   27    HA   GLU   4           HA       GLU   4  46.982  -6.100  -1.543
   28    HB2  GLU   4           HB2      GLU   4  48.592  -4.052  -0.924
   29    HB3  GLU   4           HB1      GLU   4  49.785  -5.071  -1.727
   30    HG2  GLU   4           HG2      GLU   4  48.877  -3.750  -3.472
   31    HG3  GLU   4           HG1      GLU   4  48.046  -5.299  -3.621
   32    HA   PRO   5           HA       PRO   5  48.746 -10.251  -1.993
   33    HB2  PRO   5           HB2      PRO   5  48.041  -9.578  -4.832
   34    HB3  PRO   5           HB1      PRO   5  47.752 -11.078  -3.926
   35    HG2  PRO   5           HG2      PRO   5  45.809  -9.301  -4.334
   36    HG3  PRO   5           HG1      PRO   5  45.932 -10.208  -2.817
   37    HD2  PRO   5           HD2      PRO   5  46.483  -7.333  -3.327
   38    HD3  PRO   5           HD1      PRO   5  46.030  -8.144  -1.812
   39    HA   PRO   6           HA       PRO   6  52.665  -8.479  -3.554
   40    HB2  PRO   6           HB2      PRO   6  54.335  -9.893  -1.958
   41    HB3  PRO   6           HB1      PRO   6  53.426  -8.489  -1.365
   42    HG2  PRO   6           HG2      PRO   6  52.907 -11.382  -0.954
   43    HG3  PRO   6           HG1      PRO   6  52.657 -10.020   0.148
   44    HD2  PRO   6           HD2      PRO   6  50.654 -11.255  -1.369
   45    HD3  PRO   6           HD1      PRO   6  50.532  -9.648  -0.622
   46    H    LYS   7           HN       LYS   7  54.484  -9.426  -4.753
   47    HA   LYS   7           HA       LYS   7  53.749 -11.608  -6.434
   48    HB2  LYS   7           HB2      LYS   7  56.525 -10.522  -5.866
   49    HB3  LYS   7           HB1      LYS   7  56.061 -11.498  -7.261
   50    HG2  LYS   7           HG2      LYS   7  54.343  -9.692  -7.794
   51    HG3  LYS   7           HG1      LYS   7  55.143  -8.697  -6.577
   52    HD2  LYS   7           HD2      LYS   7  56.511  -9.927  -8.989
   53    HD3  LYS   7           HD1      LYS   7  56.012  -8.240  -8.859
   54    HE2  LYS   7           HE2      LYS   7  58.257  -8.135  -8.203
   55    HE3  LYS   7           HE1      LYS   7  57.425  -8.264  -6.653
   56    HZ1  LYS   7           HZ1      LYS   7  57.791 -10.850  -7.520
   57    HZ2  LYS   7           HZ2      LYS   7  58.639 -10.061  -6.277
   58    HZ3  LYS   7           HZ3      LYS   7  59.257 -10.066  -7.859
   59    H    ALA   8           HN       ALA   8  56.908 -12.214  -5.373
   60    HA   ALA   8           HA       ALA   8  56.105 -14.242  -3.372
   61    HB1  ALA   8           HB1      ALA   8  57.425 -14.905  -6.018
   62    HB2  ALA   8           HB2      ALA   8  55.887 -15.517  -5.410
   63    HB3  ALA   8           HB3      ALA   8  57.398 -16.008  -4.643
   64    H    GLU   9           HN       GLU   9  57.530 -13.926  -1.739
   65    HA   GLU   9           HA       GLU   9  60.206 -12.797  -2.346
   66    HB2  GLU   9           HB2      GLU   9  58.807 -13.304   0.299
   67    HB3  GLU   9           HB1      GLU   9  60.366 -12.500   0.108
   68    HG2  GLU   9           HG2      GLU   9  57.794 -11.542  -1.180
   69    HG3  GLU   9           HG1      GLU   9  58.444 -10.900   0.329
   70    H1U  RCY  10           H1U      RCY  10  58.379 -11.450   3.110
   71    H1S  RCY  10           H1S      RCY  10  60.988 -14.337   1.848
   72    HB1  RCY  10           HB1      RCY  10  63.385 -16.551   0.182
   73    HB2  RCY  10           HB2      RCY  10  62.652 -16.348   1.772
   74    HA   RCY  10           HA       RCY  10  61.370 -16.956  -0.753
   75    HN1  RCY  10           HN1      RCY  10  60.150 -14.553   0.539
   76    H    ARG  11           HN       ARG  11  61.937 -18.412   1.504
   77    HA   ARG  11           HA       ARG  11  59.279 -18.629   2.875
   78    HE   ARG  11           HE       ARG  11  62.377 -22.097  -0.418
   79    HB2  ARG  11           HB2      ARG  11  61.096 -20.999   2.515
   80    HB3  ARG  11           HB1      ARG  11  59.343 -20.953   2.696
   81    HG2  ARG  11           HG2      ARG  11  59.642 -21.437   0.409
   82    HG3  ARG  11           HG1      ARG  11  59.350 -19.697   0.426
   83    HD2  ARG  11           HD2      ARG  11  61.340 -19.364  -0.565
   84    HD3  ARG  11           HD1      ARG  11  62.142 -20.095   0.826
   85   HH11  ARG  11          HH21      ARG  11  60.176 -19.876  -1.870
   86   HH12  ARG  11          HH22      ARG  11  60.029 -20.778  -3.342
   87   HH21  ARG  11          HH11      ARG  11  62.198 -23.288  -2.331
   88   HH22  ARG  11          HH12      ARG  11  61.173 -22.709  -3.603
   89    H    SER  12           HN       SER  12  60.731 -17.018   4.255
   90    HA   SER  12           HA       SER  12  61.811 -18.648   6.486
   91    HG   SER  12           HG       SER  12  64.071 -16.622   7.363
   92    HB2  SER  12           HB2      SER  12  63.715 -17.940   4.949
   93    HB3  SER  12           HB1      SER  12  63.340 -16.276   5.389
   94    H    ALA  13           HN       ALA  13  62.776 -16.437   7.981
   95    HA   ALA  13           HA       ALA  13  60.507 -15.525   9.320
   96    HB1  ALA  13           HB1      ALA  13  62.630 -15.150  10.342
   97    HB2  ALA  13           HB2      ALA  13  61.982 -13.544  10.006
   98    HB3  ALA  13           HB3      ALA  13  63.217 -14.234   8.954
   99    H    THR  14           HN       THR  14  59.781 -13.124   9.396
  100    HA   THR  14           HA       THR  14  59.790 -11.846   6.715
  101    HB   THR  14           HB       THR  14  57.188 -12.270   8.193
  102    HG1  THR  14           HG1      THR  14  57.048 -14.194   7.383
  103   HG21  THR  14          HG21      THR  14  57.923 -11.591   5.331
  104   HG22  THR  14          HG22      THR  14  57.216 -10.497   6.520
  105   HG23  THR  14          HG23      THR  14  56.277 -11.858   5.906
  106    H    ARG  15           HN       ARG  15  60.018 -11.633  10.037
  107    HA   ARG  15           HA       ARG  15  58.868  -8.943  10.314
  108    HE   ARG  15           HE       ARG  15  57.348  -6.442  13.123
  109    HB2  ARG  15           HB2      ARG  15  58.908 -10.676  12.170
  110    HB3  ARG  15           HB1      ARG  15  60.650 -10.424  12.266
  111    HG2  ARG  15           HG2      ARG  15  59.946  -8.883  13.846
  112    HG3  ARG  15           HG1      ARG  15  59.922  -7.867  12.404
  113    HD2  ARG  15           HD2      ARG  15  57.488  -8.558  12.108
  114    HD3  ARG  15           HD1      ARG  15  57.580  -9.256  13.725
  115   HH11  ARG  15          HH21      ARG  15  58.796  -8.769  15.215
  116   HH12  ARG  15          HH22      ARG  15  58.908  -7.686  16.561
  117   HH21  ARG  15          HH11      ARG  15  57.486  -5.014  14.870
  118   HH22  ARG  15          HH12      ARG  15  58.167  -5.560  16.366
  119    H    VAL  16           HN       VAL  16  60.087  -7.616   8.910
  120    HA   VAL  16           HA       VAL  16  62.557  -6.600   9.957
  121    HB   VAL  16           HB       VAL  16  62.884  -8.936   8.435
  122   HG11  VAL  16          HG11      VAL  16  62.344  -7.545   6.419
  123   HG12  VAL  16          HG12      VAL  16  63.973  -8.219   6.381
  124   HG13  VAL  16          HG13      VAL  16  63.730  -6.524   6.802
  125   HG21  VAL  16          HG21      VAL  16  65.305  -8.271   8.503
  126   HG22  VAL  16          HG22      VAL  16  64.492  -8.095  10.058
  127   HG23  VAL  16          HG23      VAL  16  64.807  -6.674   9.062
  128    H    MET  17           HN       MET  17  60.140  -6.803   7.478
  129    HA   MET  17           HA       MET  17  60.976  -4.131   6.416
  130    HB2  MET  17           HB2      MET  17  59.481  -6.456   5.222
  131    HB3  MET  17           HB1      MET  17  59.230  -4.833   4.581
  132    HG2  MET  17           HG2      MET  17  62.047  -5.738   4.999
  133    HG3  MET  17           HG1      MET  17  61.161  -6.417   3.633
  134    HE1  MET  17           HE1      MET  17  59.840  -5.298   2.169
  135    HE2  MET  17           HE2      MET  17  60.412  -3.909   1.247
  136    HE3  MET  17           HE3      MET  17  59.271  -3.672   2.568
  137    H    GLY  18           HN       GLY  18  59.583  -4.417   8.929
  138    HA2  GLY  18           HA2      GLY  18  56.753  -3.848   8.427
  139    HA3  GLY  18           HA1      GLY  18  57.554  -3.811   9.999
  140    H    GLY  19           HN       GLY  19  55.800  -1.772   9.348
  141    HA2  GLY  19           HA2      GLY  19  55.825   0.582   9.634
  142    HA3  GLY  19           HA1      GLY  19  57.583   0.549   9.485
  143    HA   PRO  20           HA       PRO  20  54.886   1.146   5.268
  144    HB2  PRO  20           HB2      PRO  20  54.935   4.001   6.199
  145    HB3  PRO  20           HB1      PRO  20  53.741   3.170   5.182
  146    HG2  PRO  20           HG2      PRO  20  53.286   3.655   7.766
  147    HG3  PRO  20           HG1      PRO  20  52.708   2.177   6.979
  148    HD2  PRO  20           HD2      PRO  20  54.898   2.508   8.956
  149    HD3  PRO  20           HD1      PRO  20  53.928   1.068   8.577
  150    H1U  RCY  21           H1U      RCY  21  61.208   1.044  -1.635
  151    H1S  RCY  21           H1S      RCY  21  60.049   2.104   2.230
  152    HB1  RCY  21           HB1      RCY  21  59.495  -0.068   3.490
  153    HB2  RCY  21           HB2      RCY  21  59.596   0.361   5.197
  154    HA   RCY  21           HA       RCY  21  59.032   2.767   4.412
  155    HN1  RCY  21           HN1      RCY  21  57.051   0.549   4.546
  156    H    THR  22           HN       THR  22  58.237   4.026   2.695
  157    HA   THR  22           HA       THR  22  57.805   2.647   0.084
  158    HB   THR  22           HB       THR  22  55.975   4.055   0.384
  159    HG1  THR  22           HG1      THR  22  56.348   5.861  -0.919
  160   HG21  THR  22          HG21      THR  22  56.563   5.031   2.491
  161   HG22  THR  22          HG22      THR  22  56.253   6.373   1.390
  162   HG23  THR  22          HG23      THR  22  57.912   5.915   1.777
  163    HA   PRO  23           HA       PRO  23  61.645   3.757  -1.791
  164    HB2  PRO  23           HB2      PRO  23  59.961   5.457  -3.611
  165    HB3  PRO  23           HB1      PRO  23  61.272   4.333  -4.020
  166    HG2  PRO  23           HG2      PRO  23  58.683   3.676  -4.284
  167    HG3  PRO  23           HG1      PRO  23  59.926   2.492  -3.854
  168    HD2  PRO  23           HD2      PRO  23  57.751   3.571  -2.188
  169    HD3  PRO  23           HD1      PRO  23  58.756   2.130  -1.926
  170    H    ARG  24           HN       ARG  24  63.144   5.358  -1.325
  171    HA   ARG  24           HA       ARG  24  62.561   7.528   0.344
  172    HE   ARG  24           HE       ARG  24  64.431  11.699   0.103
  173    HB2  ARG  24           HB2      ARG  24  64.857   6.530  -0.350
  174    HB3  ARG  24           HB1      ARG  24  64.788   7.666  -1.694
  175    HG2  ARG  24           HG2      ARG  24  64.143   8.838   0.942
  176    HG3  ARG  24           HG1      ARG  24  65.807   8.279   0.772
  177    HD2  ARG  24           HD2      ARG  24  66.266   9.753  -0.979
  178    HD3  ARG  24           HD1      ARG  24  64.566   9.914  -1.421
  179   HH11  ARG  24          HH21      ARG  24  67.053   9.586   0.841
  180   HH12  ARG  24          HH22      ARG  24  67.646  10.561   2.144
  181   HH21  ARG  24          HH11      ARG  24  65.190  12.985   1.799
  182   HH22  ARG  24          HH12      ARG  24  66.592  12.485   2.687
  183    H    LYS  25           HN       LYS  25  61.829   7.188  -2.968
  184    HA   LYS  25           HA       LYS  25  61.075   8.716  -4.592
  185    HB2  LYS  25           HB2      LYS  25  60.005   9.804  -1.986
  186    HB3  LYS  25           HB1      LYS  25  59.625  10.571  -3.526
  187    HG2  LYS  25           HG2      LYS  25  59.170   7.626  -2.982
  188    HG3  LYS  25           HG1      LYS  25  57.926   8.856  -2.759
  189    HD2  LYS  25           HD2      LYS  25  58.661   9.522  -5.236
  190    HD3  LYS  25           HD1      LYS  25  59.143   7.826  -5.285
  191    HE2  LYS  25           HE2      LYS  25  56.888   7.828  -6.025
  192    HE3  LYS  25           HE1      LYS  25  56.804   7.313  -4.341
  193    HZ1  LYS  25           HZ1      LYS  25  56.384   9.666  -3.751
  194    HZ2  LYS  25           HZ2      LYS  25  55.159   8.978  -4.705
  195    HZ3  LYS  25           HZ3      LYS  25  56.290  10.036  -5.403
  196    H    GLY  26           HN       GLY  26  63.636   9.180  -4.484
  197    HA2  GLY  26           HA2      GLY  26  63.849  12.125  -4.577
  198    HA3  GLY  26           HA1      GLY  26  64.949  11.302  -3.469
  199    HA   PRO  27           HA       PRO  27  67.836  11.345  -6.906
  200    HB2  PRO  27           HB2      PRO  27  68.805   8.917  -5.432
  201    HB3  PRO  27           HB1      PRO  27  69.733  10.285  -6.080
  202    HG2  PRO  27           HG2      PRO  27  69.174  10.074  -3.478
  203    HG3  PRO  27           HG1      PRO  27  69.230  11.642  -4.298
  204    HD2  PRO  27           HD2      PRO  27  66.874  10.144  -3.286
  205    HD3  PRO  27           HD1      PRO  27  67.065  11.888  -3.571
  206    HA   PRO  28           HA       PRO  28  66.364   8.550 -10.010
  207    HB2  PRO  28           HB2      PRO  28  69.188   7.550 -10.173
  208    HB3  PRO  28           HB1      PRO  28  68.096   8.053 -11.478
  209    HG2  PRO  28           HG2      PRO  28  70.058   9.635 -10.573
  210    HG3  PRO  28           HG1      PRO  28  68.515  10.278 -11.155
  211    HD2  PRO  28           HD2      PRO  28  69.562  10.171  -8.392
  212    HD3  PRO  28           HD1      PRO  28  68.289  11.205  -9.075
  213    H    LYS  29           HN       LYS  29  65.503   6.473  -9.987
  214    HA   LYS  29           HA       LYS  29  65.627   4.852  -7.685
  215    HB2  LYS  29           HB2      LYS  29  65.156   3.688 -10.432
  216    HB3  LYS  29           HB1      LYS  29  64.411   3.229  -8.901
  217    HG2  LYS  29           HG2      LYS  29  62.682   4.539  -9.592
  218    HG3  LYS  29           HG1      LYS  29  63.708   5.877  -9.075
  219    HD2  LYS  29           HD2      LYS  29  64.707   5.876 -11.406
  220    HD3  LYS  29           HD1      LYS  29  63.438   4.743 -11.869
  221    HE2  LYS  29           HE2      LYS  29  61.774   6.453 -10.940
  222    HE3  LYS  29           HE1      LYS  29  63.123   7.589 -10.899
  223    HZ1  LYS  29           HZ1      LYS  29  62.194   7.943 -12.969
  224    HZ2  LYS  29           HZ2      LYS  29  61.860   6.298 -13.229
  225    HZ3  LYS  29           HZ3      LYS  29  63.458   6.869 -13.324
  226    H1U  RCY  30           H1U      RCY  30  71.546   3.160  -6.331
  227    H1S  RCY  30           H1S      RCY  30  67.089   2.336  -7.887
  228    HB1  RCY  30           HB1      RCY  30  69.518   1.074 -10.489
  229    HB2  RCY  30           HB2      RCY  30  68.482   1.744 -11.748
  230    HA   RCY  30           HA       RCY  30  69.565   3.098  -9.282
  231    HN1  RCY  30           HN1      RCY  30  67.370   4.407 -10.781
  232    H    LYS  31           HN       LYS  31  71.175   4.482  -9.893
  233    HA   LYS  31           HA       LYS  31  71.257   5.590 -12.617
  234    HB2  LYS  31           HB2      LYS  31  73.576   6.432 -11.570
  235    HB3  LYS  31           HB1      LYS  31  72.045   7.202 -11.153
  236    HG2  LYS  31           HG2      LYS  31  71.865   5.920  -9.121
  237    HG3  LYS  31           HG1      LYS  31  73.238   4.909  -9.575
  238    HD2  LYS  31           HD2      LYS  31  73.885   6.646  -7.926
  239    HD3  LYS  31           HD1      LYS  31  74.735   6.850  -9.458
  240    HE2  LYS  31           HE2      LYS  31  72.129   8.276  -9.037
  241    HE3  LYS  31           HE1      LYS  31  73.594   8.928  -8.302
  242    HZ1  LYS  31           HZ1      LYS  31  74.032   9.827 -10.266
  243    HZ2  LYS  31           HZ2      LYS  31  72.770   8.979 -11.023
  244    HZ3  LYS  31           HZ3      LYS  31  74.304   8.265 -10.869
  245    H    GLN  32           HN       GLN  32  72.347   4.641 -14.271
  246    HA   GLN  32           HA       GLN  32  74.371   2.532 -13.598
  247    HB2  GLN  32           HB2      GLN  32  72.195   1.813 -14.753
  248    HB3  GLN  32           HB1      GLN  32  72.781   2.693 -16.165
  249    HG2  GLN  32           HG2      GLN  32  74.955   1.318 -15.871
  250    HG3  GLN  32           HG1      GLN  32  73.989   0.271 -14.831
  251   HE21  GLN  32          HE21      GLN  32  73.226   1.960 -17.934
  252   HE22  GLN  32          HE22      GLN  32  72.701   0.558 -18.734
  253    H    ARG  33           HN       ARG  33  75.408   5.020 -13.650
  254    HA   ARG  33           HA       ARG  33  77.365   4.931 -15.693
  255    HE   ARG  33           HE       ARG  33  74.331   4.363 -18.334
  256    HB2  ARG  33           HB2      ARG  33  74.852   6.060 -16.552
  257    HB3  ARG  33           HB1      ARG  33  76.070   7.331 -16.548
  258    HG2  ARG  33           HG2      ARG  33  77.469   6.159 -18.051
  259    HG3  ARG  33           HG1      ARG  33  76.642   4.628 -17.762
  260    HD2  ARG  33           HD2      ARG  33  75.078   6.929 -18.880
  261    HD3  ARG  33           HD1      ARG  33  76.136   6.015 -19.954
  262   HH11  ARG  33          HH21      ARG  33  74.910   6.110 -21.249
  263   HH12  ARG  33          HH22      ARG  33  73.756   5.209 -22.175
  264   HH21  ARG  33          HH11      ARG  33  72.821   3.176 -19.526
  265   HH22  ARG  33          HH12      ARG  33  72.574   3.548 -21.199
  266    H    GLN  34           HN       GLN  34  77.360   5.381 -12.938
  267    HA   GLN  34           HA       GLN  34  78.706   8.009 -12.844
  268    HB2  GLN  34           HB2      GLN  34  76.422   8.590 -12.203
  269    HB3  GLN  34           HB1      GLN  34  76.390   7.278 -11.025
  270    HG2  GLN  34           HG2      GLN  34  78.063   8.334  -9.671
  271    HG3  GLN  34           HG1      GLN  34  78.418   9.522 -10.926
  272   HE21  GLN  34          HE21      GLN  34  76.164   8.676  -8.353
  273   HE22  GLN  34          HE22      GLN  34  75.251  10.104  -8.431
  274    H    THR  35           HN       THR  35  80.646   7.519 -11.951
  275    HA   THR  35           HA       THR  35  82.265   6.357 -10.697
  276    HB   THR  35           HB       THR  35  81.488   6.004  -8.262
  277    HG1  THR  35           HG1      THR  35  79.525   7.116  -7.817
  278   HG21  THR  35          HG21      THR  35  81.307   8.710  -9.612
  279   HG22  THR  35          HG22      THR  35  82.743   7.974  -8.900
  280   HG23  THR  35          HG23      THR  35  81.409   8.484  -7.866
  281    H    ARG  36           HN       ARG  36  81.995   4.452 -12.131
  282    HA   ARG  36           HA       ARG  36  80.805   2.139 -10.644
  283    HE   ARG  36           HE       ARG  36  76.533   1.061 -11.944
  284    HB2  ARG  36           HB2      ARG  36  79.616   2.990 -12.832
  285    HB3  ARG  36           HB1      ARG  36  80.956   2.192 -13.651
  286    HG2  ARG  36           HG2      ARG  36  79.201   0.565 -13.478
  287    HG3  ARG  36           HG1      ARG  36  80.414   0.121 -12.276
  288    HD2  ARG  36           HD2      ARG  36  78.934   0.379 -10.600
  289    HD3  ARG  36           HD1      ARG  36  78.529   2.005 -11.149
  290   HH11  ARG  36          HH21      ARG  36  79.140  -1.190 -12.089
  291   HH12  ARG  36          HH22      ARG  36  78.183  -2.457 -12.781
  292   HH21  ARG  36          HH11      ARG  36  75.268  -0.580 -12.846
  293   HH22  ARG  36          HH12      ARG  36  75.990  -2.112 -13.210
  294    H    GLN  37           HN       GLN  37  83.622   3.473 -11.310
  295    HA   GLN  37           HA       GLN  37  85.019   1.234 -12.580
  296    HB2  GLN  37           HB2      GLN  37  86.077   3.702 -11.167
  297    HB3  GLN  37           HB1      GLN  37  87.057   2.561 -12.088
  298    HG2  GLN  37           HG2      GLN  37  85.735   3.050 -14.113
  299    HG3  GLN  37           HG1      GLN  37  84.751   4.191 -13.196
  300   HE21  GLN  37          HE21      GLN  37  85.562   6.309 -12.943
  301   HE22  GLN  37          HE22      GLN  37  87.107   6.800 -13.448
  302    H1U  RCY  38           H1U      RCY  38  85.484   3.010  -2.727
  303    H1S  RCY  38           H1S      RCY  38  84.767   2.667  -6.723
  304    HB1  RCY  38           HB1      RCY  38  85.394   0.015  -6.692
  305    HB2  RCY  38           HB2      RCY  38  85.220  -0.676  -8.303
  306    HA   RCY  38           HA       RCY  38  86.607   1.877  -7.488
  307    HN1  RCY  38           HN1      RCY  38  86.139   2.771  -9.611
  308    H    LYS  39           HN       LYS  39  87.431  -0.618  -6.722
  309    HA   LYS  39           HA       LYS  39  89.559  -1.656  -6.681
  310    HB2  LYS  39           HB2      LYS  39  89.626  -3.465  -8.222
  311    HB3  LYS  39           HB1      LYS  39  87.923  -3.160  -7.907
  312    HG2  LYS  39           HG2      LYS  39  88.951  -1.549 -10.129
  313    HG3  LYS  39           HG1      LYS  39  89.101  -3.281 -10.427
  314    HD2  LYS  39           HD2      LYS  39  86.675  -3.502  -9.706
  315    HD3  LYS  39           HD1      LYS  39  86.586  -1.741  -9.746
  316    HE2  LYS  39           HE2      LYS  39  85.853  -2.350 -11.895
  317    HE3  LYS  39           HE1      LYS  39  87.557  -1.975 -12.151
  318    HZ1  LYS  39           HZ1      LYS  39  87.953  -4.425 -11.725
  319    HZ2  LYS  39           HZ2      LYS  39  87.213  -4.018 -13.199
  320    HZ3  LYS  39           HZ3      LYS  39  86.281  -4.633 -11.918
  321    H    SER  40           HN       SER  40  89.716   1.054  -7.747
  322    HA   SER  40           HA       SER  40  92.232   0.708  -9.291
  323    HG   SER  40           HG       SER  40  88.868   2.015 -10.471
  324    HB2  SER  40           HB2      SER  40  91.485   2.623 -10.792
  325    HB3  SER  40           HB1      SER  40  90.656   1.092 -11.057
  326    H    LYS  41           HN       LYS  41  90.514   2.157  -6.799
  327    HA   LYS  41           HA       LYS  41  92.170   4.616  -6.767
  328    HB2  LYS  41           HB2      LYS  41  89.799   3.647  -5.176
  329    HB3  LYS  41           HB1      LYS  41  90.774   5.002  -4.606
  330    HG2  LYS  41           HG2      LYS  41  88.891   5.837  -5.933
  331    HG3  LYS  41           HG1      LYS  41  90.406   6.152  -6.780
  332    HD2  LYS  41           HD2      LYS  41  90.052   4.365  -8.303
  333    HD3  LYS  41           HD1      LYS  41  88.781   3.659  -7.304
  334    HE2  LYS  41           HE2      LYS  41  88.614   6.329  -8.735
  335    HE3  LYS  41           HE1      LYS  41  87.822   4.839  -9.249
  336    HZ1  LYS  41           HZ1      LYS  41  86.138   5.616  -8.017
  337    HZ2  LYS  41           HZ2      LYS  41  87.126   6.663  -7.115
  338    HZ3  LYS  41           HZ3      LYS  41  87.027   5.018  -6.702
  339    HA   PRO  42           HA       PRO  42  95.044   2.668  -3.965
  340    HB2  PRO  42           HB2      PRO  42  96.330   4.885  -3.041
  341    HB3  PRO  42           HB1      PRO  42  96.555   4.271  -4.691
  342    HG2  PRO  42           HG2      PRO  42  94.869   6.531  -3.736
  343    HG3  PRO  42           HG1      PRO  42  95.881   6.410  -5.186
  344    HD2  PRO  42           HD2      PRO  42  93.151   6.076  -5.220
  345    HD3  PRO  42           HD1      PRO  42  94.244   5.317  -6.398
  346    HA   PRO  43           HA       PRO  43  93.313   2.830   0.110
  347    HB2  PRO  43           HB2      PRO  43  95.548   2.467   1.688
  348    HB3  PRO  43           HB1      PRO  43  94.749   1.164   0.788
  349    HG2  PRO  43           HG2      PRO  43  97.199   2.702   0.106
  350    HG3  PRO  43           HG1      PRO  43  96.841   0.983  -0.127
  351    HD2  PRO  43           HD2      PRO  43  96.717   2.796  -2.164
  352    HD3  PRO  43           HD1      PRO  43  95.683   1.351  -2.103
  353    H    LYS  44           HN       LYS  44  92.607   4.641   1.151
  354    HA   LYS  44           HA       LYS  44  94.614   6.749   1.860
  355    HB2  LYS  44           HB2      LYS  44  91.794   7.156   0.816
  356    HB3  LYS  44           HB1      LYS  44  92.856   8.442   1.392
  357    HG2  LYS  44           HG2      LYS  44  94.360   8.173  -0.403
  358    HG3  LYS  44           HG1      LYS  44  93.756   6.561  -0.785
  359    HD2  LYS  44           HD2      LYS  44  92.950   8.202  -2.436
  360    HD3  LYS  44           HD1      LYS  44  91.604   7.541  -1.507
  361    HE2  LYS  44           HE2      LYS  44  91.449   9.504  -0.153
  362    HE3  LYS  44           HE1      LYS  44  92.996  10.114  -0.739
  363    HZ1  LYS  44           HZ1      LYS  44  90.909   9.575  -2.713
  364    HZ2  LYS  44           HZ2      LYS  44  92.104  10.782  -2.698
  365    HZ3  LYS  44           HZ3      LYS  44  90.719  10.943  -1.728
  366    H    LYS  45           HN       LYS  45  91.947   4.768   2.794
  367    HA   LYS  45           HA       LYS  45  90.876   4.500   4.862
  368    HB2  LYS  45           HB2      LYS  45  93.574   5.190   5.403
  369    HB3  LYS  45           HB1      LYS  45  92.597   6.151   6.510
  370    HG2  LYS  45           HG2      LYS  45  91.451   4.153   7.305
  371    HG3  LYS  45           HG1      LYS  45  92.296   3.158   6.118
  372    HD2  LYS  45           HD2      LYS  45  94.418   3.554   7.180
  373    HD3  LYS  45           HD1      LYS  45  93.725   4.785   8.236
  374    HE2  LYS  45           HE2      LYS  45  94.085   2.414   9.222
  375    HE3  LYS  45           HE1      LYS  45  92.529   3.195   9.505
  376    HZ1  LYS  45           HZ1      LYS  45  92.883   1.525   7.115
  377    HZ2  LYS  45           HZ2      LYS  45  91.473   1.850   8.006
  378    HZ3  LYS  45           HZ3      LYS  45  92.635   0.771   8.615
  379    H    GLY  46           HN       GLY  46  88.975   5.646   4.732
  380    HA2  GLY  46           HA2      GLY  46  88.729   8.455   4.429
  381    HA3  GLY  46           HA1      GLY  46  87.466   7.410   5.078
  382    H    VAL  47           HN       VAL  47  87.008   9.231   6.562
  383    HA   VAL  47           HA       VAL  47  88.574   8.946   9.049
  384    HB   VAL  47           HB       VAL  47  88.200  11.605   7.636
  385   HG11  VAL  47          HG11      VAL  47  89.071  10.898  10.443
  386   HG12  VAL  47          HG12      VAL  47  87.814  12.031   9.946
  387   HG13  VAL  47          HG13      VAL  47  89.512  12.428   9.683
  388   HG21  VAL  47          HG21      VAL  47  90.596   9.904   8.362
  389   HG22  VAL  47          HG22      VAL  47  90.741  11.616   7.963
  390   HG23  VAL  47          HG23      VAL  47  90.121  10.480   6.764
  391    H    GLN  48           HN       GLN  48  85.690   9.544   7.348
  392    HA   GLN  48           HA       GLN  48  84.193   9.619   9.889
  393    HB2  GLN  48           HB2      GLN  48  84.754  12.032   8.863
  394    HB3  GLN  48           HB1      GLN  48  83.353  11.654   7.861
  395    HG2  GLN  48           HG2      GLN  48  82.438  12.740   9.759
  396    HG3  GLN  48           HG1      GLN  48  82.174  11.023  10.069
  397   HE21  GLN  48          HE21      GLN  48  82.142  11.790  12.430
  398   HE22  GLN  48          HE22      GLN  48  83.630  11.942  13.232
  399    H    GLY  49           HN       GLY  49  84.635   7.993   7.284
  400    HA2  GLY  49           HA2      GLY  49  83.262   6.460   6.139
  401    HA3  GLY  49           HA1      GLY  49  81.896   7.051   7.087
  402    H1U  RCY  50           H1U      RCY  50  82.568   5.658   2.479
  403    H1S  RCY  50           H1S      RCY  50  79.316   9.106   3.587
  404    HB1  RCY  50           HB1      RCY  50  82.050  12.091   4.255
  405    HB2  RCY  50           HB2      RCY  50  81.234  10.909   5.277
  406    HA   RCY  50           HA       RCY  50  82.022   9.418   3.059
  407    HN1  RCY  50           HN1      RCY  50  83.743   9.459   5.460
  408    H    GLY  51           HN       GLY  51  83.531   9.637   1.478
  409    HA2  GLY  51           HA2      GLY  51  86.137  10.735   1.862
  410    HA3  GLY  51           HA1      GLY  51  85.383  10.455   0.291
  411    H    ASP  52           HN       ASP  52  85.051  12.271  -0.889
  412    HA   ASP  52           HA       ASP  52  83.936  14.683   0.251
  413    HB2  ASP  52           HB2      ASP  52  86.362  14.776   1.008
  414    HB3  ASP  52           HB1      ASP  52  86.803  14.907  -0.695
  415    H    ASP  53           HN       ASP  53  84.677  12.665  -2.279
  416    HA   ASP  53           HA       ASP  53  84.481  14.718  -4.397
  417    HB2  ASP  53           HB2      ASP  53  84.711  11.695  -4.496
  418    HB3  ASP  53           HB1      ASP  53  84.634  12.729  -5.923
  419    H    ILE  54           HN       ILE  54  82.226  14.528  -2.644
  420    HA   ILE  54           HA       ILE  54  80.080  12.935  -3.354
  421    HB   ILE  54           HB       ILE  54  78.803  15.345  -3.129
  422   HG12  ILE  54          HG12      ILE  54  80.156  16.682  -1.506
  423   HG13  ILE  54          HG11      ILE  54  81.524  15.611  -1.810
  424   HG21  ILE  54          HG21      ILE  54  78.938  14.883  -0.613
  425   HG22  ILE  54          HG22      ILE  54  80.019  13.550  -1.021
  426   HG23  ILE  54          HG23      ILE  54  78.359  13.553  -1.618
  427   HD11  ILE  54          HD11      ILE  54  80.099  17.162  -3.987
  428   HD12  ILE  54          HD12      ILE  54  81.608  16.260  -4.133
  429   HD13  ILE  54          HD13      ILE  54  81.554  17.737  -3.172
  430    HA   PRO  55           HA       PRO  55  79.835  14.303  -7.687
  431    HB2  PRO  55           HB2      PRO  55  79.151  11.945  -8.775
  432    HB3  PRO  55           HB1      PRO  55  80.805  12.248  -8.206
  433    HG2  PRO  55           HG2      PRO  55  78.646  10.655  -6.946
  434    HG3  PRO  55           HG1      PRO  55  80.397  10.395  -6.938
  435    HD2  PRO  55           HD2      PRO  55  78.879  11.587  -4.867
  436    HD3  PRO  55           HD1      PRO  55  80.650  11.591  -5.007
  437    H    GLY  56           HN       GLY  56  77.411  12.015  -6.354
  438    HA2  GLY  56           HA2      GLY  56  75.293  13.430  -7.880
  439    HA3  GLY  56           HA1      GLY  56  75.113  11.868  -7.082
  440    H    MET  57           HN       MET  57  75.477  12.059  -4.565
  441    HA   MET  57           HA       MET  57  74.930  14.526  -3.237
  442    HB2  MET  57           HB2      MET  57  72.740  14.779  -3.795
  443    HB3  MET  57           HB1      MET  57  72.629  13.138  -4.421
  444    HG2  MET  57           HG2      MET  57  72.738  13.665  -1.449
  445    HG3  MET  57           HG1      MET  57  71.210  13.717  -2.328
  446    HE1  MET  57           HE1      MET  57  71.168  11.682  -0.073
  447    HE2  MET  57           HE2      MET  57  70.447  10.355  -0.980
  448    HE3  MET  57           HE3      MET  57  69.971  12.014  -1.331
  449    H    GLU  58           HN       GLU  58  74.666  11.007  -3.266
  450    HA   GLU  58           HA       GLU  58  74.413  10.690  -0.413
  451    HB2  GLU  58           HB2      GLU  58  75.295   8.884  -2.662
  452    HB3  GLU  58           HB1      GLU  58  75.446   8.359  -0.988
  453    HG2  GLU  58           HG2      GLU  58  73.301   7.625  -1.300
  454    HG3  GLU  58           HG1      GLU  58  72.895   9.309  -0.967
  455    H    GLY  59           HN       GLY  59  77.270  10.167  -2.517
  456    HA2  GLY  59           HA2      GLY  59  79.341  11.461  -1.734
  457    HA3  GLY  59           HA1      GLY  59  78.975  10.798  -0.140
  458    H1U  RCY  60           H1U      RCY  60  76.271   6.754  -0.703
  459    H1S  RCY  60           H1S      RCY  60  79.069   9.802  -3.121
  460    HB1  RCY  60           HB1      RCY  60  80.091   6.812  -3.481
  461    HB2  RCY  60           HB2      RCY  60  81.521   7.005  -4.492
  462    HA   RCY  60           HA       RCY  60  81.582   7.608  -1.897
  463    HN1  RCY  60           HN1      RCY  60  80.927  10.342  -2.748
  464    H    GLY  61           HN       GLY  61  83.773   7.434  -1.956
  465    HA2  GLY  61           HA2      GLY  61  85.350   8.589  -4.117
  466    HA3  GLY  61           HA1      GLY  61  85.554   9.450  -2.590
  467    H    THR  62           HN       THR  62  85.409   7.315  -0.784
  468    HA   THR  62           HA       THR  62  87.032   5.068  -1.478
  469    HB   THR  62           HB       THR  62  88.917   6.457  -1.772
  470    HG1  THR  62           HG1      THR  62  89.899   5.207  -0.419
  471   HG21  THR  62          HG21      THR  62  87.804   8.015   0.566
  472   HG22  THR  62          HG22      THR  62  88.075   8.576  -1.084
  473   HG23  THR  62          HG23      THR  62  89.448   8.252  -0.025
  474    H    ASP  63           HN       ASP  63  84.897   6.482   0.415
  475    HA   ASP  63           HA       ASP  63  85.760   5.791   3.084
  476    HB2  ASP  63           HB2      ASP  63  83.239   5.934   3.557
  477    HB3  ASP  63           HB1      ASP  63  84.005   7.392   2.924
  478    H    ILE  64           HN       ILE  64  86.009   3.647   1.020
  479    HA   ILE  64           HA       ILE  64  84.953   1.481   2.648
  480    HB   ILE  64           HB       ILE  64  82.921   1.883   1.438
  481   HG12  ILE  64          HG12      ILE  64  84.051  -0.221  -0.344
  482   HG13  ILE  64          HG11      ILE  64  84.163  -0.508   1.393
  483   HG21  ILE  64          HG21      ILE  64  83.015   1.875  -1.123
  484   HG22  ILE  64          HG22      ILE  64  84.756   2.104  -0.956
  485   HG23  ILE  64          HG23      ILE  64  83.643   3.318  -0.326
  486   HD11  ILE  64          HD11      ILE  64  82.026  -1.322   0.164
  487   HD12  ILE  64          HD12      ILE  64  81.570   0.381   0.139
  488   HD13  ILE  64          HD13      ILE  64  81.824  -0.441   1.678
  489    H    THR  65           HN       THR  65  87.555   2.211   1.932
  490    HA   THR  65           HA       THR  65  88.471   0.648  -0.343
  491    HB   THR  65           HB       THR  65  89.761   2.586   0.568
  492    HG1  THR  65           HG1      THR  65  90.856   0.005   0.452
  493   HG21  THR  65          HG21      THR  65  89.165   1.902   2.988
  494   HG22  THR  65          HG22      THR  65  90.789   2.523   2.693
  495   HG23  THR  65          HG23      THR  65  90.527   0.788   2.865
  496    H    VAL  66           HN       VAL  66  88.357   0.235   3.164
  497    HA   VAL  66           HA       VAL  66  88.185  -2.675   2.865
  498    HB   VAL  66           HB       VAL  66  90.502  -1.396   4.361
  499   HG11  VAL  66          HG11      VAL  66  91.151  -3.848   4.654
  500   HG12  VAL  66          HG12      VAL  66  89.511  -4.246   4.140
  501   HG13  VAL  66          HG13      VAL  66  89.771  -3.303   5.608
  502   HG21  VAL  66          HG21      VAL  66  91.012  -1.431   2.018
  503   HG22  VAL  66          HG22      VAL  66  90.319  -3.041   1.826
  504   HG23  VAL  66          HG23      VAL  66  91.826  -2.831   2.717
  505    H    ILE  67           HN       ILE  67  87.708   0.265   4.489
  506    HA   ILE  67           HA       ILE  67  86.275  -1.159   6.684
  507    HB   ILE  67           HB       ILE  67  87.921   1.344   7.121
  508   HG12  ILE  67          HG12      ILE  67  88.607  -1.556   7.702
  509   HG13  ILE  67          HG11      ILE  67  89.424  -0.508   6.542
  510   HG21  ILE  67          HG21      ILE  67  85.936   0.753   8.627
  511   HG22  ILE  67          HG22      ILE  67  87.488   0.964   9.438
  512   HG23  ILE  67          HG23      ILE  67  86.868  -0.658   9.130
  513   HD11  ILE  67          HD11      ILE  67  89.891   1.062   8.510
  514   HD12  ILE  67          HD12      ILE  67  90.782  -0.460   8.501
  515   HD13  ILE  67          HD13      ILE  67  89.382  -0.264   9.555
  516    H1U  RCY  68           H1U      RCY  68  76.017   2.435   2.771
  517    H1S  RCY  68           H1S      RCY  68  80.363   1.718   1.964
  518    HB1  RCY  68           HB1      RCY  68  81.822  -0.013   4.690
  519    HB2  RCY  68           HB2      RCY  68  83.230   0.483   3.755
  520    HA   RCY  68           HA       RCY  68  83.567   2.235   5.672
  521    HN1  RCY  68           HN1      RCY  68  84.194  -0.650   6.171
  522    HA   PRO  69           HA       PRO  69  81.337   2.397   9.503
  523    HB2  PRO  69           HB2      PRO  69  79.160   3.352   7.660
  524    HB3  PRO  69           HB1      PRO  69  79.635   3.981   9.252
  525    HG2  PRO  69           HG2      PRO  69  80.446   5.136   6.978
  526    HG3  PRO  69           HG1      PRO  69  81.482   5.067   8.413
  527    HD2  PRO  69           HD2      PRO  69  81.784   3.649   5.845
  528    HD3  PRO  69           HD1      PRO  69  82.984   3.911   7.130
  529    H    TRP  70           HN       TRP  70  80.128   0.620   6.745
  530    HA   TRP  70           HA       TRP  70  77.804  -0.547   7.908
  531    HD1  TRP  70           HD1      TRP  70  76.566  -2.692   7.603
  532    HE1  TRP  70           HE1      TRP  70  76.438  -5.251   7.335
  533    HE3  TRP  70           HE3      TRP  70  80.634  -3.469   4.616
  534    HZ2  TRP  70           HZ2      TRP  70  77.873  -7.355   6.025
  535    HZ3  TRP  70           HZ3      TRP  70  81.230  -5.754   3.874
  536    HH2  TRP  70           HH2      TRP  70  79.859  -7.697   4.572
  537    HB2  TRP  70           HB2      TRP  70  78.066  -0.935   5.599
  538    HB3  TRP  70           HB1      TRP  70  79.743  -1.446   5.781
  539    H    GLU  71           HN       GLU  71  81.217  -1.202   8.356
  540    HA   GLU  71           HA       GLU  71  80.541  -3.541  10.091
  541    HB2  GLU  71           HB2      GLU  71  83.184  -2.690   8.871
  542    HB3  GLU  71           HB1      GLU  71  82.939  -4.119   9.876
  543    HG2  GLU  71           HG2      GLU  71  81.630  -5.196   8.249
  544    HG3  GLU  71           HG1      GLU  71  81.268  -3.688   7.408
  545    H    ALA  72           HN       ALA  72  82.255  -0.440   9.997
  546    HA   ALA  72           HA       ALA  72  83.260  -0.639  12.705
  547    HB1  ALA  72           HB1      ALA  72  84.053   1.550  12.403
  548    HB2  ALA  72           HB2      ALA  72  82.733   1.981  11.316
  549    HB3  ALA  72           HB3      ALA  72  84.029   0.925  10.754
  550    H1U  RCY  73           H1U      RCY  73  74.159   2.814   7.502
  551    H1S  RCY  73           H1S      RCY  73  75.091   2.750  11.701
  552    HB1  RCY  73           HB1      RCY  73  77.622   1.183  11.432
  553    HB2  RCY  73           HB2      RCY  73  78.729   2.537  11.202
  554    HA   RCY  73           HA       RCY  73  79.430   2.060  13.675
  555    HN1  RCY  73           HN1      RCY  73  80.414   0.919  11.225
  556    H    ASN  74           HN       ASN  74  78.858  -1.039  12.038
  557    HA   ASN  74           HA       ASN  74  78.063  -3.063  12.923
  558    HB2  ASN  74           HB2      ASN  74  79.344  -1.909  15.040
  559    HB3  ASN  74           HB1      ASN  74  77.704  -2.011  15.678
  560   HD21  ASN  74          HD21      ASN  74  77.395  -3.935  16.798
  561   HD22  ASN  74          HD22      ASN  74  78.086  -5.430  16.386
  562    H    HIS  75           HN       HIS  75  76.319  -0.920  11.934
  563    HA   HIS  75           HA       HIS  75  73.896  -1.230  13.636
  564    HD1  HIS  75           HD1      HIS  75  71.580   0.674  10.821
  565    HD2  HIS  75           HD2      HIS  75  72.704   1.143  14.810
  566    HE1  HIS  75           HE1      HIS  75  69.495   1.380  12.073
  567    HE2  HIS  75           HE2      HIS  75  70.165   1.669  14.503
  568    HB2  HIS  75           HB2      HIS  75  74.736   1.031  12.649
  569    HB3  HIS  75           HB1      HIS  75  74.063   0.440  11.130
  570    H1U  RCY  76           H1U      RCY  76  76.890  -4.340   4.973
  571    H1S  RCY  76           H1S      RCY  76  74.830  -6.396   7.495
  572    HB1  RCY  76           HB1      RCY  76  75.374  -4.613   9.194
  573    HB2  RCY  76           HB2      RCY  76  74.640  -3.054   8.836
  574    HA   RCY  76           HA       RCY  76  72.642  -3.911  10.264
  575    HN1  RCY  76           HN1      RCY  76  75.150  -3.308  11.768
  576    H    GLU  77           HN       GLU  77  73.422  -6.390   9.300
  577    HA   GLU  77           HA       GLU  77  73.224  -8.026  11.688
  578    HB2  GLU  77           HB2      GLU  77  73.768  -8.847   8.815
  579    HB3  GLU  77           HB1      GLU  77  73.268  -9.924  10.120
  580    HG2  GLU  77           HG2      GLU  77  71.641  -7.522   9.259
  581    HG3  GLU  77           HG1      GLU  77  71.393  -9.137   8.594
  582    H    LEU  78           HN       LEU  78  75.165  -9.876   9.880
  583    HA   LEU  78           HA       LEU  78  77.335 -10.016  11.623
  584    HG   LEU  78           HG       LEU  78  79.633 -10.208   9.656
  585    HB2  LEU  78           HB2      LEU  78  76.953 -11.627   9.797
  586    HB3  LEU  78           HB1      LEU  78  77.375 -10.394   8.611
  587   HD11  LEU  78          HD11      LEU  78  78.421 -12.289  11.450
  588   HD12  LEU  78          HD12      LEU  78  79.422 -10.901  11.873
  589   HD13  LEU  78          HD13      LEU  78  80.156 -12.325  11.135
  590   HD21  LEU  78          HD21      LEU  78  80.506 -12.253   8.710
  591   HD22  LEU  78          HD22      LEU  78  79.120 -11.770   7.732
  592   HD23  LEU  78          HD23      LEU  78  78.955 -13.068   8.914
  593    H    HIS  79           HN       HIS  79  79.442  -9.037  11.624
  594    HA   HIS  79           HA       HIS  79  79.989  -6.810   9.794
  595    HD1  HIS  79           HD1      HIS  79  80.060  -8.161  13.437
  596    HD2  HIS  79           HD2      HIS  79  76.946  -5.400  13.154
  597    HE1  HIS  79           HE1      HIS  79  78.416  -8.747  15.272
  598    HE2  HIS  79           HE2      HIS  79  76.516  -7.074  15.111
  599    HB2  HIS  79           HB2      HIS  79  80.377  -5.427  12.108
  600    HB3  HIS  79           HB1      HIS  79  78.888  -5.335  11.168
  601    H    GLU  80           HN       GLU  80  82.197  -6.408   9.682
  602    HA   GLU  80           HA       GLU  80  84.135  -6.887  11.673
  603    HB2  GLU  80           HB2      GLU  80  83.110  -9.317  10.473
  604    HB3  GLU  80           HB1      GLU  80  84.802  -9.123  10.028
  605    HG2  GLU  80           HG2      GLU  80  83.851  -8.783  12.876
  606    HG3  GLU  80           HG1      GLU  80  84.338 -10.351  12.233
  607    H    LEU  81           HN       LEU  81  86.226  -7.924   9.957
  608    HA   LEU  81           HA       LEU  81  86.588  -5.542   8.257
  609    HG   LEU  81           HG       LEU  81  87.976  -7.306  10.779
  610    HB2  LEU  81           HB2      LEU  81  88.498  -7.872   8.493
  611    HB3  LEU  81           HB1      LEU  81  88.865  -6.190   8.107
  612   HD11  LEU  81          HD11      LEU  81  90.401  -7.469  10.135
  613   HD12  LEU  81          HD12      LEU  81  90.115  -6.461  11.553
  614   HD13  LEU  81          HD13      LEU  81  90.431  -5.712   9.987
  615   HD21  LEU  81          HD21      LEU  81  86.799  -5.241  10.550
  616   HD22  LEU  81          HD22      LEU  81  88.175  -4.460   9.771
  617   HD23  LEU  81          HD23      LEU  81  88.241  -4.856  11.488
  618    H    ALA  82           HN       ALA  82  84.680  -7.902   7.694
  619    HA   ALA  82           HA       ALA  82  85.706  -9.265   5.378
  620    HB1  ALA  82           HB1      ALA  82  82.909  -8.788   6.422
  621    HB2  ALA  82           HB2      ALA  82  83.855 -10.275   6.491
  622    HB3  ALA  82           HB3      ALA  82  83.221  -9.705   4.947
  623    H    GLN  83           HN       GLN  83  85.292  -6.061   5.701
  624    HA   GLN  83           HA       GLN  83  83.686  -5.103   3.647
  625    HB2  GLN  83           HB2      GLN  83  85.350  -3.835   5.229
  626    HB3  GLN  83           HB1      GLN  83  86.496  -4.052   3.906
  627    HG2  GLN  83           HG2      GLN  83  85.490  -1.968   3.435
  628    HG3  GLN  83           HG1      GLN  83  84.620  -3.097   2.395
  629   HE21  GLN  83          HE21      GLN  83  82.460  -2.431   2.405
  630   HE22  GLN  83          HE22      GLN  83  81.574  -2.041   3.799
  631    H    TYR  84           HN       TYR  84  87.068  -6.211   3.303
  632    HA   TYR  84           HA       TYR  84  86.587  -6.487   0.368
  633    HD1  TYR  84           HD2      TYR  84  88.100  -4.035  -0.485
  634    HD2  TYR  84           HD1      TYR  84  89.806  -7.976  -0.600
  635    HE1  TYR  84           HE2      TYR  84  88.622  -3.739  -2.891
  636    HE2  TYR  84           HE1      TYR  84  90.328  -7.679  -3.007
  637    HH   TYR  84           HH       TYR  84  90.674  -5.138  -4.511
  638    HB2  TYR  84           HB2      TYR  84  88.666  -5.250   1.580
  639    HB3  TYR  84           HB1      TYR  84  89.313  -6.890   1.517
  640    H    GLY  85           HN       GLY  85  85.743  -8.321   2.633
  641    HA2  GLY  85           HA2      GLY  85  87.391 -10.707   2.356
  642    HA3  GLY  85           HA1      GLY  85  85.833 -10.616   3.179
  643    H    ILE  86           HN       ILE  86  84.767  -9.290   0.615
  644    HA   ILE  86           HA       ILE  86  84.660 -11.724  -1.112
  645    HB   ILE  86           HB       ILE  86  82.650 -11.835   0.215
  646   HG12  ILE  86          HG12      ILE  86  81.811 -10.470  -2.350
  647   HG13  ILE  86          HG11      ILE  86  82.531 -12.081  -2.346
  648   HG21  ILE  86          HG21      ILE  86  82.210  -8.940  -0.582
  649   HG22  ILE  86          HG22      ILE  86  82.696  -9.495   1.020
  650   HG23  ILE  86          HG23      ILE  86  81.108  -9.921   0.383
  651   HD11  ILE  86          HD11      ILE  86  80.083 -12.255  -2.300
  652   HD12  ILE  86          HD12      ILE  86  80.026 -11.250  -0.852
  653   HD13  ILE  86          HD13      ILE  86  80.762 -12.851  -0.786
  654    H1U  RCY  87           H1U      RCY  87  79.115  -1.866  -0.465
  655    H1S  RCY  87           H1S      RCY  87  82.410  -4.735   0.202
  656    HB1  RCY  87           HB1      RCY  87  84.291  -5.424  -3.086
  657    HB2  RCY  87           HB2      RCY  87  84.973  -5.866  -1.520
  658    HA   RCY  87           HA       RCY  87  83.885  -7.788  -3.602
  659    HN1  RCY  87           HN1      RCY  87  84.532  -8.242  -0.780
  Start of MODEL   86
    1    HA   MET   1           HA       MET   1  70.949 -17.954   8.619
    2    HB2  MET   1           HB2      MET   1  72.931 -19.027   7.672
    3    HB3  MET   1           HB1      MET   1  73.896 -18.522   9.059
    4    HG2  MET   1           HG2      MET   1  72.662 -19.934  10.549
    5    HG3  MET   1           HG1      MET   1  71.426 -20.248   9.330
    6    HE1  MET   1           HE1      MET   1  72.765 -22.638  10.898
    7    HE2  MET   1           HE2      MET   1  72.876 -23.742   9.529
    8    HE3  MET   1           HE3      MET   1  71.487 -22.668   9.676
    9    H    ASN   2           HN       ASN   2  70.096 -18.435  10.628
   10    HA   ASN   2           HA       ASN   2  71.514 -18.080  13.107
   11    HB2  ASN   2           HB2      ASN   2  71.263 -15.700  12.623
   12    HB3  ASN   2           HB1      ASN   2  69.537 -15.913  12.329
   13   HD21  ASN   2          HD21      ASN   2  68.706 -14.700  14.102
   14   HD22  ASN   2          HD22      ASN   2  69.012 -15.095  15.725
   15    H    LEU   3           HN       LEU   3  69.875 -18.222  14.999
   16    HA   LEU   3           HA       LEU   3  68.262 -20.492  14.744
   17    HG   LEU   3           HG       LEU   3  69.981 -19.947  16.556
   18    HB2  LEU   3           HB2      LEU   3  68.055 -18.132  16.626
   19    HB3  LEU   3           HB1      LEU   3  67.016 -19.549  16.777
   20   HD11  LEU   3          HD11      LEU   3  69.914 -18.299  18.290
   21   HD12  LEU   3          HD12      LEU   3  70.010 -19.859  19.108
   22   HD13  LEU   3          HD13      LEU   3  68.467 -19.012  19.004
   23   HD21  LEU   3          HD21      LEU   3  68.476 -21.887  16.521
   24   HD22  LEU   3          HD22      LEU   3  67.730 -21.355  18.028
   25   HD23  LEU   3          HD23      LEU   3  69.413 -21.882  18.015
   26    H    GLU   4           HN       GLU   4  66.446 -17.617  15.609
   27    HA   GLU   4           HA       GLU   4  64.394 -18.371  13.630
   28    HB2  GLU   4           HB2      GLU   4  63.209 -16.342  14.778
   29    HB3  GLU   4           HB1      GLU   4  63.405 -17.840  15.687
   30    HG2  GLU   4           HG2      GLU   4  65.330 -16.975  16.849
   31    HG3  GLU   4           HG1      GLU   4  65.388 -15.554  15.805
   32    HA   PRO   5           HA       PRO   5  66.120 -15.635  10.506
   33    HB2  PRO   5           HB2      PRO   5  63.202 -15.375   9.855
   34    HB3  PRO   5           HB1      PRO   5  64.574 -15.671   8.769
   35    HG2  PRO   5           HG2      PRO   5  62.930 -17.635   9.527
   36    HG3  PRO   5           HG1      PRO   5  64.661 -17.908   9.272
   37    HD2  PRO   5           HD2      PRO   5  63.136 -17.835  11.816
   38    HD3  PRO   5           HD1      PRO   5  64.686 -18.625  11.452
   39    HA   PRO   6           HA       PRO   6  65.381 -11.599  12.229
   40    HB2  PRO   6           HB2      PRO   6  66.109  -9.997  10.144
   41    HB3  PRO   6           HB1      PRO   6  67.285 -10.924  11.097
   42    HG2  PRO   6           HG2      PRO   6  66.126 -11.536   8.424
   43    HG3  PRO   6           HG1      PRO   6  67.784 -11.747   9.012
   44    HD2  PRO   6           HD2      PRO   6  65.979 -13.811   8.834
   45    HD3  PRO   6           HD1      PRO   6  67.317 -13.782  10.004
   46    H    LYS   7           HN       LYS   7  64.035  -9.599  11.905
   47    HA   LYS   7           HA       LYS   7  61.463 -10.294  10.708
   48    HB2  LYS   7           HB2      LYS   7  61.638  -8.989  12.824
   49    HB3  LYS   7           HB1      LYS   7  62.377  -7.667  11.925
   50    HG2  LYS   7           HG2      LYS   7  59.884  -8.611  10.706
   51    HG3  LYS   7           HG1      LYS   7  59.656  -7.994  12.343
   52    HD2  LYS   7           HD2      LYS   7  61.380  -6.410  10.487
   53    HD3  LYS   7           HD1      LYS   7  59.635  -6.361  10.233
   54    HE2  LYS   7           HE2      LYS   7  59.234  -5.508  12.417
   55    HE3  LYS   7           HE1      LYS   7  60.865  -5.907  12.955
   56    HZ1  LYS   7           HZ1      LYS   7  61.552  -3.931  12.280
   57    HZ2  LYS   7           HZ2      LYS   7  59.969  -3.528  11.813
   58    HZ3  LYS   7           HZ3      LYS   7  61.030  -4.247  10.698
   59    H    ALA   8           HN       ALA   8  64.177  -9.511   9.214
   60    HA   ALA   8           HA       ALA   8  63.940  -7.245   7.666
   61    HB1  ALA   8           HB1      ALA   8  64.918  -8.579   5.768
   62    HB2  ALA   8           HB2      ALA   8  64.658 -10.037   6.726
   63    HB3  ALA   8           HB3      ALA   8  65.770  -8.793   7.298
   64    H    GLU   9           HN       GLU   9  62.686 -10.326   6.355
   65    HA   GLU   9           HA       GLU   9  60.031  -9.316   5.897
   66    HB2  GLU   9           HB2      GLU   9  62.076  -9.014   3.721
   67    HB3  GLU   9           HB1      GLU   9  60.446  -9.497   3.262
   68    HG2  GLU   9           HG2      GLU   9  59.910  -7.455   5.003
   69    HG3  GLU   9           HG1      GLU   9  61.421  -6.897   4.284
   70    H1U  RCY  10           H1U      RCY  10  56.062  -7.607   4.182
   71    H1S  RCY  10           H1S      RCY  10  56.668 -10.680   6.759
   72    HB1  RCY  10           HB1      RCY  10  57.452 -14.269   4.230
   73    HB2  RCY  10           HB2      RCY  10  57.186 -12.609   3.699
   74    HA   RCY  10           HA       RCY  10  59.655 -13.615   5.147
   75    HN1  RCY  10           HN1      RCY  10  58.777 -10.890   4.512
   76    H    ARG  11           HN       ARG  11  61.597 -13.236   3.622
   77    HA   ARG  11           HA       ARG  11  62.664 -13.670   1.576
   78    HE   ARG  11           HE       ARG  11  64.026 -17.499   3.850
   79    HB2  ARG  11           HB2      ARG  11  60.178 -15.342   1.096
   80    HB3  ARG  11           HB1      ARG  11  61.730 -15.520   0.279
   81    HG2  ARG  11           HG2      ARG  11  61.299 -15.843   3.264
   82    HG3  ARG  11           HG1      ARG  11  61.448 -17.174   2.116
   83    HD2  ARG  11           HD2      ARG  11  63.674 -15.848   1.453
   84    HD3  ARG  11           HD1      ARG  11  63.537 -15.294   3.122
   85   HH11  ARG  11          HH21      ARG  11  63.312 -17.324   0.481
   86   HH12  ARG  11          HH22      ARG  11  63.805 -18.952   0.156
   87   HH21  ARG  11          HH11      ARG  11  64.674 -19.626   3.445
   88   HH22  ARG  11          HH12      ARG  11  64.576 -20.256   1.834
   89    H    SER  12           HN       SER  12  61.413 -14.168  -0.977
   90    HA   SER  12           HA       SER  12  60.539 -12.976  -2.797
   91    HG   SER  12           HG       SER  12  57.475 -13.219  -1.185
   92    HB2  SER  12           HB2      SER  12  58.974 -11.252  -0.893
   93    HB3  SER  12           HB1      SER  12  58.509 -11.859  -2.479
   94    H    ALA  13           HN       ALA  13  59.826 -10.202  -2.906
   95    HA   ALA  13           HA       ALA  13  62.091  -8.685  -1.810
   96    HB1  ALA  13           HB1      ALA  13  61.766  -8.896  -4.815
   97    HB2  ALA  13           HB2      ALA  13  62.969  -9.804  -3.901
   98    HB3  ALA  13           HB3      ALA  13  63.035  -8.042  -3.937
   99    H    THR  14           HN       THR  14  59.030  -8.742  -2.000
  100    HA   THR  14           HA       THR  14  57.258  -7.255  -2.504
  101    HB   THR  14           HB       THR  14  58.155  -6.383  -0.392
  102    HG1  THR  14           HG1      THR  14  57.876  -3.998  -1.693
  103   HG21  THR  14          HG21      THR  14  59.790  -4.460  -0.522
  104   HG22  THR  14          HG22      THR  14  60.023  -4.859  -2.224
  105   HG23  THR  14          HG23      THR  14  60.463  -6.025  -0.976
  106    H    ARG  15           HN       ARG  15  58.680  -7.721  -4.824
  107    HA   ARG  15           HA       ARG  15  59.008  -6.829  -6.955
  108    HE   ARG  15           HE       ARG  15  55.194  -3.327  -6.055
  109    HB2  ARG  15           HB2      ARG  15  57.641  -4.317  -5.982
  110    HB3  ARG  15           HB1      ARG  15  57.649  -5.002  -7.607
  111    HG2  ARG  15           HG2      ARG  15  56.443  -7.022  -6.627
  112    HG3  ARG  15           HG1      ARG  15  56.223  -6.068  -5.160
  113    HD2  ARG  15           HD2      ARG  15  55.025  -5.670  -7.878
  114    HD3  ARG  15           HD1      ARG  15  54.262  -5.553  -6.292
  115   HH11  ARG  15          HH21      ARG  15  55.893  -4.943  -9.019
  116   HH12  ARG  15          HH22      ARG  15  56.373  -3.500  -9.847
  117   HH21  ARG  15          HH11      ARG  15  55.818  -1.433  -7.119
  118   HH22  ARG  15          HH12      ARG  15  56.331  -1.512  -8.771
  119    H    VAL  16           HN       VAL  16  60.283  -5.151  -8.098
  120    HA   VAL  16           HA       VAL  16  61.768  -3.217  -6.464
  121    HB   VAL  16           HB       VAL  16  63.007  -5.334  -6.066
  122   HG11  VAL  16          HG11      VAL  16  63.577  -5.307  -9.038
  123   HG12  VAL  16          HG12      VAL  16  62.321  -6.313  -8.317
  124   HG13  VAL  16          HG13      VAL  16  64.009  -6.554  -7.869
  125   HG21  VAL  16          HG21      VAL  16  65.223  -4.504  -6.790
  126   HG22  VAL  16          HG22      VAL  16  64.233  -3.192  -6.149
  127   HG23  VAL  16          HG23      VAL  16  64.436  -3.373  -7.891
  128    H    MET  17           HN       MET  17  61.051  -4.739  -9.536
  129    HA   MET  17           HA       MET  17  62.556  -2.822 -11.129
  130    HB2  MET  17           HB2      MET  17  61.899  -5.167 -11.862
  131    HB3  MET  17           HB1      MET  17  60.252  -4.564 -12.041
  132    HG2  MET  17           HG2      MET  17  61.300  -2.708 -13.509
  133    HG3  MET  17           HG1      MET  17  62.722  -3.750 -13.571
  134    HE1  MET  17           HE1      MET  17  60.912  -6.689 -13.344
  135    HE2  MET  17           HE2      MET  17  62.528  -6.231 -13.879
  136    HE3  MET  17           HE3      MET  17  61.432  -7.039 -14.997
  137    H    GLY  18           HN       GLY  18  61.833  -0.738 -10.517
  138    HA2  GLY  18           HA2      GLY  18  58.977  -0.102 -10.519
  139    HA3  GLY  18           HA1      GLY  18  60.294   1.049 -10.286
  140    H    GLY  19           HN       GLY  19  58.631  -0.860 -12.792
  141    HA2  GLY  19           HA2      GLY  19  58.159  -0.290 -15.023
  142    HA3  GLY  19           HA1      GLY  19  58.615   1.368 -14.627
  143    HA   PRO  20           HA       PRO  20  61.738  -0.585 -17.593
  144    HB2  PRO  20           HB2      PRO  20  61.584   2.217 -18.607
  145    HB3  PRO  20           HB1      PRO  20  61.600   0.690 -19.510
  146    HG2  PRO  20           HG2      PRO  20  59.371   2.125 -19.213
  147    HG3  PRO  20           HG1      PRO  20  59.348   0.353 -19.243
  148    HD2  PRO  20           HD2      PRO  20  59.028   2.202 -16.915
  149    HD3  PRO  20           HD1      PRO  20  58.311   0.599 -17.192
  150    H1U  RCY  21           H1U      RCY  21  63.800   3.796 -11.708
  151    H1S  RCY  21           H1S      RCY  21  67.269   1.657 -13.614
  152    HB1  RCY  21           HB1      RCY  21  66.910   1.937 -17.435
  153    HB2  RCY  21           HB2      RCY  21  65.826   0.587 -17.764
  154    HA   RCY  21           HA       RCY  21  64.713   2.422 -15.780
  155    HN1  RCY  21           HN1      RCY  21  63.536   1.653 -18.412
  156    H    THR  22           HN       THR  22  64.214   4.603 -16.037
  157    HA   THR  22           HA       THR  22  65.030   5.951 -18.551
  158    HB   THR  22           HB       THR  22  63.621   7.713 -17.924
  159    HG1  THR  22           HG1      THR  22  64.202   6.813 -15.329
  160   HG21  THR  22          HG21      THR  22  62.426   5.484 -18.198
  161   HG22  THR  22          HG22      THR  22  61.539   6.712 -17.294
  162   HG23  THR  22          HG23      THR  22  62.354   5.404 -16.437
  163    HA   PRO  23           HA       PRO  23  69.047   6.872 -16.706
  164    HB2  PRO  23           HB2      PRO  23  68.662   9.267 -18.479
  165    HB3  PRO  23           HB1      PRO  23  70.099   8.245 -18.266
  166    HG2  PRO  23           HG2      PRO  23  68.492   7.979 -20.380
  167    HG3  PRO  23           HG1      PRO  23  69.277   6.582 -19.626
  168    HD2  PRO  23           HD2      PRO  23  66.416   7.367 -19.579
  169    HD3  PRO  23           HD1      PRO  23  67.151   5.768 -19.333
  170    H    ARG  24           HN       ARG  24  69.926   8.550 -15.282
  171    HA   ARG  24           HA       ARG  24  69.701  10.092 -13.528
  172    HE   ARG  24           HE       ARG  24  69.215  14.773 -12.628
  173    HB2  ARG  24           HB2      ARG  24  69.193  11.499 -15.670
  174    HB3  ARG  24           HB1      ARG  24  67.516  11.420 -15.129
  175    HG2  ARG  24           HG2      ARG  24  68.118  12.419 -12.985
  176    HG3  ARG  24           HG1      ARG  24  69.825  12.408 -13.428
  177    HD2  ARG  24           HD2      ARG  24  69.423  13.977 -15.238
  178    HD3  ARG  24           HD1      ARG  24  67.682  13.900 -14.968
  179   HH11  ARG  24          HH21      ARG  24  67.569  15.609 -15.540
  180   HH12  ARG  24          HH22      ARG  24  67.251  17.239 -15.049
  181   HH21  ARG  24          HH11      ARG  24  68.809  16.897 -11.970
  182   HH22  ARG  24          HH12      ARG  24  67.952  17.968 -13.028
  183    H    LYS  25           HN       LYS  25  67.990  11.006 -11.952
  184    HA   LYS  25           HA       LYS  25  65.465   9.461 -11.942
  185    HB2  LYS  25           HB2      LYS  25  66.255   9.182  -9.304
  186    HB3  LYS  25           HB1      LYS  25  66.343   7.916 -10.524
  187    HG2  LYS  25           HG2      LYS  25  68.526   8.113  -9.484
  188    HG3  LYS  25           HG1      LYS  25  68.641   8.744 -11.127
  189    HD2  LYS  25           HD2      LYS  25  68.717  10.975 -10.403
  190    HD3  LYS  25           HD1      LYS  25  68.004  10.590  -8.836
  191    HE2  LYS  25           HE2      LYS  25  70.395  11.032  -8.562
  192    HE3  LYS  25           HE1      LYS  25  70.066   9.329  -8.240
  193    HZ1  LYS  25           HZ1      LYS  25  70.580   9.782 -10.999
  194    HZ2  LYS  25           HZ2      LYS  25  71.358   8.727  -9.918
  195    HZ3  LYS  25           HZ3      LYS  25  71.868  10.342 -10.048
  196    H    GLY  26           HN       GLY  26  67.413  12.137 -10.888
  197    HA2  GLY  26           HA2      GLY  26  65.707  14.158 -10.700
  198    HA3  GLY  26           HA1      GLY  26  65.167  13.250  -9.287
  199    HA   PRO  27           HA       PRO  27  68.045  15.033  -6.500
  200    HB2  PRO  27           HB2      PRO  27  69.534  12.591  -5.975
  201    HB3  PRO  27           HB1      PRO  27  68.375  13.425  -4.929
  202    HG2  PRO  27           HG2      PRO  27  67.998  11.083  -6.598
  203    HG3  PRO  27           HG1      PRO  27  66.967  11.726  -5.313
  204    HD2  PRO  27           HD2      PRO  27  66.289  11.775  -7.982
  205    HD3  PRO  27           HD1      PRO  27  65.666  12.934  -6.785
  206    HA   PRO  28           HA       PRO  28  71.945  16.207  -8.191
  207    HB2  PRO  28           HB2      PRO  28  73.294  14.474  -6.138
  208    HB3  PRO  28           HB1      PRO  28  73.676  16.137  -6.630
  209    HG2  PRO  28           HG2      PRO  28  72.322  15.612  -4.391
  210    HG3  PRO  28           HG1      PRO  28  71.972  17.038  -5.381
  211    HD2  PRO  28           HD2      PRO  28  70.348  14.593  -4.997
  212    HD3  PRO  28           HD1      PRO  28  69.844  16.204  -5.552
  213    H    LYS  29           HN       LYS  29  73.232  15.452  -9.865
  214    HA   LYS  29           HA       LYS  29  73.060  12.549 -10.467
  215    HB2  LYS  29           HB2      LYS  29  74.123  13.403 -12.686
  216    HB3  LYS  29           HB1      LYS  29  72.439  13.809 -12.357
  217    HG2  LYS  29           HG2      LYS  29  73.082  16.009 -11.531
  218    HG3  LYS  29           HG1      LYS  29  74.791  15.609 -11.709
  219    HD2  LYS  29           HD2      LYS  29  74.598  15.486 -14.102
  220    HD3  LYS  29           HD1      LYS  29  72.839  15.586 -14.023
  221    HE2  LYS  29           HE2      LYS  29  74.800  17.761 -13.237
  222    HE3  LYS  29           HE1      LYS  29  73.732  17.769 -14.640
  223    HZ1  LYS  29           HZ1      LYS  29  73.145  18.347 -11.880
  224    HZ2  LYS  29           HZ2      LYS  29  72.026  17.298 -12.611
  225    HZ3  LYS  29           HZ3      LYS  29  72.328  18.828 -13.286
  226    H1U  RCY  30           H1U      RCY  30  80.604   9.446  -4.730
  227    H1S  RCY  30           H1S      RCY  30  78.537  10.960  -7.949
  228    HB1  RCY  30           HB1      RCY  30  78.338  10.617  -9.794
  229    HB2  RCY  30           HB2      RCY  30  76.921   9.946 -10.602
  230    HA   RCY  30           HA       RCY  30  77.632  12.883 -10.341
  231    HN1  RCY  30           HN1      RCY  30  75.244  11.932 -11.828
  232    H    LYS  31           HN       LYS  31  79.666  12.019 -11.401
  233    HA   LYS  31           HA       LYS  31  79.526  10.809 -14.017
  234    HB2  LYS  31           HB2      LYS  31  80.184  12.772 -15.352
  235    HB3  LYS  31           HB1      LYS  31  78.612  13.034 -14.597
  236    HG2  LYS  31           HG2      LYS  31  80.007  14.104 -12.658
  237    HG3  LYS  31           HG1      LYS  31  81.274  14.237 -13.878
  238    HD2  LYS  31           HD2      LYS  31  78.455  15.319 -14.171
  239    HD3  LYS  31           HD1      LYS  31  79.876  16.287 -13.777
  240    HE2  LYS  31           HE2      LYS  31  79.373  14.732 -16.327
  241    HE3  LYS  31           HE1      LYS  31  79.512  16.482 -16.153
  242    HZ1  LYS  31           HZ1      LYS  31  81.811  16.098 -15.334
  243    HZ2  LYS  31           HZ2      LYS  31  81.574  15.657 -16.957
  244    HZ3  LYS  31           HZ3      LYS  31  81.648  14.462 -15.752
  245    H    GLN  32           HN       GLN  32  81.113  11.608 -11.276
  246    HA   GLN  32           HA       GLN  32  83.815  11.913 -12.378
  247    HB2  GLN  32           HB2      GLN  32  82.859  11.411  -9.541
  248    HB3  GLN  32           HB1      GLN  32  84.519  11.792 -10.000
  249    HG2  GLN  32           HG2      GLN  32  83.892  13.966 -10.797
  250    HG3  GLN  32           HG1      GLN  32  82.174  13.582 -10.678
  251   HE21  GLN  32          HE21      GLN  32  82.813  15.815  -9.296
  252   HE22  GLN  32          HE22      GLN  32  82.933  15.521  -7.629
  253    H    ARG  33           HN       ARG  33  85.037  10.140 -10.347
  254    HA   ARG  33           HA       ARG  33  84.209   7.445 -11.303
  255    HE   ARG  33           HE       ARG  33  88.547   6.619 -13.356
  256    HB2  ARG  33           HB2      ARG  33  87.023   8.566 -11.441
  257    HB3  ARG  33           HB1      ARG  33  86.601   6.876 -11.721
  258    HG2  ARG  33           HG2      ARG  33  85.149   7.532 -13.594
  259    HG3  ARG  33           HG1      ARG  33  85.531   9.230 -13.307
  260    HD2  ARG  33           HD2      ARG  33  86.897   8.222 -15.145
  261    HD3  ARG  33           HD1      ARG  33  87.879   8.838 -13.816
  262   HH11  ARG  33          HH21      ARG  33  85.756   6.756 -15.374
  263   HH12  ARG  33          HH22      ARG  33  85.739   5.053 -15.693
  264   HH21  ARG  33          HH11      ARG  33  88.542   4.395 -13.760
  265   HH22  ARG  33          HH12      ARG  33  87.317   3.717 -14.779
  266    H    GLN  34           HN       GLN  34  87.104   8.488  -9.569
  267    HA   GLN  34           HA       GLN  34  87.857   7.983  -7.406
  268    HB2  GLN  34           HB2      GLN  34  85.630   9.202  -6.918
  269    HB3  GLN  34           HB1      GLN  34  84.964   7.594  -6.632
  270    HG2  GLN  34           HG2      GLN  34  86.922   7.220  -5.030
  271    HG3  GLN  34           HG1      GLN  34  87.225   8.954  -5.154
  272   HE21  GLN  34          HE21      GLN  34  84.968   6.528  -3.915
  273   HE22  GLN  34          HE22      GLN  34  84.034   7.606  -2.996
  274    H    THR  35           HN       THR  35  88.817   5.980  -7.939
  275    HA   THR  35           HA       THR  35  87.669   3.661  -6.659
  276    HB   THR  35           HB       THR  35  86.294   3.242  -8.493
  277    HG1  THR  35           HG1      THR  35  87.268   1.392  -8.661
  278   HG21  THR  35          HG21      THR  35  88.494   4.524 -10.115
  279   HG22  THR  35          HG22      THR  35  86.831   5.073  -9.905
  280   HG23  THR  35          HG23      THR  35  87.170   3.639 -10.873
  281    H    ARG  36           HN       ARG  36  89.884   4.134  -5.785
  282    HA   ARG  36           HA       ARG  36  91.818   2.320  -6.915
  283    HE   ARG  36           HE       ARG  36  96.288   3.962  -9.442
  284    HB2  ARG  36           HB2      ARG  36  91.824   4.784  -8.162
  285    HB3  ARG  36           HB1      ARG  36  93.043   5.011  -6.911
  286    HG2  ARG  36           HG2      ARG  36  94.266   3.053  -7.670
  287    HG3  ARG  36           HG1      ARG  36  92.994   2.660  -8.828
  288    HD2  ARG  36           HD2      ARG  36  93.499   4.518 -10.195
  289    HD3  ARG  36           HD1      ARG  36  94.407   5.323  -8.915
  290   HH11  ARG  36          HH21      ARG  36  93.396   2.982 -11.043
  291   HH12  ARG  36          HH22      ARG  36  94.203   1.887 -12.116
  292   HH21  ARG  36          HH11      ARG  36  97.358   2.539 -10.833
  293   HH22  ARG  36          HH12      ARG  36  96.447   1.636 -11.997
  294    H    GLN  37           HN       GLN  37  90.422   3.572  -4.394
  295    HA   GLN  37           HA       GLN  37  92.828   3.274  -2.664
  296    HB2  GLN  37           HB2      GLN  37  90.800   5.461  -2.166
  297    HB3  GLN  37           HB1      GLN  37  92.388   5.256  -1.425
  298    HG2  GLN  37           HG2      GLN  37  92.729   6.958  -3.031
  299    HG3  GLN  37           HG1      GLN  37  93.322   5.499  -3.827
  300   HE21  GLN  37          HE21      GLN  37  92.698   7.222  -5.708
  301   HE22  GLN  37          HE22      GLN  37  91.149   6.995  -6.364
  302    H1U  RCY  38           H1U      RCY  38  83.420   4.044   1.398
  303    H1S  RCY  38           H1S      RCY  38  86.961   5.502   0.110
  304    HB1  RCY  38           HB1      RCY  38  88.790   3.270   1.607
  305    HB2  RCY  38           HB2      RCY  38  88.037   2.336   0.317
  306    HA   RCY  38           HA       RCY  38  90.689   2.091   1.320
  307    HN1  RCY  38           HN1      RCY  38  91.804   3.494  -0.220
  308    H    LYS  39           HN       LYS  39  91.454   0.012   0.721
  309    HA   LYS  39           HA       LYS  39  89.396  -1.737  -0.422
  310    HB2  LYS  39           HB2      LYS  39  91.664  -0.795  -2.009
  311    HB3  LYS  39           HB1      LYS  39  91.655  -2.553  -1.874
  312    HG2  LYS  39           HG2      LYS  39  89.417  -2.690  -2.746
  313    HG3  LYS  39           HG1      LYS  39  89.208  -0.941  -2.643
  314    HD2  LYS  39           HD2      LYS  39  91.522  -1.897  -4.245
  315    HD3  LYS  39           HD1      LYS  39  89.923  -2.190  -4.928
  316    HE2  LYS  39           HE2      LYS  39  90.730  -0.020  -5.694
  317    HE3  LYS  39           HE1      LYS  39  89.380   0.224  -4.587
  318    HZ1  LYS  39           HZ1      LYS  39  91.335   1.679  -4.172
  319    HZ2  LYS  39           HZ2      LYS  39  92.224   0.294  -3.751
  320    HZ3  LYS  39           HZ3      LYS  39  90.869   0.748  -2.833
  321    H    SER  40           HN       SER  40  92.154  -1.119   1.464
  322    HA   SER  40           HA       SER  40  92.139  -3.945   2.416
  323    HG   SER  40           HG       SER  40  94.215  -1.594   0.871
  324    HB2  SER  40           HB2      SER  40  94.664  -3.757   2.642
  325    HB3  SER  40           HB1      SER  40  94.069  -3.879   0.989
  326    H    LYS  41           HN       LYS  41  91.317  -1.048   3.279
  327    HA   LYS  41           HA       LYS  41  92.448  -1.300   6.033
  328    HB2  LYS  41           HB2      LYS  41  92.522   1.179   6.166
  329    HB3  LYS  41           HB1      LYS  41  93.607   0.547   4.929
  330    HG2  LYS  41           HG2      LYS  41  91.546   0.876   3.337
  331    HG3  LYS  41           HG1      LYS  41  90.989   1.986   4.589
  332    HD2  LYS  41           HD2      LYS  41  92.253   3.287   3.006
  333    HD3  LYS  41           HD1      LYS  41  93.249   3.120   4.452
  334    HE2  LYS  41           HE2      LYS  41  93.584   0.957   2.469
  335    HE3  LYS  41           HE1      LYS  41  94.116   2.547   1.922
  336    HZ1  LYS  41           HZ1      LYS  41  95.549   0.860   3.483
  337    HZ2  LYS  41           HZ2      LYS  41  94.905   1.949   4.616
  338    HZ3  LYS  41           HZ3      LYS  41  95.835   2.523   3.316
  339    HA   PRO  42           HA       PRO  42  87.933  -1.124   6.495
  340    HB2  PRO  42           HB2      PRO  42  87.778  -2.417   8.869
  341    HB3  PRO  42           HB1      PRO  42  88.083  -3.277   7.346
  342    HG2  PRO  42           HG2      PRO  42  89.989  -2.513   9.493
  343    HG3  PRO  42           HG1      PRO  42  89.936  -3.975   8.496
  344    HD2  PRO  42           HD2      PRO  42  91.633  -1.806   8.048
  345    HD3  PRO  42           HD1      PRO  42  91.195  -3.024   6.830
  346    HA   PRO  43           HA       PRO  43  87.530   2.374   9.200
  347    HB2  PRO  43           HB2      PRO  43  84.925   2.184   9.978
  348    HB3  PRO  43           HB1      PRO  43  85.401   2.615   8.323
  349    HG2  PRO  43           HG2      PRO  43  84.479  -0.005   9.395
  350    HG3  PRO  43           HG1      PRO  43  84.087   0.789   7.860
  351    HD2  PRO  43           HD2      PRO  43  85.940  -1.230   8.081
  352    HD3  PRO  43           HD1      PRO  43  86.005   0.024   6.822
  353    H    LYS  44           HN       LYS  44  87.072   3.024  11.476
  354    HA   LYS  44           HA       LYS  44  88.208   1.300  13.396
  355    HB2  LYS  44           HB2      LYS  44  86.221   3.546  13.854
  356    HB3  LYS  44           HB1      LYS  44  87.268   2.841  15.084
  357    HG2  LYS  44           HG2      LYS  44  89.228   3.453  13.546
  358    HG3  LYS  44           HG1      LYS  44  88.074   4.443  12.652
  359    HD2  LYS  44           HD2      LYS  44  88.844   6.011  14.172
  360    HD3  LYS  44           HD1      LYS  44  87.491   5.343  15.086
  361    HE2  LYS  44           HE2      LYS  44  89.407   5.393  16.555
  362    HE3  LYS  44           HE1      LYS  44  89.107   3.709  16.127
  363    HZ1  LYS  44           HZ1      LYS  44  91.323   5.438  15.409
  364    HZ2  LYS  44           HZ2      LYS  44  90.742   4.440  14.162
  365    HZ3  LYS  44           HZ3      LYS  44  91.282   3.756  15.621
  366    H    LYS  45           HN       LYS  45  84.749   2.066  12.940
  367    HA   LYS  45           HA       LYS  45  82.980   0.423  12.990
  368    HB2  LYS  45           HB2      LYS  45  84.668  -1.452  13.151
  369    HB3  LYS  45           HB1      LYS  45  84.730  -1.163  14.890
  370    HG2  LYS  45           HG2      LYS  45  83.140  -2.944  14.482
  371    HG3  LYS  45           HG1      LYS  45  82.240  -1.506  14.967
  372    HD2  LYS  45           HD2      LYS  45  81.442  -1.113  12.810
  373    HD3  LYS  45           HD1      LYS  45  82.758  -2.010  12.051
  374    HE2  LYS  45           HE2      LYS  45  80.616  -3.301  13.761
  375    HE3  LYS  45           HE1      LYS  45  80.538  -3.207  12.002
  376    HZ1  LYS  45           HZ1      LYS  45  83.012  -4.171  12.408
  377    HZ2  LYS  45           HZ2      LYS  45  81.646  -5.130  12.087
  378    HZ3  LYS  45           HZ3      LYS  45  82.164  -4.894  13.688
  379    H    GLY  46           HN       GLY  46  81.253   0.706  14.359
  380    HA2  GLY  46           HA2      GLY  46  80.254   0.921  16.570
  381    HA3  GLY  46           HA1      GLY  46  81.812   1.477  17.184
  382    H    VAL  47           HN       VAL  47  78.785   2.508  16.353
  383    HA   VAL  47           HA       VAL  47  78.002   4.581  15.368
  384    HB   VAL  47           HB       VAL  47  78.003   6.168  17.178
  385   HG11  VAL  47          HG11      VAL  47  76.814   3.998  17.546
  386   HG12  VAL  47          HG12      VAL  47  77.360   4.743  19.048
  387   HG13  VAL  47          HG13      VAL  47  78.253   3.386  18.362
  388   HG21  VAL  47          HG21      VAL  47  80.079   6.583  18.022
  389   HG22  VAL  47          HG22      VAL  47  80.640   4.942  17.697
  390   HG23  VAL  47          HG23      VAL  47  79.693   5.280  19.147
  391    H    GLN  48           HN       GLN  48  79.918   4.322  13.653
  392    HA   GLN  48           HA       GLN  48  82.290   5.770  13.733
  393    HB2  GLN  48           HB2      GLN  48  81.645   4.463  11.772
  394    HB3  GLN  48           HB1      GLN  48  80.321   5.578  11.432
  395    HG2  GLN  48           HG2      GLN  48  81.841   7.371  10.945
  396    HG3  GLN  48           HG1      GLN  48  83.216   6.453  11.559
  397   HE21  GLN  48          HE21      GLN  48  84.420   5.418   9.966
  398   HE22  GLN  48          HE22      GLN  48  83.834   4.968   8.438
  399    H    GLY  49           HN       GLY  49  79.712   7.280  11.848
  400    HA2  GLY  49           HA2      GLY  49  78.785   9.428  13.111
  401    HA3  GLY  49           HA1      GLY  49  80.484   9.896  13.019
  402    H1U  RCY  50           H1U      RCY  50  83.987   7.502   4.230
  403    H1S  RCY  50           H1S      RCY  50  80.413  10.143   5.785
  404    HB1  RCY  50           HB1      RCY  50  79.035   9.063   7.271
  405    HB2  RCY  50           HB2      RCY  50  79.985   8.734   8.719
  406    HA   RCY  50           HA       RCY  50  78.030  10.904   9.071
  407    HN1  RCY  50           HN1      RCY  50  77.812   8.776  10.927
  408    H    GLY  51           HN       GLY  51  77.107   7.653   9.861
  409    HA2  GLY  51           HA2      GLY  51  74.964   7.762   7.774
  410    HA3  GLY  51           HA1      GLY  51  75.626   6.259   8.419
  411    H    ASP  52           HN       ASP  52  74.860   9.067  10.412
  412    HA   ASP  52           HA       ASP  52  72.247   8.155  11.223
  413    HB2  ASP  52           HB2      ASP  52  73.852   6.409  12.229
  414    HB3  ASP  52           HB1      ASP  52  74.395   7.701  13.300
  415    H    ASP  53           HN       ASP  53  73.707  10.629  10.533
  416    HA   ASP  53           HA       ASP  53  72.718  12.266  12.764
  417    HB2  ASP  53           HB2      ASP  53  75.130  11.613  13.317
  418    HB3  ASP  53           HB1      ASP  53  75.607  12.586  11.925
  419    H    ILE  54           HN       ILE  54  75.133  12.973  10.240
  420    HA   ILE  54           HA       ILE  54  73.076  14.650   8.852
  421    HB   ILE  54           HB       ILE  54  75.982  15.382   9.324
  422   HG12  ILE  54          HG12      ILE  54  73.514  16.738  10.433
  423   HG13  ILE  54          HG11      ILE  54  74.379  15.484  11.323
  424   HG21  ILE  54          HG21      ILE  54  73.684  16.735   7.896
  425   HG22  ILE  54          HG22      ILE  54  75.270  16.320   7.246
  426   HG23  ILE  54          HG23      ILE  54  75.115  17.616   8.432
  427   HD11  ILE  54          HD11      ILE  54  76.372  16.789  11.423
  428   HD12  ILE  54          HD12      ILE  54  75.064  17.900  11.827
  429   HD13  ILE  54          HD13      ILE  54  75.776  17.925  10.213
  430    HA   PRO  55           HA       PRO  55  75.215  11.877   5.844
  431    HB2  PRO  55           HB2      PRO  55  73.043  10.618   4.862
  432    HB3  PRO  55           HB1      PRO  55  73.769  10.148   6.412
  433    HG2  PRO  55           HG2      PRO  55  71.320  11.740   5.884
  434    HG3  PRO  55           HG1      PRO  55  71.650  10.564   7.165
  435    HD2  PRO  55           HD2      PRO  55  71.793  13.352   7.446
  436    HD3  PRO  55           HD1      PRO  55  72.509  12.165   8.557
  437    H    GLY  56           HN       GLY  56  75.784  12.928   3.983
  438    HA2  GLY  56           HA2      GLY  56  75.628  14.394   2.144
  439    HA3  GLY  56           HA1      GLY  56  74.162  13.475   1.800
  440    H    MET  57           HN       MET  57  74.505  15.371   4.730
  441    HA   MET  57           HA       MET  57  73.208  17.164   5.516
  442    HB2  MET  57           HB2      MET  57  73.445  18.046   2.622
  443    HB3  MET  57           HB1      MET  57  73.048  19.080   3.995
  444    HG2  MET  57           HG2      MET  57  75.594  17.464   3.954
  445    HG3  MET  57           HG1      MET  57  75.511  19.049   3.185
  446    HE1  MET  57           HE1      MET  57  75.242  21.591   5.842
  447    HE2  MET  57           HE2      MET  57  74.245  21.074   4.485
  448    HE3  MET  57           HE3      MET  57  75.998  21.129   4.312
  449    H    GLU  58           HN       GLU  58  71.711  14.879   4.835
  450    HA   GLU  58           HA       GLU  58  69.517  14.211   4.345
  451    HB2  GLU  58           HB2      GLU  58  69.260  16.284   5.947
  452    HB3  GLU  58           HB1      GLU  58  68.682  17.099   4.493
  453    HG2  GLU  58           HG2      GLU  58  67.563  14.527   5.650
  454    HG3  GLU  58           HG1      GLU  58  66.795  16.114   5.722
  455    H    GLY  59           HN       GLY  59  69.543  13.573   2.202
  456    HA2  GLY  59           HA2      GLY  59  68.075  14.561   0.197
  457    HA3  GLY  59           HA1      GLY  59  69.469  15.637   0.078
  458    H1U  RCY  60           H1U      RCY  60  75.074   6.619   1.478
  459    H1S  RCY  60           H1S      RCY  60  75.053   9.529  -1.341
  460    HB1  RCY  60           HB1      RCY  60  71.936  11.803  -0.158
  461    HB2  RCY  60           HB2      RCY  60  73.357  12.751  -0.597
  462    HA   RCY  60           HA       RCY  60  72.327  13.515  -2.623
  463    HN1  RCY  60           HN1      RCY  60  71.153  14.935  -1.155
  464    H    GLY  61           HN       GLY  61  70.754  10.717  -1.252
  465    HA2  GLY  61           HA2      GLY  61  68.818  10.582  -3.493
  466    HA3  GLY  61           HA1      GLY  61  70.026   9.299  -3.395
  467    H    THR  62           HN       THR  62  67.875  10.991  -1.076
  468    HA   THR  62           HA       THR  62  67.639   8.908   0.790
  469    HB   THR  62           HB       THR  62  66.667  10.961   1.424
  470    HG1  THR  62           HG1      THR  62  64.905  10.132   2.191
  471   HG21  THR  62          HG21      THR  62  64.723  11.895  -0.008
  472   HG22  THR  62          HG22      THR  62  65.321  10.818  -1.269
  473   HG23  THR  62          HG23      THR  62  66.363  12.087  -0.626
  474    H    ASP  63           HN       ASP  63  67.536   6.886  -0.352
  475    HA   ASP  63           HA       ASP  63  65.473   6.335  -2.294
  476    HB2  ASP  63           HB2      ASP  63  67.748   5.062  -1.682
  477    HB3  ASP  63           HB1      ASP  63  66.653   4.113  -0.679
  478    H    ILE  64           HN       ILE  64  65.668   6.084   1.221
  479    HA   ILE  64           HA       ILE  64  62.850   5.098   1.211
  480    HB   ILE  64           HB       ILE  64  65.081   3.986   2.524
  481   HG12  ILE  64          HG12      ILE  64  62.124   3.606   3.102
  482   HG13  ILE  64          HG11      ILE  64  63.000   2.837   1.778
  483   HG21  ILE  64          HG21      ILE  64  64.926   5.744   4.228
  484   HG22  ILE  64          HG22      ILE  64  64.430   4.197   4.913
  485   HG23  ILE  64          HG23      ILE  64  63.214   5.391   4.460
  486   HD11  ILE  64          HD11      ILE  64  64.338   2.484   4.355
  487   HD12  ILE  64          HD12      ILE  64  63.897   1.277   3.147
  488   HD13  ILE  64          HD13      ILE  64  62.711   1.805   4.341
  489    H    THR  65           HN       THR  65  65.136   7.166   2.972
  490    HA   THR  65           HA       THR  65  63.287   9.366   3.147
  491    HB   THR  65           HB       THR  65  63.646   7.626   5.610
  492    HG1  THR  65           HG1      THR  65  61.320   8.678   4.384
  493   HG21  THR  65          HG21      THR  65  63.910   9.747   6.532
  494   HG22  THR  65          HG22      THR  65  62.156   9.570   6.579
  495   HG23  THR  65          HG23      THR  65  62.912  10.518   5.299
  496    H    VAL  66           HN       VAL  66  66.195   8.000   3.164
  497    HA   VAL  66           HA       VAL  66  67.909  10.080   3.158
  498    HB   VAL  66           HB       VAL  66  66.994   9.607   5.977
  499   HG11  VAL  66          HG11      VAL  66  69.277  10.576   6.705
  500   HG12  VAL  66          HG12      VAL  66  69.864  10.020   5.137
  501   HG13  VAL  66          HG13      VAL  66  69.217   8.861   6.299
  502   HG21  VAL  66          HG21      VAL  66  66.813  11.880   5.983
  503   HG22  VAL  66          HG22      VAL  66  66.925  11.722   4.230
  504   HG23  VAL  66          HG23      VAL  66  68.366  12.097   5.175
  505    H    ILE  67           HN       ILE  67  67.820   7.367   5.493
  506    HA   ILE  67           HA       ILE  67  69.833   5.964   3.803
  507    HB   ILE  67           HB       ILE  67  70.065   6.599   6.749
  508   HG12  ILE  67          HG12      ILE  67  72.107   6.684   4.510
  509   HG13  ILE  67          HG11      ILE  67  71.109   8.066   4.962
  510   HG21  ILE  67          HG21      ILE  67  71.233   4.304   5.176
  511   HG22  ILE  67          HG22      ILE  67  70.452   4.268   6.757
  512   HG23  ILE  67          HG23      ILE  67  72.065   4.960   6.586
  513   HD11  ILE  67          HD11      ILE  67  72.092   8.226   7.105
  514   HD12  ILE  67          HD12      ILE  67  73.455   7.887   6.038
  515   HD13  ILE  67          HD13      ILE  67  72.757   6.595   7.016
  516    H1U  RCY  68           H1U      RCY  68  72.897   3.637   3.251
  517    H1S  RCY  68           H1S      RCY  68  69.182   1.717   1.852
  518    HB1  RCY  68           HB1      RCY  68  66.024   1.933   2.940
  519    HB2  RCY  68           HB2      RCY  68  67.638   1.233   2.917
  520    HA   RCY  68           HA       RCY  68  66.469   3.119   4.814
  521    HN1  RCY  68           HN1      RCY  68  68.463   4.304   3.168
  522    HA   PRO  69           HA       PRO  69  69.356   0.935   7.476
  523    HB2  PRO  69           HB2      PRO  69  67.524  -0.242   9.118
  524    HB3  PRO  69           HB1      PRO  69  67.955   1.475   9.228
  525    HG2  PRO  69           HG2      PRO  69  65.572   0.205   7.984
  526    HG3  PRO  69           HG1      PRO  69  65.698   1.710   8.909
  527    HD2  PRO  69           HD2      PRO  69  65.547   1.612   6.153
  528    HD3  PRO  69           HD1      PRO  69  66.290   2.950   7.058
  529    H    TRP  70           HN       TRP  70  67.235  -0.453   5.238
  530    HA   TRP  70           HA       TRP  70  67.665  -3.229   6.053
  531    HD1  TRP  70           HD1      TRP  70  67.717  -5.011   3.054
  532    HE1  TRP  70           HE1      TRP  70  68.148  -4.694   0.533
  533    HE3  TRP  70           HE3      TRP  70  65.848  -0.301   2.425
  534    HZ2  TRP  70           HZ2      TRP  70  67.752  -2.702  -1.488
  535    HZ3  TRP  70           HZ3      TRP  70  65.886   0.780   0.199
  536    HH2  TRP  70           HH2      TRP  70  66.834  -0.410  -1.757
  537    HB2  TRP  70           HB2      TRP  70  65.913  -3.611   4.686
  538    HB3  TRP  70           HB1      TRP  70  65.853  -1.883   4.368
  539    H    GLU  71           HN       GLU  71  69.656  -0.946   4.688
  540    HA   GLU  71           HA       GLU  71  71.352  -3.100   3.489
  541    HB2  GLU  71           HB2      GLU  71  71.284  -0.332   2.305
  542    HB3  GLU  71           HB1      GLU  71  71.866  -1.829   1.580
  543    HG2  GLU  71           HG2      GLU  71  69.453  -2.667   1.724
  544    HG3  GLU  71           HG1      GLU  71  69.003  -0.999   2.081
  545    H    ALA  72           HN       ALA  72  71.037  -0.486   5.623
  546    HA   ALA  72           HA       ALA  72  73.617   0.679   5.604
  547    HB1  ALA  72           HB1      ALA  72  73.181   1.073   8.078
  548    HB2  ALA  72           HB2      ALA  72  71.693   0.146   7.881
  549    HB3  ALA  72           HB3      ALA  72  71.917   1.653   6.994
  550    H1U  RCY  73           H1U      RCY  73  74.826   1.650   4.055
  551    H1S  RCY  73           H1S      RCY  73  75.119   1.392   8.150
  552    HB1  RCY  73           HB1      RCY  73  77.757  -0.788   7.826
  553    HB2  RCY  73           HB2      RCY  73  77.651  -1.669   9.348
  554    HA   RCY  73           HA       RCY  73  76.104  -2.438   7.428
  555    HN1  RCY  73           HN1      RCY  73  75.010   0.245   7.839
  556    H    ASN  74           HN       ASN  74  73.400  -2.358   8.454
  557    HA   ASN  74           HA       ASN  74  73.125  -2.668  11.230
  558    HB2  ASN  74           HB2      ASN  74  71.211  -2.709   9.691
  559    HB3  ASN  74           HB1      ASN  74  71.760  -4.249   9.030
  560   HD21  ASN  74          HD21      ASN  74  69.617  -5.129   9.809
  561   HD22  ASN  74          HD22      ASN  74  69.453  -5.561  11.443
  562    H    HIS  75           HN       HIS  75  74.497  -4.881   8.863
  563    HA   HIS  75           HA       HIS  75  75.932  -6.358  10.854
  564    HD1  HIS  75           HD1      HIS  75  71.549  -8.415  10.899
  565    HD2  HIS  75           HD2      HIS  75  73.538  -6.515   7.763
  566    HE1  HIS  75           HE1      HIS  75  69.823  -8.027   9.087
  567    HE2  HIS  75           HE2      HIS  75  71.020  -6.871   7.172
  568    HB2  HIS  75           HB2      HIS  75  74.642  -8.563  10.405
  569    HB3  HIS  75           HB1      HIS  75  73.925  -7.410  11.531
  570    H1U  RCY  76           H1U      RCY  76  80.090  -4.197   1.711
  571    H1S  RCY  76           H1S      RCY  76  80.139  -4.266   4.843
  572    HB1  RCY  76           HB1      RCY  76  79.183  -5.326   7.702
  573    HB2  RCY  76           HB2      RCY  76  78.239  -4.654   6.373
  574    HA   RCY  76           HA       RCY  76  76.884  -6.601   6.211
  575    HN1  RCY  76           HN1      RCY  76  76.991  -5.312   8.696
  576    H    GLU  77           HN       GLU  77  76.563  -8.871   6.534
  577    HA   GLU  77           HA       GLU  77  78.180 -10.574   8.114
  578    HB2  GLU  77           HB2      GLU  77  76.800 -11.152   5.472
  579    HB3  GLU  77           HB1      GLU  77  77.438 -12.383   6.564
  580    HG2  GLU  77           HG2      GLU  77  75.894 -11.780   8.292
  581    HG3  GLU  77           HG1      GLU  77  75.412 -10.313   7.440
  582    H    LEU  78           HN       LEU  78  80.127 -11.675   7.684
  583    HA   LEU  78           HA       LEU  78  82.293 -11.849   6.786
  584    HG   LEU  78           HG       LEU  78  82.522 -13.831   5.523
  585    HB2  LEU  78           HB2      LEU  78  80.440 -11.916   4.424
  586    HB3  LEU  78           HB1      LEU  78  82.177 -11.831   4.132
  587   HD11  LEU  78          HD11      LEU  78  79.514 -13.663   5.839
  588   HD12  LEU  78          HD12      LEU  78  80.730 -13.621   7.115
  589   HD13  LEU  78          HD13      LEU  78  80.445 -15.112   6.218
  590   HD21  LEU  78          HD21      LEU  78  81.892 -13.945   3.034
  591   HD22  LEU  78          HD22      LEU  78  80.280 -14.409   3.577
  592   HD23  LEU  78          HD23      LEU  78  81.667 -15.424   3.968
  593    H    HIS  79           HN       HIS  79  83.610 -10.617   4.716
  594    HA   HIS  79           HA       HIS  79  82.897  -7.762   4.692
  595    HD1  HIS  79           HD1      HIS  79  87.229  -6.979   5.501
  596    HD2  HIS  79           HD2      HIS  79  85.700 -10.843   5.861
  597    HE1  HIS  79           HE1      HIS  79  89.202  -8.551   5.283
  598    HE2  HIS  79           HE2      HIS  79  88.285 -10.907   5.500
  599    HB2  HIS  79           HB2      HIS  79  84.770  -6.947   5.869
  600    HB3  HIS  79           HB1      HIS  79  84.222  -8.302   6.852
  601    H    GLU  80           HN       GLU  80  85.254  -6.692   3.755
  602    HA   GLU  80           HA       GLU  80  86.624  -6.571   1.846
  603    HB2  GLU  80           HB2      GLU  80  86.895  -9.172   2.696
  604    HB3  GLU  80           HB1      GLU  80  86.261  -9.408   1.068
  605    HG2  GLU  80           HG2      GLU  80  88.033  -7.894   0.189
  606    HG3  GLU  80           HG1      GLU  80  88.696  -7.761   1.818
  607    H    LEU  81           HN       LEU  81  86.227  -8.174  -0.576
  608    HA   LEU  81           HA       LEU  81  83.681  -6.927  -1.477
  609    HG   LEU  81           HG       LEU  81  86.155  -5.767  -3.856
  610    HB2  LEU  81           HB2      LEU  81  86.140  -7.968  -2.871
  611    HB3  LEU  81           HB1      LEU  81  84.634  -7.791  -3.768
  612   HD11  LEU  81          HD11      LEU  81  83.685  -4.885  -2.444
  613   HD12  LEU  81          HD12      LEU  81  83.466  -5.906  -3.866
  614   HD13  LEU  81          HD13      LEU  81  84.331  -4.376  -4.004
  615   HD21  LEU  81          HD21      LEU  81  86.502  -4.446  -1.924
  616   HD22  LEU  81          HD22      LEU  81  86.756  -6.096  -1.355
  617   HD23  LEU  81          HD23      LEU  81  85.231  -5.275  -1.024
  618    H    ALA  82           HN       ALA  82  84.088  -9.524   0.128
  619    HA   ALA  82           HA       ALA  82  83.345 -11.710  -1.587
  620    HB1  ALA  82           HB1      ALA  82  84.295 -12.184   0.580
  621    HB2  ALA  82           HB2      ALA  82  82.644 -12.806   0.574
  622    HB3  ALA  82           HB3      ALA  82  83.013 -11.287   1.393
  623    H    GLN  83           HN       GLN  83  81.092 -11.746   0.879
  624    HA   GLN  83           HA       GLN  83  78.758 -11.522   0.902
  625    HB2  GLN  83           HB2      GLN  83  79.165  -9.421  -1.245
  626    HB3  GLN  83           HB1      GLN  83  77.796  -9.577  -0.148
  627    HG2  GLN  83           HG2      GLN  83  79.044  -8.865   1.713
  628    HG3  GLN  83           HG1      GLN  83  80.585  -9.220   0.933
  629   HE21  GLN  83          HE21      GLN  83  77.905  -6.886   1.037
  630   HE22  GLN  83          HE22      GLN  83  78.721  -5.654   0.200
  631    H    TYR  84           HN       TYR  84  77.377 -10.649  -1.723
  632    HA   TYR  84           HA       TYR  84  77.143 -13.371  -2.785
  633    HD1  TYR  84           HD1      TYR  84  74.791 -14.274  -2.808
  634    HD2  TYR  84           HD2      TYR  84  75.334 -11.565  -6.097
  635    HE1  TYR  84           HE1      TYR  84  73.699 -15.901  -4.328
  636    HE2  TYR  84           HE2      TYR  84  74.242 -13.192  -7.617
  637    HH   TYR  84           HH       TYR  84  73.978 -16.094  -7.319
  638    HB2  TYR  84           HB2      TYR  84  75.208 -11.719  -2.531
  639    HB3  TYR  84           HB1      TYR  84  75.875 -10.867  -3.924
  640    H    GLY  85           HN       GLY  85  79.088 -10.650  -3.442
  641    HA2  GLY  85           HA2      GLY  85  80.819 -11.673  -5.248
  642    HA3  GLY  85           HA1      GLY  85  79.453 -11.290  -6.295
  643    H    ILE  86           HN       ILE  86  78.946  -8.990  -4.225
  644    HA   ILE  86           HA       ILE  86  81.160  -7.172  -4.544
  645    HB   ILE  86           HB       ILE  86  80.474  -7.215  -6.898
  646   HG12  ILE  86          HG12      ILE  86  79.357  -4.650  -5.772
  647   HG13  ILE  86          HG11      ILE  86  81.074  -5.027  -5.617
  648   HG21  ILE  86          HG21      ILE  86  78.029  -7.833  -6.138
  649   HG22  ILE  86          HG22      ILE  86  78.278  -6.919  -7.626
  650   HG23  ILE  86          HG23      ILE  86  77.794  -6.085  -6.149
  651   HD11  ILE  86          HD11      ILE  86  79.575  -5.044  -8.251
  652   HD12  ILE  86          HD12      ILE  86  81.316  -5.204  -8.020
  653   HD13  ILE  86          HD13      ILE  86  80.516  -3.673  -7.664
  654    H1U  RCY  87           H1U      RCY  87  77.537   0.156   0.125
  655    H1S  RCY  87           H1S      RCY  87  75.619  -3.333  -0.922
  656    HB1  RCY  87           HB1      RCY  87  75.046  -6.161  -3.211
  657    HB2  RCY  87           HB2      RCY  87  75.856  -5.511  -4.635
  658    HA   RCY  87           HA       RCY  87  77.616  -4.798  -2.664
  659    HN1  RCY  87           HN1      RCY  87  77.574  -6.962  -4.634
  Start of MODEL   87
    1    HA   MET   1           HA       MET   1  73.592  -9.061  20.420
    2    HB2  MET   1           HB2      MET   1  74.028 -10.792  22.017
    3    HB3  MET   1           HB1      MET   1  73.071  -9.983  23.257
    4    HG2  MET   1           HG2      MET   1  71.928 -11.946  22.099
    5    HG3  MET   1           HG1      MET   1  71.022 -10.433  22.102
    6    HE1  MET   1           HE1      MET   1  74.232 -11.190  19.654
    7    HE2  MET   1           HE2      MET   1  73.354 -12.402  18.725
    8    HE3  MET   1           HE3      MET   1  73.523 -12.590  20.469
    9    H    ASN   2           HN       ASN   2  72.577  -6.767  22.711
   10    HA   ASN   2           HA       ASN   2  69.744  -6.971  22.552
   11    HB2  ASN   2           HB2      ASN   2  71.419  -4.450  22.773
   12    HB3  ASN   2           HB1      ASN   2  69.717  -4.609  23.211
   13   HD21  ASN   2          HD21      ASN   2  69.819  -7.162  24.510
   14   HD22  ASN   2          HD22      ASN   2  70.746  -7.006  25.923
   15    H    LEU   3           HN       LEU   3  70.423  -3.924  21.327
   16    HA   LEU   3           HA       LEU   3  69.995  -2.917  19.255
   17    HG   LEU   3           HG       LEU   3  70.406  -2.892  16.983
   18    HB2  LEU   3           HB2      LEU   3  71.733  -4.964  18.717
   19    HB3  LEU   3           HB1      LEU   3  70.368  -5.415  17.698
   20   HD11  LEU   3          HD11      LEU   3  72.047  -2.153  18.640
   21   HD12  LEU   3          HD12      LEU   3  72.722  -1.968  17.021
   22   HD13  LEU   3          HD13      LEU   3  73.219  -3.323  18.035
   23   HD21  LEU   3          HD21      LEU   3  70.867  -4.593  15.370
   24   HD22  LEU   3          HD22      LEU   3  72.397  -5.010  16.141
   25   HD23  LEU   3          HD23      LEU   3  72.232  -3.479  15.281
   26    H    GLU   4           HN       GLU   4  67.816  -2.499  19.216
   27    HA   GLU   4           HA       GLU   4  65.905  -4.718  18.834
   28    HB2  GLU   4           HB2      GLU   4  64.260  -2.674  18.941
   29    HB3  GLU   4           HB1      GLU   4  65.067  -3.213  20.413
   30    HG2  GLU   4           HG2      GLU   4  66.352  -1.130  18.659
   31    HG3  GLU   4           HG1      GLU   4  65.112  -0.670  19.827
   32    HA   PRO   5           HA       PRO   5  66.139  -4.276  14.350
   33    HB2  PRO   5           HB2      PRO   5  63.309  -5.230  14.652
   34    HB3  PRO   5           HB1      PRO   5  64.572  -5.794  13.540
   35    HG2  PRO   5           HG2      PRO   5  63.926  -7.163  15.737
   36    HG3  PRO   5           HG1      PRO   5  65.592  -7.084  15.143
   37    HD2  PRO   5           HD2      PRO   5  64.395  -5.791  17.535
   38    HD3  PRO   5           HD1      PRO   5  66.088  -6.226  17.216
   39    HA   PRO   6           HA       PRO   6  64.073  -0.401  13.668
   40    HB2  PRO   6           HB2      PRO   6  63.802  -0.409  10.949
   41    HB3  PRO   6           HB1      PRO   6  65.364  -0.188  11.762
   42    HG2  PRO   6           HG2      PRO   6  64.225  -2.631  10.500
   43    HG3  PRO   6           HG1      PRO   6  65.885  -2.012  10.470
   44    HD2  PRO   6           HD2      PRO   6  65.082  -4.055  12.116
   45    HD3  PRO   6           HD1      PRO   6  66.417  -2.951  12.516
   46    H    LYS   7           HN       LYS   7  62.019   0.560  12.926
   47    HA   LYS   7           HA       LYS   7  59.774  -1.250  13.273
   48    HB2  LYS   7           HB2      LYS   7  60.074   1.696  12.744
   49    HB3  LYS   7           HB1      LYS   7  58.489   0.932  12.612
   50    HG2  LYS   7           HG2      LYS   7  58.943   1.870  14.892
   51    HG3  LYS   7           HG1      LYS   7  58.627   0.135  14.906
   52    HD2  LYS   7           HD2      LYS   7  60.952  -0.382  15.127
   53    HD3  LYS   7           HD1      LYS   7  61.424   1.280  14.770
   54    HE2  LYS   7           HE2      LYS   7  60.609   2.075  16.854
   55    HE3  LYS   7           HE1      LYS   7  59.692   0.598  17.149
   56    HZ1  LYS   7           HZ1      LYS   7  62.158  -0.375  16.882
   57    HZ2  LYS   7           HZ2      LYS   7  61.479   0.070  18.375
   58    HZ3  LYS   7           HZ3      LYS   7  62.511   1.142  17.554
   59    H    ALA   8           HN       ALA   8  59.927   1.159  10.714
   60    HA   ALA   8           HA       ALA   8  59.712   0.934   8.376
   61    HB1  ALA   8           HB1      ALA   8  59.622  -2.051   8.501
   62    HB2  ALA   8           HB2      ALA   8  61.134  -1.266   8.956
   63    HB3  ALA   8           HB3      ALA   8  60.449  -0.998   7.353
   64    H    GLU   9           HN       GLU   9  57.708  -0.546  10.714
   65    HA   GLU   9           HA       GLU   9  55.427  -1.108  10.709
   66    HB2  GLU   9           HB2      GLU   9  55.577   1.066   8.611
   67    HB3  GLU   9           HB1      GLU   9  54.048   0.367   9.144
   68    HG2  GLU   9           HG2      GLU   9  54.470   1.049  11.434
   69    HG3  GLU   9           HG1      GLU   9  56.088   1.608  11.010
   70    H1U  RCY  10           H1U      RCY  10  56.755  -7.665   4.227
   71    H1S  RCY  10           H1S      RCY  10  55.088  -4.137   7.066
   72    HB1  RCY  10           HB1      RCY  10  53.113  -2.523   5.188
   73    HB2  RCY  10           HB2      RCY  10  52.885  -1.546   6.637
   74    HA   RCY  10           HA       RCY  10  55.341  -3.216   6.577
   75    HN1  RCY  10           HN1      RCY  10  55.153  -0.343   7.323
   76    H    ARG  11           HN       ARG  11  54.577  -3.108   3.980
   77    HA   ARG  11           HA       ARG  11  56.768  -1.847   2.671
   78    HE   ARG  11           HE       ARG  11  56.610  -6.463   1.621
   79    HB2  ARG  11           HB2      ARG  11  54.129  -2.543   1.363
   80    HB3  ARG  11           HB1      ARG  11  55.726  -2.503   0.615
   81    HG2  ARG  11           HG2      ARG  11  54.783  -4.438   2.750
   82    HG3  ARG  11           HG1      ARG  11  55.126  -4.821   1.063
   83    HD2  ARG  11           HD2      ARG  11  57.492  -3.869   1.554
   84    HD3  ARG  11           HD1      ARG  11  57.059  -4.074   3.251
   85   HH11  ARG  11          HH21      ARG  11  58.782  -4.592   3.535
   86   HH12  ARG  11          HH22      ARG  11  59.792  -5.938   3.945
   87   HH21  ARG  11          HH11      ARG  11  57.916  -8.232   2.145
   88   HH22  ARG  11          HH12      ARG  11  59.301  -7.999   3.158
   89    H    SER  12           HN       SER  12  56.953   0.357   2.996
   90    HA   SER  12           HA       SER  12  54.578   2.073   2.468
   91    HG   SER  12           HG       SER  12  56.304   4.749   4.009
   92    HB2  SER  12           HB2      SER  12  55.925   2.463   4.537
   93    HB3  SER  12           HB1      SER  12  57.319   2.832   3.526
   94    H    ALA  13           HN       ALA  13  57.189   3.973   1.962
   95    HA   ALA  13           HA       ALA  13  57.973   5.017   0.005
   96    HB1  ALA  13           HB1      ALA  13  59.352   2.942   0.060
   97    HB2  ALA  13           HB2      ALA  13  59.034   3.489  -1.586
   98    HB3  ALA  13           HB3      ALA  13  58.128   2.131  -0.918
   99    H    THR  14           HN       THR  14  57.586   3.596  -2.676
  100    HA   THR  14           HA       THR  14  54.864   4.687  -3.164
  101    HB   THR  14           HB       THR  14  56.865   3.735  -5.225
  102    HG1  THR  14           HG1      THR  14  56.950   5.869  -3.573
  103   HG21  THR  14          HG21      THR  14  54.657   5.798  -5.404
  104   HG22  THR  14          HG22      THR  14  54.444   4.106  -5.853
  105   HG23  THR  14          HG23      THR  14  55.592   5.114  -6.733
  106    H    ARG  15           HN       ARG  15  56.702   1.891  -4.470
  107    HA   ARG  15           HA       ARG  15  54.620   0.021  -3.670
  108    HE   ARG  15           HE       ARG  15  51.296   1.616  -5.707
  109    HB2  ARG  15           HB2      ARG  15  53.777   1.332  -5.780
  110    HB3  ARG  15           HB1      ARG  15  54.927   0.319  -6.651
  111    HG2  ARG  15           HG2      ARG  15  53.110  -1.090  -6.745
  112    HG3  ARG  15           HG1      ARG  15  53.738  -1.589  -5.174
  113    HD2  ARG  15           HD2      ARG  15  51.378  -1.165  -4.903
  114    HD3  ARG  15           HD1      ARG  15  52.245   0.158  -4.122
  115   HH11  ARG  15          HH21      ARG  15  51.257  -1.659  -6.786
  116   HH12  ARG  15          HH22      ARG  15  50.353  -1.314  -8.223
  117   HH21  ARG  15          HH11      ARG  15  50.116   2.084  -7.578
  118   HH22  ARG  15          HH12      ARG  15  49.707   0.805  -8.671
  119    H    VAL  16           HN       VAL  16  56.228  -1.344  -2.894
  120    HA   VAL  16           HA       VAL  16  58.117  -2.755  -2.942
  121    HB   VAL  16           HB       VAL  16  57.195  -3.333  -5.763
  122   HG11  VAL  16          HG11      VAL  16  59.273  -4.412  -4.684
  123   HG12  VAL  16          HG12      VAL  16  58.066  -5.504  -5.365
  124   HG13  VAL  16          HG13      VAL  16  58.137  -5.244  -3.622
  125   HG21  VAL  16          HG21      VAL  16  55.167  -3.315  -4.497
  126   HG22  VAL  16          HG22      VAL  16  55.942  -4.083  -3.112
  127   HG23  VAL  16          HG23      VAL  16  55.655  -5.007  -4.586
  128    H    MET  17           HN       MET  17  58.893  -3.094  -6.123
  129    HA   MET  17           HA       MET  17  61.340  -1.581  -5.857
  130    HB2  MET  17           HB2      MET  17  61.795  -2.297  -8.146
  131    HB3  MET  17           HB1      MET  17  61.129  -3.653  -7.236
  132    HG2  MET  17           HG2      MET  17  58.825  -2.783  -8.139
  133    HG3  MET  17           HG1      MET  17  59.814  -1.973  -9.354
  134    HE1  MET  17           HE1      MET  17  61.927  -4.890 -10.781
  135    HE2  MET  17           HE2      MET  17  62.283  -4.424  -9.119
  136    HE3  MET  17           HE3      MET  17  61.885  -3.187 -10.308
  137    H    GLY  18           HN       GLY  18  59.029   0.098  -5.520
  138    HA2  GLY  18           HA2      GLY  18  58.131   2.129  -6.287
  139    HA3  GLY  18           HA1      GLY  18  59.742   2.386  -6.959
  140    H    GLY  19           HN       GLY  19  56.501   1.214  -7.664
  141    HA2  GLY  19           HA2      GLY  19  55.471   0.691  -9.718
  142    HA3  GLY  19           HA1      GLY  19  56.370   2.095 -10.295
  143    HA   PRO  20           HA       PRO  20  57.612  -1.647 -12.838
  144    HB2  PRO  20           HB2      PRO  20  58.248   0.699 -14.590
  145    HB3  PRO  20           HB1      PRO  20  57.501  -0.855 -15.014
  146    HG2  PRO  20           HG2      PRO  20  56.055   1.368 -14.786
  147    HG3  PRO  20           HG1      PRO  20  55.423  -0.207 -14.275
  148    HD2  PRO  20           HD2      PRO  20  56.350   2.079 -12.599
  149    HD3  PRO  20           HD1      PRO  20  55.134   0.834 -12.239
  150    H1U  RCY  21           H1U      RCY  21  64.938   0.653  -8.476
  151    H1S  RCY  21           H1S      RCY  21  65.418  -0.764 -12.626
  152    HB1  RCY  21           HB1      RCY  21  61.966  -2.639 -14.725
  153    HB2  RCY  21           HB2      RCY  21  62.133  -3.279 -13.091
  154    HA   RCY  21           HA       RCY  21  61.911  -1.096 -12.122
  155    HN1  RCY  21           HN1      RCY  21  59.840  -1.886 -14.022
  156    H    THR  22           HN       THR  22  62.219   1.135 -12.246
  157    HA   THR  22           HA       THR  22  63.482   2.099 -14.756
  158    HB   THR  22           HB       THR  22  61.210   3.486 -13.305
  159    HG1  THR  22           HG1      THR  22  61.385   2.840 -16.038
  160   HG21  THR  22          HG21      THR  22  61.533   5.204 -15.148
  161   HG22  THR  22          HG22      THR  22  63.082   4.432 -15.485
  162   HG23  THR  22          HG23      THR  22  62.793   5.180 -13.915
  163    HA   PRO  23           HA       PRO  23  66.137   3.542 -11.410
  164    HB2  PRO  23           HB2      PRO  23  68.162   4.521 -12.943
  165    HB3  PRO  23           HB1      PRO  23  67.913   2.783 -12.684
  166    HG2  PRO  23           HG2      PRO  23  67.191   4.459 -15.032
  167    HG3  PRO  23           HG1      PRO  23  67.828   2.808 -14.976
  168    HD2  PRO  23           HD2      PRO  23  65.163   3.408 -15.379
  169    HD3  PRO  23           HD1      PRO  23  65.739   1.873 -14.695
  170    H    ARG  24           HN       ARG  24  65.942   5.456 -10.319
  171    HA   ARG  24           HA       ARG  24  65.025   7.845 -11.800
  172    HE   ARG  24           HE       ARG  24  62.144   7.888  -9.295
  173    HB2  ARG  24           HB2      ARG  24  63.952   7.089  -9.636
  174    HB3  ARG  24           HB1      ARG  24  65.447   7.524  -8.815
  175    HG2  ARG  24           HG2      ARG  24  64.123   9.463  -8.592
  176    HG3  ARG  24           HG1      ARG  24  65.159   9.834  -9.971
  177    HD2  ARG  24           HD2      ARG  24  62.700  10.359 -10.313
  178    HD3  ARG  24           HD1      ARG  24  63.412   9.302 -11.532
  179   HH11  ARG  24          HH21      ARG  24  61.862   9.302 -12.427
  180   HH12  ARG  24          HH22      ARG  24  60.491   8.345 -12.881
  181   HH21  ARG  24          HH11      ARG  24  60.357   6.630  -9.870
  182   HH22  ARG  24          HH12      ARG  24  59.639   6.832 -11.434
  183    H    LYS  25           HN       LYS  25  67.018   8.130  -8.925
  184    HA   LYS  25           HA       LYS  25  68.946   9.447  -8.609
  185    HB2  LYS  25           HB2      LYS  25  70.013   8.210 -11.135
  186    HB3  LYS  25           HB1      LYS  25  70.839   8.504  -9.605
  187    HG2  LYS  25           HG2      LYS  25  68.683   6.429 -10.099
  188    HG3  LYS  25           HG1      LYS  25  70.401   6.108  -9.857
  189    HD2  LYS  25           HD2      LYS  25  70.209   7.223  -7.603
  190    HD3  LYS  25           HD1      LYS  25  68.463   7.287  -7.848
  191    HE2  LYS  25           HE2      LYS  25  68.496   4.792  -8.191
  192    HE3  LYS  25           HE1      LYS  25  70.195   4.804  -7.720
  193    HZ1  LYS  25           HZ1      LYS  25  69.698   5.245  -5.574
  194    HZ2  LYS  25           HZ2      LYS  25  68.245   4.465  -5.984
  195    HZ3  LYS  25           HZ3      LYS  25  68.321   6.162  -5.948
  196    H    GLY  26           HN       GLY  26  70.724  10.216 -10.905
  197    HA2  GLY  26           HA2      GLY  26  69.718  11.618 -12.991
  198    HA3  GLY  26           HA1      GLY  26  69.241  12.653 -11.645
  199    HA   PRO  27           HA       PRO  27  73.119  14.610 -10.996
  200    HB2  PRO  27           HB2      PRO  27  73.843  12.720  -8.786
  201    HB3  PRO  27           HB1      PRO  27  73.877  14.495  -8.806
  202    HG2  PRO  27           HG2      PRO  27  71.931  13.153  -7.579
  203    HG3  PRO  27           HG1      PRO  27  71.618  14.675  -8.430
  204    HD2  PRO  27           HD2      PRO  27  70.890  11.898  -9.221
  205    HD3  PRO  27           HD1      PRO  27  70.099  13.435  -9.635
  206    HA   PRO  28           HA       PRO  28  76.072  12.498 -13.583
  207    HB2  PRO  28           HB2      PRO  28  78.046  13.785 -11.720
  208    HB3  PRO  28           HB1      PRO  28  78.045  13.731 -13.494
  209    HG2  PRO  28           HG2      PRO  28  77.255  15.899 -12.132
  210    HG3  PRO  28           HG1      PRO  28  76.530  15.436 -13.679
  211    HD2  PRO  28           HD2      PRO  28  75.349  15.344 -10.974
  212    HD3  PRO  28           HD1      PRO  28  74.540  15.326 -12.555
  213    H    LYS  29           HN       LYS  29  77.701  10.772 -13.424
  214    HA   LYS  29           HA       LYS  29  77.249   9.047 -11.111
  215    HB2  LYS  29           HB2      LYS  29  79.160   8.692 -13.441
  216    HB3  LYS  29           HB1      LYS  29  78.661   7.441 -12.304
  217    HG2  LYS  29           HG2      LYS  29  76.858   7.003 -13.578
  218    HG3  LYS  29           HG1      LYS  29  76.296   8.658 -13.343
  219    HD2  LYS  29           HD2      LYS  29  77.587   9.426 -15.251
  220    HD3  LYS  29           HD1      LYS  29  78.326   7.836 -15.438
  221    HE2  LYS  29           HE2      LYS  29  76.240   6.841 -16.069
  222    HE3  LYS  29           HE1      LYS  29  75.337   8.278 -15.592
  223    HZ1  LYS  29           HZ1      LYS  29  75.580   8.278 -17.951
  224    HZ2  LYS  29           HZ2      LYS  29  77.259   8.044 -17.840
  225    HZ3  LYS  29           HZ3      LYS  29  76.568   9.508 -17.328
  226    H1U  RCY  30           H1U      RCY  30  77.596  10.497  -3.810
  227    H1S  RCY  30           H1S      RCY  30  81.589   9.280  -5.954
  228    HB1  RCY  30           HB1      RCY  30  80.538   9.484  -8.594
  229    HB2  RCY  30           HB2      RCY  30  79.712  10.796  -7.759
  230    HA   RCY  30           HA       RCY  30  80.503  12.395  -9.429
  231    HN1  RCY  30           HN1      RCY  30  78.613  11.597 -10.580
  232    H    LYS  31           HN       LYS  31  82.275   9.505  -9.309
  233    HA   LYS  31           HA       LYS  31  83.778  10.155 -11.807
  234    HB2  LYS  31           HB2      LYS  31  85.000   9.675  -9.068
  235    HB3  LYS  31           HB1      LYS  31  85.908   9.839 -10.571
  236    HG2  LYS  31           HG2      LYS  31  85.149  12.114 -10.863
  237    HG3  LYS  31           HG1      LYS  31  84.028  11.966  -9.508
  238    HD2  LYS  31           HD2      LYS  31  85.998  11.544  -8.007
  239    HD3  LYS  31           HD1      LYS  31  87.056  11.893  -9.375
  240    HE2  LYS  31           HE2      LYS  31  85.146  13.762  -7.968
  241    HE3  LYS  31           HE1      LYS  31  86.880  13.957  -8.218
  242    HZ1  LYS  31           HZ1      LYS  31  86.428  14.069 -10.627
  243    HZ2  LYS  31           HZ2      LYS  31  85.711  15.340  -9.757
  244    HZ3  LYS  31           HZ3      LYS  31  84.764  14.037 -10.298
  245    H    GLN  32           HN       GLN  32  85.514   8.258 -12.075
  246    HA   GLN  32           HA       GLN  32  84.053   5.835 -12.417
  247    HB2  GLN  32           HB2      GLN  32  87.062   6.165 -12.177
  248    HB3  GLN  32           HB1      GLN  32  86.217   4.811 -12.928
  249    HG2  GLN  32           HG2      GLN  32  85.430   6.148 -14.721
  250    HG3  GLN  32           HG1      GLN  32  85.799   7.649 -13.871
  251   HE21  GLN  32          HE21      GLN  32  87.929   8.496 -14.062
  252   HE22  GLN  32          HE22      GLN  32  89.155   7.744 -14.965
  253    H    ARG  33           HN       ARG  33  86.851   4.812 -10.929
  254    HA   ARG  33           HA       ARG  33  85.876   4.800  -8.172
  255    HE   ARG  33           HE       ARG  33  84.044   0.596  -9.535
  256    HB2  ARG  33           HB2      ARG  33  85.683   2.368  -9.942
  257    HB3  ARG  33           HB1      ARG  33  86.009   2.171  -8.221
  258    HG2  ARG  33           HG2      ARG  33  83.954   3.933  -8.096
  259    HG3  ARG  33           HG1      ARG  33  83.530   3.085  -9.584
  260    HD2  ARG  33           HD2      ARG  33  84.217   1.672  -6.993
  261    HD3  ARG  33           HD1      ARG  33  82.567   2.050  -7.490
  262   HH11  ARG  33          HH21      ARG  33  82.209   0.414  -6.622
  263   HH12  ARG  33          HH22      ARG  33  81.669  -1.207  -6.907
  264   HH21  ARG  33          HH11      ARG  33  83.349  -1.520  -9.924
  265   HH22  ARG  33          HH12      ARG  33  82.315  -2.302  -8.776
  266    H    GLN  34           HN       GLN  34  88.118   5.916  -8.582
  267    HA   GLN  34           HA       GLN  34  90.449   4.346  -9.054
  268    HB2  GLN  34           HB2      GLN  34  91.580   6.192  -7.656
  269    HB3  GLN  34           HB1      GLN  34  90.719   6.709  -9.106
  270    HG2  GLN  34           HG2      GLN  34  88.823   7.431  -7.835
  271    HG3  GLN  34           HG1      GLN  34  89.423   6.647  -6.373
  272   HE21  GLN  34          HE21      GLN  34  88.821   9.447  -6.403
  273   HE22  GLN  34          HE22      GLN  34  90.274  10.309  -6.231
  274    H    THR  35           HN       THR  35  92.024   3.589  -7.430
  275    HA   THR  35           HA       THR  35  92.473   2.184  -5.594
  276    HB   THR  35           HB       THR  35  92.273   3.269  -3.524
  277    HG1  THR  35           HG1      THR  35  90.153   4.893  -4.348
  278   HG21  THR  35          HG21      THR  35  91.830   5.602  -5.391
  279   HG22  THR  35          HG22      THR  35  93.337   4.687  -5.375
  280   HG23  THR  35          HG23      THR  35  92.815   5.549  -3.929
  281    H    ARG  36           HN       ARG  36  90.552   0.992  -7.017
  282    HA   ARG  36           HA       ARG  36  87.978   0.616  -6.042
  283    HE   ARG  36           HE       ARG  36  89.805  -0.146 -10.914
  284    HB2  ARG  36           HB2      ARG  36  89.785  -1.657  -6.909
  285    HB3  ARG  36           HB1      ARG  36  88.026  -1.591  -7.022
  286    HG2  ARG  36           HG2      ARG  36  88.366   0.494  -8.490
  287    HG3  ARG  36           HG1      ARG  36  90.057   0.001  -8.594
  288    HD2  ARG  36           HD2      ARG  36  89.195  -2.291  -9.334
  289    HD3  ARG  36           HD1      ARG  36  87.619  -1.524  -9.529
  290   HH11  ARG  36          HH21      ARG  36  87.334  -2.549 -10.979
  291   HH12  ARG  36          HH22      ARG  36  87.186  -2.541 -12.705
  292   HH21  ARG  36          HH11      ARG  36  89.627  -0.122 -13.167
  293   HH22  ARG  36          HH12      ARG  36  88.484  -1.167 -13.944
  294    H    GLN  37           HN       GLN  37  90.962  -0.234  -4.500
  295    HA   GLN  37           HA       GLN  37  89.652  -2.068  -2.592
  296    HB2  GLN  37           HB2      GLN  37  92.481  -0.992  -2.494
  297    HB3  GLN  37           HB1      GLN  37  91.853  -2.440  -1.706
  298    HG2  GLN  37           HG2      GLN  37  91.294  -3.296  -4.053
  299    HG3  GLN  37           HG1      GLN  37  92.294  -1.976  -4.661
  300   HE21  GLN  37          HE21      GLN  37  93.056  -4.697  -5.088
  301   HE22  GLN  37          HE22      GLN  37  94.457  -5.014  -4.183
  302    H1U  RCY  38           H1U      RCY  38  84.901   2.329   2.201
  303    H1S  RCY  38           H1S      RCY  38  87.705   5.166   0.287
  304    HB1  RCY  38           HB1      RCY  38  88.622   2.406   0.289
  305    HB2  RCY  38           HB2      RCY  38  88.430   1.776  -1.346
  306    HA   RCY  38           HA       RCY  38  91.100   2.862  -0.972
  307    HN1  RCY  38           HN1      RCY  38  91.212   1.142  -2.564
  308    H    LYS  39           HN       LYS  39  92.772   1.270   0.077
  309    HA   LYS  39           HA       LYS  39  91.828   0.700   2.860
  310    HB2  LYS  39           HB2      LYS  39  93.701  -0.983   1.165
  311    HB3  LYS  39           HB1      LYS  39  93.379  -1.256   2.877
  312    HG2  LYS  39           HG2      LYS  39  91.170  -1.164   0.813
  313    HG3  LYS  39           HG1      LYS  39  91.998  -2.661   1.243
  314    HD2  LYS  39           HD2      LYS  39  91.441  -1.990   3.698
  315    HD3  LYS  39           HD1      LYS  39  90.251  -0.914   2.965
  316    HE2  LYS  39           HE2      LYS  39  89.098  -2.964   3.396
  317    HE3  LYS  39           HE1      LYS  39  89.415  -2.943   1.662
  318    HZ1  LYS  39           HZ1      LYS  39  90.202  -4.994   2.142
  319    HZ2  LYS  39           HZ2      LYS  39  90.590  -4.606   3.750
  320    HZ3  LYS  39           HZ3      LYS  39  91.616  -4.121   2.485
  321    H    SER  40           HN       SER  40  93.583   2.747   1.158
  322    HA   SER  40           HA       SER  40  95.977   2.694   2.946
  323    HG   SER  40           HG       SER  40  96.181   1.757   0.601
  324    HB2  SER  40           HB2      SER  40  95.434   4.027   0.286
  325    HB3  SER  40           HB1      SER  40  96.837   4.422   1.274
  326    H    LYS  41           HN       LYS  41  93.011   4.321   2.393
  327    HA   LYS  41           HA       LYS  41  93.918   6.834   3.645
  328    HB2  LYS  41           HB2      LYS  41  91.257   5.888   2.559
  329    HB3  LYS  41           HB1      LYS  41  91.438   7.421   3.409
  330    HG2  LYS  41           HG2      LYS  41  91.793   8.144   1.238
  331    HG3  LYS  41           HG1      LYS  41  93.448   7.731   1.685
  332    HD2  LYS  41           HD2      LYS  41  93.256   6.580  -0.323
  333    HD3  LYS  41           HD1      LYS  41  92.745   5.332   0.814
  334    HE2  LYS  41           HE2      LYS  41  91.166   5.480  -1.069
  335    HE3  LYS  41           HE1      LYS  41  90.382   5.963   0.436
  336    HZ1  LYS  41           HZ1      LYS  41  90.516   8.209  -0.133
  337    HZ2  LYS  41           HZ2      LYS  41  90.039   7.444  -1.573
  338    HZ3  LYS  41           HZ3      LYS  41  91.652   7.936  -1.363
  339    HA   PRO  42           HA       PRO  42  92.787   5.261   7.673
  340    HB2  PRO  42           HB2      PRO  42  93.032   7.553   9.109
  341    HB3  PRO  42           HB1      PRO  42  94.440   6.684   8.466
  342    HG2  PRO  42           HG2      PRO  42  93.082   9.111   7.402
  343    HG3  PRO  42           HG1      PRO  42  94.811   8.738   7.506
  344    HD2  PRO  42           HD2      PRO  42  93.332   8.469   5.194
  345    HD3  PRO  42           HD1      PRO  42  94.802   7.531   5.538
  346    HA   PRO  43           HA       PRO  43  88.497   6.278   8.248
  347    HB2  PRO  43           HB2      PRO  43  88.141   5.710  10.887
  348    HB3  PRO  43           HB1      PRO  43  88.425   4.449   9.670
  349    HG2  PRO  43           HG2      PRO  43  90.335   5.664  11.604
  350    HG3  PRO  43           HG1      PRO  43  90.162   3.976  11.096
  351    HD2  PRO  43           HD2      PRO  43  92.096   5.662  10.103
  352    HD3  PRO  43           HD1      PRO  43  91.445   4.276   9.200
  353    H    LYS  44           HN       LYS  44  86.994   7.742   9.483
  354    HA   LYS  44           HA       LYS  44  88.304   9.861  11.082
  355    HB2  LYS  44           HB2      LYS  44  88.492  10.631   8.734
  356    HB3  LYS  44           HB1      LYS  44  86.747  10.466   8.548
  357    HG2  LYS  44           HG2      LYS  44  86.289  12.259   9.975
  358    HG3  LYS  44           HG1      LYS  44  87.847  12.135  10.792
  359    HD2  LYS  44           HD2      LYS  44  87.823  12.777   7.869
  360    HD3  LYS  44           HD1      LYS  44  87.403  14.053   9.012
  361    HE2  LYS  44           HE2      LYS  44  89.886  12.366   9.351
  362    HE3  LYS  44           HE1      LYS  44  89.887  13.842   8.385
  363    HZ1  LYS  44           HZ1      LYS  44  90.544  14.178  10.731
  364    HZ2  LYS  44           HZ2      LYS  44  88.984  13.701  11.208
  365    HZ3  LYS  44           HZ3      LYS  44  89.197  15.102  10.271
  366    H    LYS  45           HN       LYS  45  85.301  10.603   9.557
  367    HA   LYS  45           HA       LYS  45  83.842  11.006  11.898
  368    HB2  LYS  45           HB2      LYS  45  83.038  10.283   9.092
  369    HB3  LYS  45           HB1      LYS  45  81.805  10.358  10.350
  370    HG2  LYS  45           HG2      LYS  45  83.754  12.625  10.094
  371    HG3  LYS  45           HG1      LYS  45  82.407  12.523   8.959
  372    HD2  LYS  45           HD2      LYS  45  81.859  12.199  11.889
  373    HD3  LYS  45           HD1      LYS  45  82.120  13.820  11.244
  374    HE2  LYS  45           HE2      LYS  45  80.247  13.702   9.837
  375    HE3  LYS  45           HE1      LYS  45  80.211  11.939   9.876
  376    HZ1  LYS  45           HZ1      LYS  45  78.453  12.804  11.235
  377    HZ2  LYS  45           HZ2      LYS  45  79.539  13.771  12.113
  378    HZ3  LYS  45           HZ3      LYS  45  79.610  12.079  12.241
  379    H    GLY  46           HN       GLY  46  83.515   8.081   9.848
  380    HA2  GLY  46           HA2      GLY  46  81.962   6.543  11.581
  381    HA3  GLY  46           HA1      GLY  46  83.156   5.844  10.486
  382    H    VAL  47           HN       VAL  47  82.469   6.683  13.776
  383    HA   VAL  47           HA       VAL  47  85.062   6.637  14.909
  384    HB   VAL  47           HB       VAL  47  83.789   5.613  16.942
  385   HG11  VAL  47          HG11      VAL  47  82.682   7.807  17.367
  386   HG12  VAL  47          HG12      VAL  47  82.954   8.242  15.680
  387   HG13  VAL  47          HG13      VAL  47  84.327   7.992  16.758
  388   HG21  VAL  47          HG21      VAL  47  81.378   5.679  16.805
  389   HG22  VAL  47          HG22      VAL  47  81.954   4.705  15.452
  390   HG23  VAL  47          HG23      VAL  47  81.438   6.370  15.183
  391    H    GLN  48           HN       GLN  48  82.863   3.938  14.139
  392    HA   GLN  48           HA       GLN  48  85.045   2.139  13.625
  393    HB2  GLN  48           HB2      GLN  48  85.013   2.363  16.206
  394    HB3  GLN  48           HB1      GLN  48  83.514   1.438  16.133
  395    HG2  GLN  48           HG2      GLN  48  86.130   0.536  14.897
  396    HG3  GLN  48           HG1      GLN  48  85.542   0.003  16.472
  397   HE21  GLN  48          HE21      GLN  48  83.594  -1.361  16.516
  398   HE22  GLN  48          HE22      GLN  48  83.061  -2.162  15.118
  399    H    GLY  49           HN       GLY  49  83.776   1.681  11.770
  400    HA2  GLY  49           HA2      GLY  49  82.388  -0.056  10.801
  401    HA3  GLY  49           HA1      GLY  49  81.469  -0.119  12.305
  402    H1U  RCY  50           H1U      RCY  50  83.217  -0.921   4.078
  403    H1S  RCY  50           H1S      RCY  50  81.382   2.849   6.525
  404    HB1  RCY  50           HB1      RCY  50  81.465   4.097   8.709
  405    HB2  RCY  50           HB2      RCY  50  79.792   4.633   8.556
  406    HA   RCY  50           HA       RCY  50  80.487   4.754  10.901
  407    HN1  RCY  50           HN1      RCY  50  82.087   3.075  11.395
  408    H    GLY  51           HN       GLY  51  79.412   2.425  12.453
  409    HA2  GLY  51           HA2      GLY  51  76.637   2.248  11.403
  410    HA3  GLY  51           HA1      GLY  51  77.306   1.253  12.696
  411    H    ASP  52           HN       ASP  52  74.921   2.336  13.267
  412    HA   ASP  52           HA       ASP  52  73.776   3.773  14.729
  413    HB2  ASP  52           HB2      ASP  52  75.523   2.619  16.216
  414    HB3  ASP  52           HB1      ASP  52  76.453   4.113  16.090
  415    H    ASP  53           HN       ASP  53  74.594   5.068  12.397
  416    HA   ASP  53           HA       ASP  53  75.774   7.654  13.280
  417    HB2  ASP  53           HB2      ASP  53  76.616   6.527  11.197
  418    HB3  ASP  53           HB1      ASP  53  75.019   6.758  10.483
  419    H    ILE  54           HN       ILE  54  74.024   8.414  10.654
  420    HA   ILE  54           HA       ILE  54  71.659   9.260  12.286
  421    HB   ILE  54           HB       ILE  54  72.852  10.552   9.815
  422   HG12  ILE  54          HG12      ILE  54  72.793  11.558  12.674
  423   HG13  ILE  54          HG11      ILE  54  74.183  10.737  11.964
  424   HG21  ILE  54          HG21      ILE  54  71.260  12.429  10.627
  425   HG22  ILE  54          HG22      ILE  54  70.457  11.157  11.548
  426   HG23  ILE  54          HG23      ILE  54  70.542  11.052   9.790
  427   HD11  ILE  54          HD11      ILE  54  72.921  13.312  10.980
  428   HD12  ILE  54          HD12      ILE  54  74.232  12.463  10.161
  429   HD13  ILE  54          HD13      ILE  54  74.492  13.149  11.765
  430    HA   PRO  55           HA       PRO  55  69.925   6.463   9.106
  431    HB2  PRO  55           HB2      PRO  55  68.003   5.341  10.655
  432    HB3  PRO  55           HB1      PRO  55  69.700   4.828  10.729
  433    HG2  PRO  55           HG2      PRO  55  68.167   6.553  12.593
  434    HG3  PRO  55           HG1      PRO  55  69.449   5.381  12.931
  435    HD2  PRO  55           HD2      PRO  55  69.796   8.156  12.796
  436    HD3  PRO  55           HD1      PRO  55  71.097   6.952  12.687
  437    H    GLY  56           HN       GLY  56  68.901   7.971   7.749
  438    HA2  GLY  56           HA2      GLY  56  66.090   8.320   7.948
  439    HA3  GLY  56           HA1      GLY  56  66.853   9.786   8.564
  440    H    MET  57           HN       MET  57  68.824   8.289   6.275
  441    HA   MET  57           HA       MET  57  69.359   8.821   4.056
  442    HB2  MET  57           HB2      MET  57  66.843   8.158   3.846
  443    HB3  MET  57           HB1      MET  57  66.564   9.892   3.688
  444    HG2  MET  57           HG2      MET  57  68.316   9.904   1.855
  445    HG3  MET  57           HG1      MET  57  68.293   8.142   1.924
  446    HE1  MET  57           HE1      MET  57  66.435  11.315   1.688
  447    HE2  MET  57           HE2      MET  57  65.092  11.068   0.575
  448    HE3  MET  57           HE3      MET  57  66.743  11.099  -0.040
  449    H    GLU  58           HN       GLU  58  70.620  10.561   5.240
  450    HA   GLU  58           HA       GLU  58  70.380  13.056   3.897
  451    HB2  GLU  58           HB2      GLU  58  68.642  12.784   6.171
  452    HB3  GLU  58           HB1      GLU  58  69.893  13.959   6.573
  453    HG2  GLU  58           HG2      GLU  58  69.408  15.198   4.497
  454    HG3  GLU  58           HG1      GLU  58  68.164  14.020   4.079
  455    H    GLY  59           HN       GLY  59  72.216  10.919   5.090
  456    HA2  GLY  59           HA2      GLY  59  74.575  12.347   5.352
  457    HA3  GLY  59           HA1      GLY  59  73.914  12.323   6.988
  458    H1U  RCY  60           H1U      RCY  60  79.195   5.463   0.868
  459    H1S  RCY  60           H1S      RCY  60  76.403   8.767   3.059
  460    HB1  RCY  60           HB1      RCY  60  76.854   7.270   5.456
  461    HB2  RCY  60           HB2      RCY  60  76.439   8.289   6.834
  462    HA   RCY  60           HA       RCY  60  74.833   7.702   4.360
  463    HN1  RCY  60           HN1      RCY  60  74.093   9.925   4.337
  464    H    GLY  61           HN       GLY  61  75.491   6.095   6.656
  465    HA2  GLY  61           HA2      GLY  61  74.409   4.817   8.302
  466    HA3  GLY  61           HA1      GLY  61  73.502   6.275   8.712
  467    H    THR  62           HN       THR  62  71.522   6.702   7.572
  468    HA   THR  62           HA       THR  62  69.385   5.770   7.026
  469    HB   THR  62           HB       THR  62  69.985   6.779   4.976
  470    HG1  THR  62           HG1      THR  62  69.495   4.978   3.423
  471   HG21  THR  62          HG21      THR  62  72.333   6.145   4.930
  472   HG22  THR  62          HG22      THR  62  71.590   5.692   3.397
  473   HG23  THR  62          HG23      THR  62  71.906   4.462   4.620
  474    H    ASP  63           HN       ASP  63  69.487   3.905   8.523
  475    HA   ASP  63           HA       ASP  63  70.528   1.357   7.700
  476    HB2  ASP  63           HB2      ASP  63  69.895   2.086  10.067
  477    HB3  ASP  63           HB1      ASP  63  68.219   1.781   9.608
  478    H    ILE  64           HN       ILE  64  68.331   3.020   6.077
  479    HA   ILE  64           HA       ILE  64  66.842   0.563   5.246
  480    HB   ILE  64           HB       ILE  64  65.624   3.319   5.589
  481   HG12  ILE  64          HG12      ILE  64  65.039   0.778   7.134
  482   HG13  ILE  64          HG11      ILE  64  66.129   2.035   7.720
  483   HG21  ILE  64          HG21      ILE  64  64.548   0.655   4.636
  484   HG22  ILE  64          HG22      ILE  64  64.556   2.190   3.767
  485   HG23  ILE  64          HG23      ILE  64  63.500   1.973   5.163
  486   HD11  ILE  64          HD11      ILE  64  63.766   2.246   8.577
  487   HD12  ILE  64          HD12      ILE  64  63.252   2.549   6.918
  488   HD13  ILE  64          HD13      ILE  64  64.350   3.672   7.720
  489    H    THR  65           HN       THR  65  67.927   3.838   4.468
  490    HA   THR  65           HA       THR  65  68.029   4.920   2.358
  491    HB   THR  65           HB       THR  65  69.344   2.237   1.813
  492    HG1  THR  65           HG1      THR  65  70.173   3.519   3.567
  493   HG21  THR  65          HG21      THR  65  69.370   3.035  -0.314
  494   HG22  THR  65          HG22      THR  65  70.642   4.101   0.284
  495   HG23  THR  65          HG23      THR  65  68.977   4.676   0.198
  496    H    VAL  66           HN       VAL  66  65.529   3.768   2.761
  497    HA   VAL  66           HA       VAL  66  63.606   3.214   1.544
  498    HB   VAL  66           HB       VAL  66  65.290   3.231  -0.969
  499   HG11  VAL  66          HG11      VAL  66  62.436   4.101  -0.424
  500   HG12  VAL  66          HG12      VAL  66  62.887   2.507  -1.029
  501   HG13  VAL  66          HG13      VAL  66  63.208   3.943  -2.001
  502   HG21  VAL  66          HG21      VAL  66  64.357   5.541   0.731
  503   HG22  VAL  66          HG22      VAL  66  64.539   5.726  -1.014
  504   HG23  VAL  66          HG23      VAL  66  65.932   5.293  -0.023
  505    H    ILE  67           HN       ILE  67  66.388   1.685  -0.082
  506    HA   ILE  67           HA       ILE  67  65.309  -0.979   0.699
  507    HB   ILE  67           HB       ILE  67  66.200  -0.191  -2.093
  508   HG12  ILE  67          HG12      ILE  67  63.549  -1.311  -1.142
  509   HG13  ILE  67          HG11      ILE  67  63.847   0.415  -1.351
  510   HG21  ILE  67          HG21      ILE  67  65.566  -2.864  -0.827
  511   HG22  ILE  67          HG22      ILE  67  67.026  -2.395  -1.698
  512   HG23  ILE  67          HG23      ILE  67  65.509  -2.609  -2.571
  513   HD11  ILE  67          HD11      ILE  67  64.206   0.174  -3.692
  514   HD12  ILE  67          HD12      ILE  67  62.782  -0.805  -3.341
  515   HD13  ILE  67          HD13      ILE  67  64.351  -1.579  -3.566
  516    H1U  RCY  68           H1U      RCY  68  73.135  -0.561  -0.771
  517    H1S  RCY  68           H1S      RCY  68  70.452   1.908   2.396
  518    HB1  RCY  68           HB1      RCY  68  70.387  -1.739   3.555
  519    HB2  RCY  68           HB2      RCY  68  68.655  -1.824   3.867
  520    HA   RCY  68           HA       RCY  68  69.814  -0.766   1.276
  521    HN1  RCY  68           HN1      RCY  68  67.068  -1.146   2.230
  522    HA   PRO  69           HA       PRO  69  70.316  -4.878  -0.294
  523    HB2  PRO  69           HB2      PRO  69  73.024  -5.213   0.096
  524    HB3  PRO  69           HB1      PRO  69  72.329  -4.242  -1.215
  525    HG2  PRO  69           HG2      PRO  69  73.486  -3.362   1.376
  526    HG3  PRO  69           HG1      PRO  69  73.600  -2.615  -0.226
  527    HD2  PRO  69           HD2      PRO  69  71.913  -1.692   1.721
  528    HD3  PRO  69           HD1      PRO  69  71.565  -1.529  -0.014
  529    H    TRP  70           HN       TRP  70  70.202  -4.222   2.864
  530    HA   TRP  70           HA       TRP  70  71.493  -6.614   3.945
  531    HD1  TRP  70           HD1      TRP  70  71.173  -7.801   6.263
  532    HE1  TRP  70           HE1      TRP  70  73.161  -7.780   7.903
  533    HE3  TRP  70           HE3      TRP  70  72.245  -2.809   6.284
  534    HZ2  TRP  70           HZ2      TRP  70  74.970  -5.892   9.072
  535    HZ3  TRP  70           HZ3      TRP  70  74.100  -1.927   7.665
  536    HH2  TRP  70           HH2      TRP  70  75.463  -3.457   9.058
  537    HB2  TRP  70           HB2      TRP  70  70.612  -4.177   5.009
  538    HB3  TRP  70           HB1      TRP  70  69.503  -5.365   5.690
  539    H    GLU  71           HN       GLU  71  68.655  -6.090   2.237
  540    HA   GLU  71           HA       GLU  71  67.606  -8.712   3.134
  541    HB2  GLU  71           HB2      GLU  71  66.019  -6.131   3.235
  542    HB3  GLU  71           HB1      GLU  71  65.281  -7.732   3.300
  543    HG2  GLU  71           HG2      GLU  71  66.827  -8.226   5.266
  544    HG3  GLU  71           HG1      GLU  71  67.212  -6.505   5.280
  545    H    ALA  72           HN       ALA  72  67.159  -5.921   0.952
  546    HA   ALA  72           HA       ALA  72  65.716  -7.516  -1.012
  547    HB1  ALA  72           HB1      ALA  72  66.133  -5.469  -2.476
  548    HB2  ALA  72           HB2      ALA  72  66.944  -4.752  -1.083
  549    HB3  ALA  72           HB3      ALA  72  65.235  -5.173  -0.988
  550    H1U  RCY  73           H1U      RCY  73  73.657  -3.755  -3.532
  551    H1S  RCY  73           H1S      RCY  73  73.372  -8.535  -3.514
  552    HB1  RCY  73           HB1      RCY  73  70.545  -9.860  -0.259
  553    HB2  RCY  73           HB2      RCY  73  71.182  -8.219  -0.157
  554    HA   RCY  73           HA       RCY  73  70.278  -7.781  -2.452
  555    HN1  RCY  73           HN1      RCY  73  68.648  -8.105  -0.096
  556    H    ASN  74           HN       ASN  74  69.094  -8.558  -4.254
  557    HA   ASN  74           HA       ASN  74  69.003 -11.520  -4.457
  558    HB2  ASN  74           HB2      ASN  74  66.660  -9.774  -5.267
  559    HB3  ASN  74           HB1      ASN  74  66.736 -11.536  -5.296
  560   HD21  ASN  74          HD21      ASN  74  66.725  -8.733  -3.068
  561   HD22  ASN  74          HD22      ASN  74  66.177  -9.606  -1.719
  562    H    HIS  75           HN       HIS  75  70.707 -11.411  -5.967
  563    HA   HIS  75           HA       HIS  75  71.515 -11.362  -8.175
  564    HD1  HIS  75           HD1      HIS  75  70.793  -9.628 -11.202
  565    HD2  HIS  75           HD2      HIS  75  69.918 -13.594 -10.252
  566    HE1  HIS  75           HE1      HIS  75  71.601 -11.026 -13.154
  567    HE2  HIS  75           HE2      HIS  75  71.074 -13.443 -12.588
  568    HB2  HIS  75           HB2      HIS  75  68.875 -11.580  -8.588
  569    HB3  HIS  75           HB1      HIS  75  69.088  -9.938  -9.194
  570    H1U  RCY  76           H1U      RCY  76  78.497  -5.757  -3.209
  571    H1S  RCY  76           H1S      RCY  76  74.205  -6.667  -5.001
  572    HB1  RCY  76           HB1      RCY  76  72.552  -7.531  -6.620
  573    HB2  RCY  76           HB2      RCY  76  71.864  -6.299  -7.676
  574    HA   RCY  76           HA       RCY  76  72.697  -7.279  -9.579
  575    HN1  RCY  76           HN1      RCY  76  73.036  -9.895  -8.727
  576    H    GLU  77           HN       GLU  77  74.784  -8.600  -6.980
  577    HA   GLU  77           HA       GLU  77  77.193  -7.539  -8.124
  578    HB2  GLU  77           HB2      GLU  77  78.246  -9.401  -6.605
  579    HB3  GLU  77           HB1      GLU  77  77.393  -8.059  -5.846
  580    HG2  GLU  77           HG2      GLU  77  76.753 -10.341  -4.959
  581    HG3  GLU  77           HG1      GLU  77  75.399  -9.386  -5.563
  582    H    LEU  78           HN       LEU  78  79.029  -9.487  -8.374
  583    HA   LEU  78           HA       LEU  78  78.026 -11.053 -10.703
  584    HG   LEU  78           HG       LEU  78  80.995 -10.558 -12.596
  585    HB2  LEU  78           HB2      LEU  78  80.198  -9.380 -10.525
  586    HB3  LEU  78           HB1      LEU  78  80.944 -10.940 -10.195
  587   HD11  LEU  78          HD11      LEU  78  78.682 -12.443 -12.305
  588   HD12  LEU  78          HD12      LEU  78  80.201 -12.835 -11.499
  589   HD13  LEU  78          HD13      LEU  78  80.160 -12.626 -13.250
  590   HD21  LEU  78          HD21      LEU  78  78.035 -10.565 -12.861
  591   HD22  LEU  78          HD22      LEU  78  79.247  -9.705 -13.811
  592   HD23  LEU  78          HD23      LEU  78  78.753  -9.079 -12.237
  593    H    HIS  79           HN       HIS  79  79.669 -11.266  -7.617
  594    HA   HIS  79           HA       HIS  79  79.362 -13.186  -6.165
  595    HD1  HIS  79           HD1      HIS  79  79.410 -17.242  -8.731
  596    HD2  HIS  79           HD2      HIS  79  81.193 -13.583  -9.642
  597    HE1  HIS  79           HE1      HIS  79  81.059 -17.696 -10.599
  598    HE2  HIS  79           HE2      HIS  79  82.151 -15.476 -11.163
  599    HB2  HIS  79           HB2      HIS  79  79.000 -15.359  -6.934
  600    HB3  HIS  79           HB1      HIS  79  78.151 -14.394  -8.134
  601    H    GLU  80           HN       GLU  80  80.960 -14.989  -5.648
  602    HA   GLU  80           HA       GLU  80  83.404 -15.624  -6.545
  603    HB2  GLU  80           HB2      GLU  80  83.410 -12.689  -5.924
  604    HB3  GLU  80           HB1      GLU  80  84.813 -13.614  -5.405
  605    HG2  GLU  80           HG2      GLU  80  83.899 -14.201  -8.155
  606    HG3  GLU  80           HG1      GLU  80  84.519 -12.567  -7.914
  607    H    LEU  81           HN       LEU  81  84.132 -13.634  -3.878
  608    HA   LEU  81           HA       LEU  81  83.741 -15.951  -2.039
  609    HG   LEU  81           HG       LEU  81  87.269 -15.206  -1.666
  610    HB2  LEU  81           HB2      LEU  81  85.550 -13.538  -2.037
  611    HB3  LEU  81           HB1      LEU  81  85.191 -14.362  -0.522
  612   HD11  LEU  81          HD11      LEU  81  85.375 -16.582  -0.280
  613   HD12  LEU  81          HD12      LEU  81  86.885 -17.302  -0.840
  614   HD13  LEU  81          HD13      LEU  81  85.408 -17.510  -1.780
  615   HD21  LEU  81          HD21      LEU  81  85.398 -16.505  -3.643
  616   HD22  LEU  81          HD22      LEU  81  87.151 -16.334  -3.736
  617   HD23  LEU  81          HD23      LEU  81  86.113 -14.929  -3.980
  618    H    ALA  82           HN       ALA  82  83.088 -12.509  -2.469
  619    HA   ALA  82           HA       ALA  82  81.605 -12.147  -0.019
  620    HB1  ALA  82           HB1      ALA  82  82.359 -10.136  -0.963
  621    HB2  ALA  82           HB2      ALA  82  80.661 -10.142  -1.439
  622    HB3  ALA  82           HB3      ALA  82  81.903 -10.620  -2.595
  623    H    GLN  83           HN       GLN  83  80.133 -14.034  -0.069
  624    HA   GLN  83           HA       GLN  83  78.287 -14.555  -2.175
  625    HB2  GLN  83           HB2      GLN  83  78.829 -15.799   0.156
  626    HB3  GLN  83           HB1      GLN  83  77.373 -14.937   0.650
  627    HG2  GLN  83           HG2      GLN  83  77.612 -16.767  -1.758
  628    HG3  GLN  83           HG1      GLN  83  76.800 -17.159  -0.242
  629   HE21  GLN  83          HE21      GLN  83  76.646 -14.953  -3.057
  630   HE22  GLN  83          HE22      GLN  83  74.996 -14.592  -2.885
  631    H    TYR  84           HN       TYR  84  77.656 -12.878   0.897
  632    HA   TYR  84           HA       TYR  84  75.530 -11.251  -0.454
  633    HD1  TYR  84           HD1      TYR  84  76.958 -10.554   3.450
  634    HD2  TYR  84           HD2      TYR  84  75.609 -14.409   2.118
  635    HE1  TYR  84           HE1      TYR  84  78.391 -11.645   5.155
  636    HE2  TYR  84           HE2      TYR  84  77.042 -15.499   3.823
  637    HH   TYR  84           HH       TYR  84  78.611 -13.694   6.330
  638    HB2  TYR  84           HB2      TYR  84  74.899 -10.841   2.050
  639    HB3  TYR  84           HB1      TYR  84  74.523 -12.422   1.357
  640    H    GLY  85           HN       GLY  85  78.597 -11.289   0.958
  641    HA2  GLY  85           HA2      GLY  85  79.858  -9.102   0.472
  642    HA3  GLY  85           HA1      GLY  85  78.576  -8.343   1.424
  643    H    ILE  86           HN       ILE  86  79.661  -7.753   3.249
  644    HA   ILE  86           HA       ILE  86  80.181  -9.629   5.299
  645    HB   ILE  86           HB       ILE  86  82.804  -9.018   5.295
  646   HG12  ILE  86          HG12      ILE  86  82.338  -9.419   2.349
  647   HG13  ILE  86          HG11      ILE  86  82.296  -7.792   3.029
  648   HG21  ILE  86          HG21      ILE  86  82.385 -11.209   3.416
  649   HG22  ILE  86          HG22      ILE  86  81.261 -11.284   4.774
  650   HG23  ILE  86          HG23      ILE  86  83.000 -11.256   5.069
  651   HD11  ILE  86          HD11      ILE  86  84.588  -9.671   3.597
  652   HD12  ILE  86          HD12      ILE  86  84.543  -7.916   3.764
  653   HD13  ILE  86          HD13      ILE  86  84.572  -8.649   2.160
  654    H1U  RCY  87           H1U      RCY  87  76.919  -5.049  -0.085
  655    H1S  RCY  87           H1S      RCY  87  79.093  -1.845   2.800
  656    HB1  RCY  87           HB1      RCY  87  77.987  -4.168   5.590
  657    HB2  RCY  87           HB2      RCY  87  78.594  -4.900   4.105
  658    HA   RCY  87           HA       RCY  87  80.749  -4.959   5.948
  659    HN1  RCY  87           HN1      RCY  87  79.189  -6.903   4.449
  Start of MODEL   88
    1    HA   MET   1           HA       MET   1  50.669  -5.047 -10.081
    2    HB2  MET   1           HB2      MET   1  48.999  -4.004 -11.739
    3    HB3  MET   1           HB1      MET   1  50.207  -4.330 -12.981
    4    HG2  MET   1           HG2      MET   1  48.825  -6.252 -13.004
    5    HG3  MET   1           HG1      MET   1  50.232  -6.743 -12.061
    6    HE1  MET   1           HE1      MET   1  50.348  -7.349  -9.815
    7    HE2  MET   1           HE2      MET   1  49.349  -8.604 -10.543
    8    HE3  MET   1           HE3      MET   1  48.944  -7.981  -8.945
    9    H    ASN   2           HN       ASN   2  53.168  -4.893  -9.783
   10    HA   ASN   2           HA       ASN   2  55.025  -4.986 -11.867
   11    HB2  ASN   2           HB2      ASN   2  55.012  -6.696  -9.359
   12    HB3  ASN   2           HB1      ASN   2  56.419  -6.384 -10.376
   13   HD21  ASN   2          HD21      ASN   2  57.605  -5.166  -8.780
   14   HD22  ASN   2          HD22      ASN   2  57.084  -3.650  -8.224
   15    H    LEU   3           HN       LEU   3  56.027  -6.839 -12.968
   16    HA   LEU   3           HA       LEU   3  53.989  -8.812 -13.787
   17    HG   LEU   3           HG       LEU   3  55.501  -7.461 -16.810
   18    HB2  LEU   3           HB2      LEU   3  56.727  -8.049 -14.807
   19    HB3  LEU   3           HB1      LEU   3  55.911  -9.501 -15.384
   20   HD11  LEU   3          HD11      LEU   3  53.354  -8.153 -17.298
   21   HD12  LEU   3          HD12      LEU   3  52.868  -8.187 -15.603
   22   HD13  LEU   3          HD13      LEU   3  53.850  -9.494 -16.264
   23   HD21  LEU   3          HD21      LEU   3  54.204  -5.649 -15.976
   24   HD22  LEU   3          HD22      LEU   3  55.409  -5.952 -14.725
   25   HD23  LEU   3          HD23      LEU   3  53.758  -6.537 -14.519
   26    H    GLU   4           HN       GLU   4  57.417  -8.971 -12.733
   27    HA   GLU   4           HA       GLU   4  57.572 -11.741 -12.365
   28    HB2  GLU   4           HB2      GLU   4  58.896  -9.425 -10.970
   29    HB3  GLU   4           HB1      GLU   4  59.208 -11.075 -10.433
   30    HG2  GLU   4           HG2      GLU   4  59.891 -11.688 -12.733
   31    HG3  GLU   4           HG1      GLU   4  59.609 -10.026 -13.251
   32    HA   PRO   5           HA       PRO   5  54.688 -13.007  -9.251
   33    HB2  PRO   5           HB2      PRO   5  57.128 -14.158  -7.937
   34    HB3  PRO   5           HB1      PRO   5  55.549 -14.912  -8.236
   35    HG2  PRO   5           HG2      PRO   5  57.687 -15.410  -9.777
   36    HG3  PRO   5           HG1      PRO   5  56.037 -15.388 -10.419
   37    HD2  PRO   5           HD2      PRO   5  58.230 -13.468 -10.877
   38    HD3  PRO   5           HD1      PRO   5  56.743 -13.721 -11.815
   39    HA   PRO   6           HA       PRO   6  55.897  -9.706  -6.309
   40    HB2  PRO   6           HB2      PRO   6  53.426  -8.655  -5.946
   41    HB3  PRO   6           HB1      PRO   6  54.397  -8.306  -7.390
   42    HG2  PRO   6           HG2      PRO   6  52.089 -10.141  -7.068
   43    HG3  PRO   6           HG1      PRO   6  52.555  -9.141  -8.452
   44    HD2  PRO   6           HD2      PRO   6  53.043 -11.889  -8.208
   45    HD3  PRO   6           HD1      PRO   6  53.862 -10.796  -9.344
   46    H    LYS   7           HN       LYS   7  56.095 -10.079  -4.134
   47    HA   LYS   7           HA       LYS   7  53.910 -11.555  -2.732
   48    HB2  LYS   7           HB2      LYS   7  56.543 -12.206  -1.646
   49    HB3  LYS   7           HB1      LYS   7  55.253 -13.289  -2.162
   50    HG2  LYS   7           HG2      LYS   7  57.086 -13.763  -3.609
   51    HG3  LYS   7           HG1      LYS   7  55.982 -12.773  -4.565
   52    HD2  LYS   7           HD2      LYS   7  57.834 -11.514  -4.974
   53    HD3  LYS   7           HD1      LYS   7  57.512 -10.847  -3.373
   54    HE2  LYS   7           HE2      LYS   7  58.966 -12.645  -2.397
   55    HE3  LYS   7           HE1      LYS   7  59.380 -13.139  -4.039
   56    HZ1  LYS   7           HZ1      LYS   7  60.315 -10.999  -4.466
   57    HZ2  LYS   7           HZ2      LYS   7  60.998 -11.594  -3.029
   58    HZ3  LYS   7           HZ3      LYS   7  59.789 -10.402  -2.968
   59    H    ALA   8           HN       ALA   8  53.255  -9.535  -1.821
   60    HA   ALA   8           HA       ALA   8  53.385  -7.688  -0.358
   61    HB1  ALA   8           HB1      ALA   8  54.821  -9.910   1.107
   62    HB2  ALA   8           HB2      ALA   8  53.155  -9.372   1.316
   63    HB3  ALA   8           HB3      ALA   8  54.485  -8.351   1.859
   64    H    GLU   9           HN       GLU   9  54.829  -6.556  -1.944
   65    HA   GLU   9           HA       GLU   9  57.711  -6.606  -1.408
   66    HB2  GLU   9           HB2      GLU   9  57.593  -4.567  -3.037
   67    HB3  GLU   9           HB1      GLU   9  57.245  -6.175  -3.671
   68    HG2  GLU   9           HG2      GLU   9  55.010  -4.500  -2.559
   69    HG3  GLU   9           HG1      GLU   9  55.591  -4.206  -4.198
   70    H1U  RCY  10           H1U      RCY  10  58.482  -4.473  -3.375
   71    H1S  RCY  10           H1S      RCY  10  59.712  -5.649   1.182
   72    HB1  RCY  10           HB1      RCY  10  57.335  -3.209   3.138
   73    HB2  RCY  10           HB2      RCY  10  58.201  -3.278   1.603
   74    HA   RCY  10           HA       RCY  10  55.302  -3.895   2.160
   75    HN1  RCY  10           HN1      RCY  10  55.489  -5.601   0.556
   76    H    ARG  11           HN       ARG  11  53.953  -2.596   0.729
   77    HA   ARG  11           HA       ARG  11  53.409  -0.622  -0.412
   78    HE   ARG  11           HE       ARG  11  53.161   4.436   0.801
   79    HB2  ARG  11           HB2      ARG  11  54.584   0.276   1.676
   80    HB3  ARG  11           HB1      ARG  11  56.025   0.448   0.674
   81    HG2  ARG  11           HG2      ARG  11  54.970   2.025  -0.759
   82    HG3  ARG  11           HG1      ARG  11  53.366   1.634  -0.138
   83    HD2  ARG  11           HD2      ARG  11  53.959   2.576   2.049
   84    HD3  ARG  11           HD1      ARG  11  55.589   2.924   1.473
   85   HH11  ARG  11          HH21      ARG  11  56.425   3.603   0.065
   86   HH12  ARG  11          HH22      ARG  11  56.725   5.042  -0.852
   87   HH21  ARG  11          HH11      ARG  11  53.535   6.320  -0.391
   88   HH22  ARG  11          HH12      ARG  11  55.089   6.580  -1.110
   89    H    SER  12           HN       SER  12  54.180   0.821  -2.223
   90    HA   SER  12           HA       SER  12  56.625  -0.094  -3.607
   91    HG   SER  12           HG       SER  12  55.679  -2.282  -4.047
   92    HB2  SER  12           HB2      SER  12  53.899  -0.262  -4.925
   93    HB3  SER  12           HB1      SER  12  55.445  -0.658  -5.670
   94    H    ALA  13           HN       ALA  13  54.477   1.235  -5.796
   95    HA   ALA  13           HA       ALA  13  54.482   3.336  -6.853
   96    HB1  ALA  13           HB1      ALA  13  54.398   4.078  -3.918
   97    HB2  ALA  13           HB2      ALA  13  53.039   3.958  -5.035
   98    HB3  ALA  13           HB3      ALA  13  54.214   5.261  -5.213
   99    H    THR  14           HN       THR  14  55.692   5.725  -6.343
  100    HA   THR  14           HA       THR  14  58.451   5.401  -5.476
  101    HB   THR  14           HB       THR  14  58.023   5.927  -8.423
  102    HG1  THR  14           HG1      THR  14  59.174   3.564  -7.816
  103   HG21  THR  14          HG21      THR  14  60.122   6.704  -7.216
  104   HG22  THR  14          HG22      THR  14  60.392   5.620  -8.581
  105   HG23  THR  14          HG23      THR  14  60.486   5.002  -6.932
  106    H    ARG  15           HN       ARG  15  56.599   7.383  -7.822
  107    HA   ARG  15           HA       ARG  15  56.406   9.721  -7.965
  108    HE   ARG  15           HE       ARG  15  52.897  11.724  -5.065
  109    HB2  ARG  15           HB2      ARG  15  56.411   9.203  -4.988
  110    HB3  ARG  15           HB1      ARG  15  56.216  10.825  -5.646
  111    HG2  ARG  15           HG2      ARG  15  54.252  10.130  -6.907
  112    HG3  ARG  15           HG1      ARG  15  54.476   8.460  -6.387
  113    HD2  ARG  15           HD2      ARG  15  52.815   9.332  -4.928
  114    HD3  ARG  15           HD1      ARG  15  54.305   9.359  -3.985
  115   HH11  ARG  15          HH21      ARG  15  55.638  10.292  -3.541
  116   HH12  ARG  15          HH22      ARG  15  56.220  11.786  -2.885
  117   HH21  ARG  15          HH11      ARG  15  53.641  13.683  -4.217
  118   HH22  ARG  15          HH12      ARG  15  55.090  13.705  -3.268
  119    H    VAL  16           HN       VAL  16  57.896  10.890  -5.266
  120    HA   VAL  16           HA       VAL  16  60.664  10.729  -6.236
  121    HB   VAL  16           HB       VAL  16  60.827  13.248  -6.410
  122   HG11  VAL  16          HG11      VAL  16  60.541  11.611  -8.365
  123   HG12  VAL  16          HG12      VAL  16  60.111  13.291  -8.683
  124   HG13  VAL  16          HG13      VAL  16  58.847  12.099  -8.386
  125   HG21  VAL  16          HG21      VAL  16  58.708  13.688  -5.151
  126   HG22  VAL  16          HG22      VAL  16  57.801  13.043  -6.518
  127   HG23  VAL  16          HG23      VAL  16  58.759  14.511  -6.710
  128    H    MET  17           HN       MET  17  58.852  10.343  -3.775
  129    HA   MET  17           HA       MET  17  59.054  10.624  -1.457
  130    HB2  MET  17           HB2      MET  17  61.874  11.547  -2.055
  131    HB3  MET  17           HB1      MET  17  61.281  10.757  -0.594
  132    HG2  MET  17           HG2      MET  17  60.637   8.796  -2.162
  133    HG3  MET  17           HG1      MET  17  61.717   9.561  -3.328
  134    HE1  MET  17           HE1      MET  17  65.163   9.007  -2.225
  135    HE2  MET  17           HE2      MET  17  64.180  10.437  -2.531
  136    HE3  MET  17           HE3      MET  17  63.996   9.013  -3.554
  137    H    GLY  18           HN       GLY  18  59.487  12.332   0.253
  138    HA2  GLY  18           HA2      GLY  18  59.970  15.065  -0.546
  139    HA3  GLY  18           HA1      GLY  18  58.242  14.766  -0.349
  140    H    GLY  19           HN       GLY  19  58.105  16.122   1.518
  141    HA2  GLY  19           HA2      GLY  19  57.961  16.335   3.865
  142    HA3  GLY  19           HA1      GLY  19  58.758  14.767   4.014
  143    HA   PRO  20           HA       PRO  20  61.764  18.813   3.758
  144    HB2  PRO  20           HB2      PRO  20  60.758  19.303   6.545
  145    HB3  PRO  20           HB1      PRO  20  61.378  20.463   5.352
  146    HG2  PRO  20           HG2      PRO  20  58.768  20.198   5.805
  147    HG3  PRO  20           HG1      PRO  20  59.397  20.510   4.178
  148    HD2  PRO  20           HD2      PRO  20  58.233  18.007   5.288
  149    HD3  PRO  20           HD1      PRO  20  58.304  18.569   3.604
  150    H1U  RCY  21           H1U      RCY  21  67.458  11.649   3.529
  151    H1S  RCY  21           H1S      RCY  21  66.270  13.315   4.358
  152    HB1  RCY  21           HB1      RCY  21  66.004  16.183   4.413
  153    HB2  RCY  21           HB2      RCY  21  64.377  15.527   4.242
  154    HA   RCY  21           HA       RCY  21  64.157  16.456   6.746
  155    HN1  RCY  21           HN1      RCY  21  63.841  18.321   4.432
  156    H    THR  22           HN       THR  22  64.978  18.042   8.119
  157    HA   THR  22           HA       THR  22  66.706  20.155   7.505
  158    HB   THR  22           HB       THR  22  66.948  18.541  10.044
  159    HG1  THR  22           HG1      THR  22  64.728  18.955   9.384
  160   HG21  THR  22          HG21      THR  22  67.515  20.633  11.037
  161   HG22  THR  22          HG22      THR  22  66.962  21.534   9.626
  162   HG23  THR  22          HG23      THR  22  68.429  20.561   9.530
  163    HA   PRO  23           HA       PRO  23  70.304  17.539   6.538
  164    HB2  PRO  23           HB2      PRO  23  71.523  19.231   4.839
  165    HB3  PRO  23           HB1      PRO  23  70.055  18.352   4.364
  166    HG2  PRO  23           HG2      PRO  23  70.368  21.190   5.179
  167    HG3  PRO  23           HG1      PRO  23  69.296  20.473   3.966
  168    HD2  PRO  23           HD2      PRO  23  68.551  21.193   6.580
  169    HD3  PRO  23           HD1      PRO  23  67.629  20.128   5.497
  170    H    ARG  24           HN       ARG  24  71.836  17.455   8.162
  171    HA   ARG  24           HA       ARG  24  73.940  19.267   8.479
  172    HE   ARG  24           HE       ARG  24  71.719  21.815  11.488
  173    HB2  ARG  24           HB2      ARG  24  71.465  20.181   9.764
  174    HB3  ARG  24           HB1      ARG  24  72.790  20.038  10.914
  175    HG2  ARG  24           HG2      ARG  24  74.058  21.669   9.873
  176    HG3  ARG  24           HG1      ARG  24  73.366  21.340   8.284
  177    HD2  ARG  24           HD2      ARG  24  72.689  23.527   9.626
  178    HD3  ARG  24           HD1      ARG  24  71.493  22.649   8.673
  179   HH11  ARG  24          HH21      ARG  24  70.194  23.740   9.068
  180   HH12  ARG  24          HH22      ARG  24  68.737  23.965   9.976
  181   HH21  ARG  24          HH11      ARG  24  69.825  22.098  12.688
  182   HH22  ARG  24          HH12      ARG  24  68.528  23.036  12.026
  183    H    LYS  25           HN       LYS  25  72.098  18.285  11.331
  184    HA   LYS  25           HA       LYS  25  74.258  16.832  12.461
  185    HB2  LYS  25           HB2      LYS  25  71.682  17.565  13.264
  186    HB3  LYS  25           HB1      LYS  25  71.628  15.806  13.267
  187    HG2  LYS  25           HG2      LYS  25  72.428  16.314  15.422
  188    HG3  LYS  25           HG1      LYS  25  73.904  15.961  14.523
  189    HD2  LYS  25           HD2      LYS  25  74.380  18.297  14.224
  190    HD3  LYS  25           HD1      LYS  25  72.791  18.759  14.835
  191    HE2  LYS  25           HE2      LYS  25  74.696  17.173  16.549
  192    HE3  LYS  25           HE1      LYS  25  74.815  18.930  16.454
  193    HZ1  LYS  25           HZ1      LYS  25  72.900  17.314  17.825
  194    HZ2  LYS  25           HZ2      LYS  25  72.153  18.448  16.804
  195    HZ3  LYS  25           HZ3      LYS  25  73.241  18.967  18.001
  196    H    GLY  26           HN       GLY  26  75.096  15.423  10.838
  197    HA2  GLY  26           HA2      GLY  26  73.539  13.541   9.365
  198    HA3  GLY  26           HA1      GLY  26  75.268  13.388   9.680
  199    HA   PRO  27           HA       PRO  27  72.365  10.180  11.936
  200    HB2  PRO  27           HB2      PRO  27  74.443   8.512  10.563
  201    HB3  PRO  27           HB1      PRO  27  72.732   8.151  10.869
  202    HG2  PRO  27           HG2      PRO  27  73.602   8.930   8.467
  203    HG3  PRO  27           HG1      PRO  27  72.011   9.398   9.088
  204    HD2  PRO  27           HD2      PRO  27  74.434  11.065   8.712
  205    HD3  PRO  27           HD1      PRO  27  72.729  11.557   8.801
  206    HA   PRO  28           HA       PRO  28  75.417  10.733  15.257
  207    HB2  PRO  28           HB2      PRO  28  73.814   8.451  16.360
  208    HB3  PRO  28           HB1      PRO  28  74.331   9.951  17.155
  209    HG2  PRO  28           HG2      PRO  28  71.828   9.612  16.300
  210    HG3  PRO  28           HG1      PRO  28  72.634  11.187  16.219
  211    HD2  PRO  28           HD2      PRO  28  71.960   9.311  14.010
  212    HD3  PRO  28           HD1      PRO  28  72.176  11.075  13.967
  213    H    LYS  29           HN       LYS  29  77.161   9.424  16.178
  214    HA   LYS  29           HA       LYS  29  78.486   7.691  14.459
  215    HB2  LYS  29           HB2      LYS  29  78.628   7.133  17.409
  216    HB3  LYS  29           HB1      LYS  29  79.931   7.204  16.223
  217    HG2  LYS  29           HG2      LYS  29  80.282   9.237  17.252
  218    HG3  LYS  29           HG1      LYS  29  79.104   9.745  16.040
  219    HD2  LYS  29           HD2      LYS  29  78.138  10.617  17.965
  220    HD3  LYS  29           HD1      LYS  29  77.359   9.036  17.898
  221    HE2  LYS  29           HE2      LYS  29  79.352   8.214  19.330
  222    HE3  LYS  29           HE1      LYS  29  79.653   9.923  19.645
  223    HZ1  LYS  29           HZ1      LYS  29  77.145   8.435  20.204
  224    HZ2  LYS  29           HZ2      LYS  29  77.337  10.111  20.404
  225    HZ3  LYS  29           HZ3      LYS  29  78.244   9.031  21.350
  226    H1U  RCY  30           H1U      RCY  30  77.925   7.690  10.475
  227    H1S  RCY  30           H1S      RCY  30  76.217   3.426  11.765
  228    HB1  RCY  30           HB1      RCY  30  74.657   5.466  14.398
  229    HB2  RCY  30           HB2      RCY  30  73.857   4.061  15.101
  230    HA   RCY  30           HA       RCY  30  74.671   4.961  17.050
  231    HN1  RCY  30           HN1      RCY  30  75.898   6.930  16.719
  232    H    LYS  31           HN       LYS  31  74.899   2.526  17.169
  233    HA   LYS  31           HA       LYS  31  77.453   1.277  16.743
  234    HB2  LYS  31           HB2      LYS  31  78.028   1.004  19.193
  235    HB3  LYS  31           HB1      LYS  31  78.248   2.635  18.565
  236    HG2  LYS  31           HG2      LYS  31  76.931   3.337  20.264
  237    HG3  LYS  31           HG1      LYS  31  75.585   2.595  19.398
  238    HD2  LYS  31           HD2      LYS  31  75.463   1.575  21.510
  239    HD3  LYS  31           HD1      LYS  31  76.364   0.393  20.559
  240    HE2  LYS  31           HE2      LYS  31  77.585   0.636  22.594
  241    HE3  LYS  31           HE1      LYS  31  78.486   1.556  21.389
  242    HZ1  LYS  31           HZ1      LYS  31  76.462   3.132  22.629
  243    HZ2  LYS  31           HZ2      LYS  31  78.129   3.431  22.489
  244    HZ3  LYS  31           HZ3      LYS  31  77.536   2.496  23.778
  245    H    GLN  32           HN       GLN  32  77.379  -0.669  18.749
  246    HA   GLN  32           HA       GLN  32  76.192  -2.570  19.471
  247    HB2  GLN  32           HB2      GLN  32  74.356  -0.614  19.780
  248    HB3  GLN  32           HB1      GLN  32  73.568  -1.530  18.497
  249    HG2  GLN  32           HG2      GLN  32  72.761  -2.560  20.454
  250    HG3  GLN  32           HG1      GLN  32  74.092  -3.612  19.971
  251   HE21  GLN  32          HE21      GLN  32  75.174  -4.233  21.850
  252   HE22  GLN  32          HE22      GLN  32  75.599  -3.188  23.118
  253    H    ARG  33           HN       ARG  33  76.467  -1.433  16.378
  254    HA   ARG  33           HA       ARG  33  74.794  -3.165  14.862
  255    HE   ARG  33           HE       ARG  33  74.885  -5.275  13.633
  256    HB2  ARG  33           HB2      ARG  33  76.474  -1.157  14.215
  257    HB3  ARG  33           HB1      ARG  33  77.498  -2.520  13.778
  258    HG2  ARG  33           HG2      ARG  33  74.653  -2.095  12.816
  259    HG3  ARG  33           HG1      ARG  33  76.107  -1.788  11.865
  260    HD2  ARG  33           HD2      ARG  33  75.566  -3.944  11.169
  261    HD3  ARG  33           HD1      ARG  33  76.684  -4.283  12.491
  262   HH11  ARG  33          HH21      ARG  33  73.800  -3.005  11.276
  263   HH12  ARG  33          HH22      ARG  33  72.120  -3.335  11.538
  264   HH21  ARG  33          HH11      ARG  33  72.697  -5.719  13.988
  265   HH22  ARG  33          HH12      ARG  33  71.496  -4.871  13.073
  266    H    GLN  34           HN       GLN  34  78.284  -3.681  14.664
  267    HA   GLN  34           HA       GLN  34  78.388  -6.181  16.018
  268    HB2  GLN  34           HB2      GLN  34  76.930  -6.399  13.656
  269    HB3  GLN  34           HB1      GLN  34  78.534  -6.944  13.180
  270    HG2  GLN  34           HG2      GLN  34  77.457  -8.900  13.975
  271    HG3  GLN  34           HG1      GLN  34  78.485  -8.389  15.314
  272   HE21  GLN  34          HE21      GLN  34  77.421  -8.318  17.293
  273   HE22  GLN  34          HE22      GLN  34  75.753  -8.078  17.498
  274    H    THR  35           HN       THR  35  79.675  -5.718  12.754
  275    HA   THR  35           HA       THR  35  82.077  -4.390  13.320
  276    HB   THR  35           HB       THR  35  82.873  -5.985  14.844
  277    HG1  THR  35           HG1      THR  35  84.561  -6.799  13.804
  278   HG21  THR  35          HG21      THR  35  81.403  -7.739  14.959
  279   HG22  THR  35          HG22      THR  35  82.643  -8.530  13.986
  280   HG23  THR  35          HG23      THR  35  81.220  -7.836  13.208
  281    H    ARG  36           HN       ARG  36  80.813  -7.269  11.644
  282    HA   ARG  36           HA       ARG  36  80.979  -6.222   9.043
  283    HE   ARG  36           HE       ARG  36  83.042  -4.587   5.574
  284    HB2  ARG  36           HB2      ARG  36  83.574  -6.940  10.115
  285    HB3  ARG  36           HB1      ARG  36  83.185  -7.998   8.763
  286    HG2  ARG  36           HG2      ARG  36  82.770  -5.020   8.553
  287    HG3  ARG  36           HG1      ARG  36  84.352  -5.735   8.243
  288    HD2  ARG  36           HD2      ARG  36  83.657  -6.781   6.318
  289    HD3  ARG  36           HD1      ARG  36  82.013  -7.013   6.913
  290   HH11  ARG  36          HH21      ARG  36  80.579  -6.225   7.346
  291   HH12  ARG  36          HH22      ARG  36  79.327  -5.120   6.884
  292   HH21  ARG  36          HH11      ARG  36  81.422  -3.136   4.961
  293   HH22  ARG  36          HH12      ARG  36  79.804  -3.371   5.534
  294    H    GLN  37           HN       GLN  37  80.296  -8.552  11.233
  295    HA   GLN  37           HA       GLN  37  80.304 -10.961   9.670
  296    HB2  GLN  37           HB2      GLN  37  78.769 -10.055  12.107
  297    HB3  GLN  37           HB1      GLN  37  78.466 -11.627  11.368
  298    HG2  GLN  37           HG2      GLN  37  81.298 -10.840  11.959
  299    HG3  GLN  37           HG1      GLN  37  80.273 -11.380  13.289
  300   HE21  GLN  37          HE21      GLN  37  79.055 -13.542  12.799
  301   HE22  GLN  37          HE22      GLN  37  79.924 -14.724  11.945
  302    H1U  RCY  38           H1U      RCY  38  79.449  -6.375   2.944
  303    H1S  RCY  38           H1S      RCY  38  76.225  -8.923   3.975
  304    HB1  RCY  38           HB1      RCY  38  77.824  -8.676   5.919
  305    HB2  RCY  38           HB2      RCY  38  77.285  -8.260   7.546
  306    HA   RCY  38           HA       RCY  38  76.391 -10.690   7.646
  307    HN1  RCY  38           HN1      RCY  38  79.297 -10.871   7.681
  308    H    LYS  39           HN       LYS  39  79.400 -10.745   5.752
  309    HA   LYS  39           HA       LYS  39  78.363 -11.695   3.322
  310    HB2  LYS  39           HB2      LYS  39  80.589 -12.585   2.871
  311    HB3  LYS  39           HB1      LYS  39  80.737 -11.023   3.671
  312    HG2  LYS  39           HG2      LYS  39  80.841 -13.678   5.134
  313    HG3  LYS  39           HG1      LYS  39  82.272 -12.793   4.606
  314    HD2  LYS  39           HD2      LYS  39  81.124 -10.787   5.885
  315    HD3  LYS  39           HD1      LYS  39  80.287 -12.084   6.738
  316    HE2  LYS  39           HE2      LYS  39  82.257 -11.640   8.013
  317    HE3  LYS  39           HE1      LYS  39  82.588 -13.127   7.125
  318    HZ1  LYS  39           HZ1      LYS  39  83.320 -11.048   5.459
  319    HZ2  LYS  39           HZ2      LYS  39  84.351 -12.122   6.278
  320    HZ3  LYS  39           HZ3      LYS  39  83.928 -10.639   6.989
  321    H    SER  40           HN       SER  40  77.792 -13.708   2.574
  322    HA   SER  40           HA       SER  40  78.079 -16.062   4.346
  323    HG   SER  40           HG       SER  40  75.016 -15.115   5.675
  324    HB2  SER  40           HB2      SER  40  75.433 -14.892   3.466
  325    HB3  SER  40           HB1      SER  40  75.600 -16.575   3.955
  326    H    LYS  41           HN       LYS  41  76.926 -14.728   1.259
  327    HA   LYS  41           HA       LYS  41  77.297 -17.386  -0.016
  328    HB2  LYS  41           HB2      LYS  41  75.755 -14.938  -0.619
  329    HB3  LYS  41           HB1      LYS  41  76.520 -15.668  -2.029
  330    HG2  LYS  41           HG2      LYS  41  74.296 -16.634  -1.724
  331    HG3  LYS  41           HG1      LYS  41  75.518 -17.863  -1.393
  332    HD2  LYS  41           HD2      LYS  41  75.096 -16.542   1.059
  333    HD3  LYS  41           HD1      LYS  41  73.490 -16.796   0.375
  334    HE2  LYS  41           HE2      LYS  41  75.616 -18.884   0.907
  335    HE3  LYS  41           HE1      LYS  41  74.015 -18.769   1.639
  336    HZ1  LYS  41           HZ1      LYS  41  74.777 -19.670  -1.041
  337    HZ2  LYS  41           HZ2      LYS  41  73.279 -18.890  -0.857
  338    HZ3  LYS  41           HZ3      LYS  41  73.618 -20.303   0.024
  339    HA   PRO  42           HA       PRO  42  81.256 -16.227  -1.624
  340    HB2  PRO  42           HB2      PRO  42  81.333 -17.710  -3.925
  341    HB3  PRO  42           HB1      PRO  42  81.495 -18.422  -2.308
  342    HG2  PRO  42           HG2      PRO  42  79.115 -18.317  -4.092
  343    HG3  PRO  42           HG1      PRO  42  79.695 -19.633  -3.057
  344    HD2  PRO  42           HD2      PRO  42  77.626 -17.981  -2.347
  345    HD3  PRO  42           HD1      PRO  42  78.693 -18.762  -1.160
  346    HA   PRO  43           HA       PRO  43  80.761 -12.982  -4.594
  347    HB2  PRO  43           HB2      PRO  43  83.185 -13.017  -5.888
  348    HB3  PRO  43           HB1      PRO  43  82.962 -12.390  -4.244
  349    HG2  PRO  43           HG2      PRO  43  84.018 -15.026  -5.130
  350    HG3  PRO  43           HG1      PRO  43  84.554 -13.982  -3.804
  351    HD2  PRO  43           HD2      PRO  43  83.002 -16.197  -3.402
  352    HD3  PRO  43           HD1      PRO  43  82.930 -14.767  -2.348
  353    H    LYS  44           HN       LYS  44  79.540 -13.050  -6.429
  354    HA   LYS  44           HA       LYS  44  80.363 -14.910  -8.622
  355    HB2  LYS  44           HB2      LYS  44  78.344 -15.683  -7.180
  356    HB3  LYS  44           HB1      LYS  44  77.464 -14.376  -7.972
  357    HG2  LYS  44           HG2      LYS  44  77.984 -15.317 -10.172
  358    HG3  LYS  44           HG1      LYS  44  78.946 -16.591  -9.422
  359    HD2  LYS  44           HD2      LYS  44  76.812 -17.200  -8.120
  360    HD3  LYS  44           HD1      LYS  44  75.958 -16.178  -9.275
  361    HE2  LYS  44           HE2      LYS  44  76.836 -17.524 -11.138
  362    HE3  LYS  44           HE1      LYS  44  77.721 -18.538  -9.997
  363    HZ1  LYS  44           HZ1      LYS  44  74.866 -18.444 -10.575
  364    HZ2  LYS  44           HZ2      LYS  44  75.309 -18.709  -8.956
  365    HZ3  LYS  44           HZ3      LYS  44  75.849 -19.766 -10.171
  366    H    LYS  45           HN       LYS  45  79.600 -11.782  -7.642
  367    HA   LYS  45           HA       LYS  45  79.876 -10.728 -10.307
  368    HB2  LYS  45           HB2      LYS  45  77.341 -11.623  -9.899
  369    HB3  LYS  45           HB1      LYS  45  77.185  -9.987  -9.263
  370    HG2  LYS  45           HG2      LYS  45  78.014  -9.043 -11.348
  371    HG3  LYS  45           HG1      LYS  45  78.343 -10.655 -11.986
  372    HD2  LYS  45           HD2      LYS  45  75.573 -10.183 -11.032
  373    HD3  LYS  45           HD1      LYS  45  76.046  -9.310 -12.490
  374    HE2  LYS  45           HE2      LYS  45  75.042 -11.675 -12.791
  375    HE3  LYS  45           HE1      LYS  45  76.525 -11.302 -13.669
  376    HZ1  LYS  45           HZ1      LYS  45  76.165 -12.955 -11.259
  377    HZ2  LYS  45           HZ2      LYS  45  77.667 -12.226 -11.575
  378    HZ3  LYS  45           HZ3      LYS  45  76.999 -13.319 -12.691
  379    H    GLY  46           HN       GLY  46  78.716  -8.220  -9.974
  380    HA2  GLY  46           HA2      GLY  46  79.258  -6.160  -8.986
  381    HA3  GLY  46           HA1      GLY  46  78.878  -6.980  -7.470
  382    H    VAL  47           HN       VAL  47  81.509  -7.837  -9.685
  383    HA   VAL  47           HA       VAL  47  83.822  -7.950  -9.313
  384    HB   VAL  47           HB       VAL  47  83.438  -5.656  -7.383
  385   HG11  VAL  47          HG11      VAL  47  85.700  -6.588  -7.574
  386   HG12  VAL  47          HG12      VAL  47  85.643  -4.989  -8.316
  387   HG13  VAL  47          HG13      VAL  47  85.632  -6.432  -9.329
  388   HG21  VAL  47          HG21      VAL  47  83.326  -5.680 -10.407
  389   HG22  VAL  47          HG22      VAL  47  83.731  -4.228  -9.491
  390   HG23  VAL  47          HG23      VAL  47  82.154  -4.989  -9.285
  391    H    GLN  48           HN       GLN  48  85.411  -8.608  -7.673
  392    HA   GLN  48           HA       GLN  48  84.079  -9.746  -5.245
  393    HB2  GLN  48           HB2      GLN  48  86.758 -10.646  -6.284
  394    HB3  GLN  48           HB1      GLN  48  85.571 -11.550  -5.342
  395    HG2  GLN  48           HG2      GLN  48  84.021 -11.389  -7.345
  396    HG3  GLN  48           HG1      GLN  48  85.394 -10.765  -8.259
  397   HE21  GLN  48          HE21      GLN  48  87.179 -12.241  -8.711
  398   HE22  GLN  48          HE22      GLN  48  87.018 -13.917  -8.496
  399    H    GLY  49           HN       GLY  49  85.537  -7.027  -5.858
  400    HA2  GLY  49           HA2      GLY  49  87.891  -6.986  -4.219
  401    HA3  GLY  49           HA1      GLY  49  86.939  -5.570  -4.664
  402    H1U  RCY  50           H1U      RCY  50  82.311  -2.945   3.097
  403    H1S  RCY  50           H1S      RCY  50  85.264  -5.241   1.478
  404    HB1  RCY  50           HB1      RCY  50  87.761  -7.672   0.367
  405    HB2  RCY  50           HB2      RCY  50  86.290  -8.175  -0.466
  406    HA   RCY  50           HA       RCY  50  85.596  -5.729  -0.475
  407    HN1  RCY  50           HN1      RCY  50  88.060  -5.920  -2.074
  408    H    GLY  51           HN       GLY  51  88.001  -4.088  -1.339
  409    HA2  GLY  51           HA2      GLY  51  89.364  -2.440  -0.378
  410    HA3  GLY  51           HA1      GLY  51  88.323  -2.565   1.040
  411    H    ASP  52           HN       ASP  52  88.830  -4.316   2.595
  412    HA   ASP  52           HA       ASP  52  90.402  -5.324   4.022
  413    HB2  ASP  52           HB2      ASP  52  91.331  -6.163   1.270
  414    HB3  ASP  52           HB1      ASP  52  92.125  -6.737   2.737
  415    H    ASP  53           HN       ASP  53  90.904  -2.652   3.821
  416    HA   ASP  53           HA       ASP  53  93.771  -2.536   4.288
  417    HB2  ASP  53           HB2      ASP  53  93.799  -2.396   1.842
  418    HB3  ASP  53           HB1      ASP  53  92.620  -1.084   1.885
  419    H    ILE  54           HN       ILE  54  91.926   0.175   3.007
  420    HA   ILE  54           HA       ILE  54  92.308   1.637   5.494
  421    HB   ILE  54           HB       ILE  54  92.413   2.835   3.372
  422   HG12  ILE  54          HG12      ILE  54  89.859   3.621   4.804
  423   HG13  ILE  54          HG11      ILE  54  91.470   3.958   5.439
  424   HG21  ILE  54          HG21      ILE  54  90.683   1.218   2.319
  425   HG22  ILE  54          HG22      ILE  54  90.636   2.908   1.817
  426   HG23  ILE  54          HG23      ILE  54  89.468   2.305   2.992
  427   HD11  ILE  54          HD11      ILE  54  90.606   5.902   4.199
  428   HD12  ILE  54          HD12      ILE  54  90.395   4.899   2.764
  429   HD13  ILE  54          HD13      ILE  54  92.014   5.220   3.385
  430    HA   PRO  55           HA       PRO  55  88.365   0.130   7.081
  431    HB2  PRO  55           HB2      PRO  55  88.501   1.261   9.544
  432    HB3  PRO  55           HB1      PRO  55  89.497  -0.137   9.095
  433    HG2  PRO  55           HG2      PRO  55  90.251   2.738   9.246
  434    HG3  PRO  55           HG1      PRO  55  91.170   1.302   9.726
  435    HD2  PRO  55           HD2      PRO  55  91.562   2.663   7.348
  436    HD3  PRO  55           HD1      PRO  55  91.981   0.954   7.598
  437    H    GLY  56           HN       GLY  56  86.946   1.841   8.968
  438    HA2  GLY  56           HA2      GLY  56  85.570   3.556   7.093
  439    HA3  GLY  56           HA1      GLY  56  85.274   3.491   8.832
  440    H    MET  57           HN       MET  57  88.454   4.133   7.456
  441    HA   MET  57           HA       MET  57  89.868   5.978   7.780
  442    HB2  MET  57           HB2      MET  57  88.391   6.897   6.035
  443    HB3  MET  57           HB1      MET  57  87.250   7.428   7.270
  444    HG2  MET  57           HG2      MET  57  88.708   9.291   6.545
  445    HG3  MET  57           HG1      MET  57  88.972   8.898   8.244
  446    HE1  MET  57           HE1      MET  57  91.777   8.595   4.714
  447    HE2  MET  57           HE2      MET  57  90.766   9.950   5.213
  448    HE3  MET  57           HE3      MET  57  90.015   8.460   4.647
  449    H    GLU  58           HN       GLU  58  87.126   7.779   9.026
  450    HA   GLU  58           HA       GLU  58  88.507   7.931  11.660
  451    HB2  GLU  58           HB2      GLU  58  87.964  10.066  10.559
  452    HB3  GLU  58           HB1      GLU  58  86.263   9.607  10.488
  453    HG2  GLU  58           HG2      GLU  58  87.703   9.609  13.129
  454    HG3  GLU  58           HG1      GLU  58  87.088  11.121  12.462
  455    H    GLY  59           HN       GLY  59  85.711   6.619  10.109
  456    HA2  GLY  59           HA2      GLY  59  84.693   4.737  11.519
  457    HA3  GLY  59           HA1      GLY  59  84.511   5.966  12.773
  458    H1U  RCY  60           H1U      RCY  60  77.906   3.505   5.545
  459    H1S  RCY  60           H1S      RCY  60  79.510   5.130   8.899
  460    HB1  RCY  60           HB1      RCY  60  79.380   6.048  12.843
  461    HB2  RCY  60           HB2      RCY  60  80.090   4.641  12.055
  462    HA   RCY  60           HA       RCY  60  80.803   6.420  10.227
  463    HN1  RCY  60           HN1      RCY  60  82.197   5.772  12.760
  464    H    GLY  61           HN       GLY  61  81.982   7.998  13.025
  465    HA2  GLY  61           HA2      GLY  61  80.096  10.058  13.438
  466    HA3  GLY  61           HA1      GLY  61  81.835  10.253  13.674
  467    H    THR  62           HN       THR  62  82.640   9.748  10.989
  468    HA   THR  62           HA       THR  62  82.562  12.293   9.825
  469    HB   THR  62           HB       THR  62  84.135  10.998   8.754
  470    HG1  THR  62           HG1      THR  62  83.409  11.301   6.828
  471   HG21  THR  62          HG21      THR  62  82.132   8.762   9.071
  472   HG22  THR  62          HG22      THR  62  83.730   8.913   9.804
  473   HG23  THR  62          HG23      THR  62  83.578   8.576   8.079
  474    H    ASP  63           HN       ASP  63  80.857  13.423   9.088
  475    HA   ASP  63           HA       ASP  63  78.274  12.215   8.631
  476    HB2  ASP  63           HB2      ASP  63  77.746  14.534   7.670
  477    HB3  ASP  63           HB1      ASP  63  78.272  14.487   9.353
  478    H    ILE  64           HN       ILE  64  79.914  10.764   7.032
  479    HA   ILE  64           HA       ILE  64  80.443  10.169   4.815
  480    HB   ILE  64           HB       ILE  64  78.074   9.559   4.951
  481   HG12  ILE  64          HG12      ILE  64  78.277  10.955   2.305
  482   HG13  ILE  64          HG11      ILE  64  79.468   9.714   2.698
  483   HG21  ILE  64          HG21      ILE  64  77.088  11.656   5.618
  484   HG22  ILE  64          HG22      ILE  64  76.383  11.219   4.062
  485   HG23  ILE  64          HG23      ILE  64  77.646  12.447   4.143
  486   HD11  ILE  64          HD11      ILE  64  76.454   9.380   2.677
  487   HD12  ILE  64          HD12      ILE  64  77.590   8.146   3.222
  488   HD13  ILE  64          HD13      ILE  64  77.599   8.670   1.538
  489    H    THR  65           HN       THR  65  80.644  13.227   5.622
  490    HA   THR  65           HA       THR  65  80.750  15.305   4.368
  491    HB   THR  65           HB       THR  65  83.032  14.658   4.655
  492    HG1  THR  65           HG1      THR  65  83.731  14.951   2.254
  493   HG21  THR  65          HG21      THR  65  82.999  12.333   4.184
  494   HG22  THR  65          HG22      THR  65  84.053  13.025   2.951
  495   HG23  THR  65          HG23      THR  65  82.392  12.592   2.549
  496    H    VAL  66           HN       VAL  66  78.626  13.964   3.256
  497    HA   VAL  66           HA       VAL  66  77.351  13.994   1.284
  498    HB   VAL  66           HB       VAL  66  79.710  15.026  -0.278
  499   HG11  VAL  66          HG11      VAL  66  77.934  16.281  -1.432
  500   HG12  VAL  66          HG12      VAL  66  76.743  15.664  -0.287
  501   HG13  VAL  66          HG13      VAL  66  77.551  14.559  -1.400
  502   HG21  VAL  66          HG21      VAL  66  78.577  17.332   0.562
  503   HG22  VAL  66          HG22      VAL  66  79.960  16.601   1.376
  504   HG23  VAL  66          HG23      VAL  66  78.331  16.347   2.005
  505    H    ILE  67           HN       ILE  67  80.743  13.031   0.918
  506    HA   ILE  67           HA       ILE  67  79.829  10.477  -0.305
  507    HB   ILE  67           HB       ILE  67  81.920  12.365  -1.406
  508   HG12  ILE  67          HG12      ILE  67  79.786  10.772  -2.841
  509   HG13  ILE  67          HG11      ILE  67  79.463  12.366  -2.156
  510   HG21  ILE  67          HG21      ILE  67  81.659   9.375  -1.720
  511   HG22  ILE  67          HG22      ILE  67  83.107  10.319  -1.368
  512   HG23  ILE  67          HG23      ILE  67  82.393  10.366  -2.980
  513   HD11  ILE  67          HD11      ILE  67  80.076  12.624  -4.500
  514   HD12  ILE  67          HD12      ILE  67  81.553  11.693  -4.248
  515   HD13  ILE  67          HD13      ILE  67  81.369  13.277  -3.493
  516    H1U  RCY  68           H1U      RCY  68  75.973   3.814   2.135
  517    H1S  RCY  68           H1S      RCY  68  79.454   5.849   3.113
  518    HB1  RCY  68           HB1      RCY  68  80.741   8.039   3.541
  519    HB2  RCY  68           HB2      RCY  68  82.327   7.348   3.886
  520    HA   RCY  68           HA       RCY  68  82.686   9.588   3.062
  521    HN1  RCY  68           HN1      RCY  68  80.451   9.092   1.336
  522    HA   PRO  69           HA       PRO  69  85.780   8.641  -0.016
  523    HB2  PRO  69           HB2      PRO  69  87.950   8.529   1.722
  524    HB3  PRO  69           HB1      PRO  69  87.300  10.001   0.981
  525    HG2  PRO  69           HG2      PRO  69  86.932   8.937   3.717
  526    HG3  PRO  69           HG1      PRO  69  86.978  10.613   3.150
  527    HD2  PRO  69           HD2      PRO  69  84.657   9.302   3.841
  528    HD3  PRO  69           HD1      PRO  69  84.719  10.658   2.695
  529    H    TRP  70           HN       TRP  70  85.711   6.681   2.983
  530    HA   TRP  70           HA       TRP  70  87.290   4.563   1.794
  531    HD1  TRP  70           HD1      TRP  70  86.482   6.986   4.595
  532    HE1  TRP  70           HE1      TRP  70  84.458   7.716   6.013
  533    HE3  TRP  70           HE3      TRP  70  83.811   2.634   4.623
  534    HZ2  TRP  70           HZ2      TRP  70  82.023   6.599   7.027
  535    HZ3  TRP  70           HZ3      TRP  70  81.649   2.494   5.819
  536    HH2  TRP  70           HH2      TRP  70  80.750   4.467   7.020
  537    HB2  TRP  70           HB2      TRP  70  86.085   3.228   3.767
  538    HB3  TRP  70           HB1      TRP  70  87.379   4.375   4.094
  539    H    GLU  71           HN       GLU  71  85.277   5.276  -0.027
  540    HA   GLU  71           HA       GLU  71  84.083   2.673  -0.497
  541    HB2  GLU  71           HB2      GLU  71  82.159   2.992   0.650
  542    HB3  GLU  71           HB1      GLU  71  82.609   4.641   1.015
  543    HG2  GLU  71           HG2      GLU  71  80.610   4.863  -0.247
  544    HG3  GLU  71           HG1      GLU  71  81.895   5.192  -1.409
  545    H    ALA  72           HN       ALA  72  85.262   5.591  -1.501
  546    HA   ALA  72           HA       ALA  72  83.698   6.099  -3.860
  547    HB1  ALA  72           HB1      ALA  72  85.626   7.453  -4.588
  548    HB2  ALA  72           HB2      ALA  72  86.610   6.744  -3.308
  549    HB3  ALA  72           HB3      ALA  72  85.239   7.774  -2.897
  550    H1U  RCY  73           H1U      RCY  73  80.513  -2.183  -1.788
  551    H1S  RCY  73           H1S      RCY  73  84.090  -0.203  -1.540
  552    HB1  RCY  73           HB1      RCY  73  85.262   0.311  -5.435
  553    HB2  RCY  73           HB2      RCY  73  83.789   1.078  -4.841
  554    HA   RCY  73           HA       RCY  73  86.467   2.439  -5.269
  555    HN1  RCY  73           HN1      RCY  73  84.339   3.274  -3.573
  556    H    ASN  74           HN       ASN  74  83.131   3.394  -5.991
  557    HA   ASN  74           HA       ASN  74  82.110   3.907  -8.038
  558    HB2  ASN  74           HB2      ASN  74  84.352   5.262  -8.133
  559    HB3  ASN  74           HB1      ASN  74  84.843   4.036  -9.301
  560   HD21  ASN  74          HD21      ASN  74  82.549   6.681  -8.727
  561   HD22  ASN  74          HD22      ASN  74  82.008   6.792 -10.332
  562    H    HIS  75           HN       HIS  75  81.777   1.379  -7.695
  563    HA   HIS  75           HA       HIS  75  82.078   0.179 -10.321
  564    HD1  HIS  75           HD1      HIS  75  85.963   0.382  -9.641
  565    HD2  HIS  75           HD2      HIS  75  83.285  -1.938 -11.843
  566    HE1  HIS  75           HE1      HIS  75  86.961   0.142 -11.957
  567    HE2  HIS  75           HE2      HIS  75  85.341  -1.268 -13.307
  568    HB2  HIS  75           HB2      HIS  75  84.058  -0.393  -8.235
  569    HB3  HIS  75           HB1      HIS  75  83.261  -1.856  -8.807
  570    H1U  RCY  76           H1U      RCY  76  79.714  -3.458  -0.893
  571    H1S  RCY  76           H1S      RCY  76  79.160  -2.236  -4.749
  572    HB1  RCY  76           HB1      RCY  76  80.099  -1.947  -6.650
  573    HB2  RCY  76           HB2      RCY  76  80.353  -3.689  -6.588
  574    HA   RCY  76           HA       RCY  76  79.980  -3.967  -8.855
  575    HN1  RCY  76           HN1      RCY  76  81.719  -2.530  -9.477
  576    H    GLU  77           HN       GLU  77  79.424  -0.809  -9.895
  577    HA   GLU  77           HA       GLU  77  76.590  -0.585  -9.661
  578    HB2  GLU  77           HB2      GLU  77  76.867   0.830 -11.812
  579    HB3  GLU  77           HB1      GLU  77  77.714   1.373 -10.365
  580    HG2  GLU  77           HG2      GLU  77  79.770   0.928 -11.245
  581    HG3  GLU  77           HG1      GLU  77  79.218  -0.549 -12.036
  582    H    LEU  78           HN       LEU  78  75.275  -2.248 -10.310
  583    HA   LEU  78           HA       LEU  78  75.973  -3.930 -12.595
  584    HG   LEU  78           HG       LEU  78  73.286  -4.939 -13.247
  585    HB2  LEU  78           HB2      LEU  78  74.760  -4.813 -10.598
  586    HB3  LEU  78           HB1      LEU  78  73.382  -3.799 -11.019
  587   HD11  LEU  78          HD11      LEU  78  75.621  -6.372 -12.028
  588   HD12  LEU  78          HD12      LEU  78  75.395  -5.814 -13.686
  589   HD13  LEU  78          HD13      LEU  78  74.555  -7.258 -13.119
  590   HD21  LEU  78          HD21      LEU  78  72.447  -7.132 -12.328
  591   HD22  LEU  78          HD22      LEU  78  71.805  -5.717 -11.494
  592   HD23  LEU  78          HD23      LEU  78  73.100  -6.662 -10.758
  593    H    HIS  79           HN       HIS  79  72.640  -3.005 -12.376
  594    HA   HIS  79           HA       HIS  79  72.696  -0.857 -14.293
  595    HD1  HIS  79           HD1      HIS  79  71.099  -3.850 -13.317
  596    HD2  HIS  79           HD2      HIS  79  71.847  -4.988 -17.260
  597    HE1  HIS  79           HE1      HIS  79  70.115  -6.168 -13.592
  598    HE2  HIS  79           HE2      HIS  79  70.564  -6.873 -15.987
  599    HB2  HIS  79           HB2      HIS  79  71.875  -2.039 -16.260
  600    HB3  HIS  79           HB1      HIS  79  73.410  -2.750 -15.763
  601    H    GLU  80           HN       GLU  80  71.301  -0.662 -12.124
  602    HA   GLU  80           HA       GLU  80  68.511  -0.849 -13.006
  603    HB2  GLU  80           HB2      GLU  80  67.759  -2.106 -11.007
  604    HB3  GLU  80           HB1      GLU  80  68.830  -3.072 -12.021
  605    HG2  GLU  80           HG2      GLU  80  70.716  -2.082 -10.470
  606    HG3  GLU  80           HG1      GLU  80  69.380  -1.814  -9.349
  607    H    LEU  81           HN       LEU  81  70.342  -0.421  -9.943
  608    HA   LEU  81           HA       LEU  81  68.733   2.035  -9.437
  609    HG   LEU  81           HG       LEU  81  71.414  -0.062  -8.467
  610    HB2  LEU  81           HB2      LEU  81  69.624   1.888  -7.144
  611    HB3  LEU  81           HB1      LEU  81  68.852   0.376  -7.616
  612   HD11  LEU  81          HD11      LEU  81  72.269   2.006  -7.512
  613   HD12  LEU  81          HD12      LEU  81  72.873   0.651  -6.558
  614   HD13  LEU  81          HD13      LEU  81  71.536   1.629  -5.953
  615   HD21  LEU  81          HD21      LEU  81  70.287  -0.586  -5.697
  616   HD22  LEU  81          HD22      LEU  81  71.636  -1.453  -6.431
  617   HD23  LEU  81          HD23      LEU  81  70.019  -1.590  -7.122
  618    H    ALA  82           HN       ALA  82  71.677   1.144 -10.767
  619    HA   ALA  82           HA       ALA  82  73.395   3.202  -9.708
  620    HB1  ALA  82           HB1      ALA  82  73.469   1.695 -12.338
  621    HB2  ALA  82           HB2      ALA  82  74.348   1.284 -10.865
  622    HB3  ALA  82           HB3      ALA  82  74.761   2.747 -11.759
  623    H    GLN  83           HN       GLN  83  70.764   4.242 -10.470
  624    HA   GLN  83           HA       GLN  83  70.608   5.557 -12.925
  625    HB2  GLN  83           HB2      GLN  83  69.851   6.540 -10.162
  626    HB3  GLN  83           HB1      GLN  83  69.430   7.406 -11.641
  627    HG2  GLN  83           HG2      GLN  83  68.751   4.487 -11.287
  628    HG3  GLN  83           HG1      GLN  83  67.679   5.756 -10.695
  629   HE21  GLN  83          HE21      GLN  83  66.271   4.596 -12.493
  630   HE22  GLN  83          HE22      GLN  83  66.387   5.252 -14.054
  631    H    TYR  84           HN       TYR  84  72.742   6.192 -10.245
  632    HA   TYR  84           HA       TYR  84  74.507   7.805 -11.848
  633    HD1  TYR  84           HD1      TYR  84  75.178   9.966 -12.608
  634    HD2  TYR  84           HD2      TYR  84  70.996   9.986 -11.630
  635    HE1  TYR  84           HE1      TYR  84  74.676  11.059 -14.777
  636    HE2  TYR  84           HE2      TYR  84  70.494  11.078 -13.799
  637    HH   TYR  84           HH       TYR  84  72.103  12.677 -15.467
  638    HB2  TYR  84           HB2      TYR  84  72.523   9.177 -10.070
  639    HB3  TYR  84           HB1      TYR  84  74.163   9.823 -10.125
  640    H    GLY  85           HN       GLY  85  74.222   5.572  -9.757
  641    HA2  GLY  85           HA2      GLY  85  75.796   4.671  -8.238
  642    HA3  GLY  85           HA1      GLY  85  76.725   6.165  -8.372
  643    H    ILE  86           HN       ILE  86  75.499   8.127  -7.368
  644    HA   ILE  86           HA       ILE  86  74.767   9.139  -5.397
  645    HB   ILE  86           HB       ILE  86  72.771   7.306  -6.239
  646   HG12  ILE  86          HG12      ILE  86  72.625   9.795  -5.854
  647   HG13  ILE  86          HG11      ILE  86  71.270   8.889  -5.179
  648   HG21  ILE  86          HG21      ILE  86  73.448   5.944  -4.246
  649   HG22  ILE  86          HG22      ILE  86  71.788   6.532  -4.152
  650   HG23  ILE  86          HG23      ILE  86  73.057   7.325  -3.219
  651   HD11  ILE  86          HD11      ILE  86  73.713   9.581  -3.540
  652   HD12  ILE  86          HD12      ILE  86  72.134   9.045  -2.965
  653   HD13  ILE  86          HD13      ILE  86  72.322  10.659  -3.652
  654    H1U  RCY  87           H1U      RCY  87  78.633   2.392   1.017
  655    H1S  RCY  87           H1S      RCY  87  76.551   3.401  -2.286
  656    HB1  RCY  87           HB1      RCY  87  78.747   4.669  -3.167
  657    HB2  RCY  87           HB2      RCY  87  78.515   5.367  -4.767
  658    HA   RCY  87           HA       RCY  87  76.300   5.368  -2.712
  659    HN1  RCY  87           HN1      RCY  87  76.409   6.250  -5.395
  Start of MODEL   89
    1    HA   MET   1           HA       MET   1  51.168   9.637  -4.592
    2    HB2  MET   1           HB2      MET   1  50.862   7.118  -6.238
    3    HB3  MET   1           HB1      MET   1  49.499   7.868  -5.407
    4    HG2  MET   1           HG2      MET   1  51.297   9.415  -7.282
    5    HG3  MET   1           HG1      MET   1  49.851   8.574  -7.840
    6    HE1  MET   1           HE1      MET   1  49.826  11.113  -8.685
    7    HE2  MET   1           HE2      MET   1  50.788  11.999  -7.504
    8    HE3  MET   1           HE3      MET   1  49.100  12.435  -7.763
    9    H    ASN   2           HN       ASN   2  53.246   7.877  -3.168
   10    HA   ASN   2           HA       ASN   2  51.514   6.040  -1.634
   11    HB2  ASN   2           HB2      ASN   2  53.751   5.693  -0.361
   12    HB3  ASN   2           HB1      ASN   2  53.651   5.115  -2.024
   13   HD21  ASN   2          HD21      ASN   2  55.128   5.993  -3.521
   14   HD22  ASN   2          HD22      ASN   2  56.171   7.288  -3.182
   15    H    LEU   3           HN       LEU   3  50.164   7.835  -0.769
   16    HA   LEU   3           HA       LEU   3  51.404   9.771   1.027
   17    HG   LEU   3           HG       LEU   3  48.463   7.759   0.563
   18    HB2  LEU   3           HB2      LEU   3  49.160  10.535   1.461
   19    HB3  LEU   3           HB1      LEU   3  49.256  10.158  -0.257
   20   HD11  LEU   3          HD11      LEU   3  46.711   9.059   2.468
   21   HD12  LEU   3          HD12      LEU   3  48.395   9.237   2.961
   22   HD13  LEU   3          HD13      LEU   3  47.722   7.631   2.687
   23   HD21  LEU   3          HD21      LEU   3  46.060   8.631   0.334
   24   HD22  LEU   3          HD22      LEU   3  47.152   8.998  -1.001
   25   HD23  LEU   3          HD23      LEU   3  46.770  10.239   0.192
   26    H    GLU   4           HN       GLU   4  49.661   6.703   1.367
   27    HA   GLU   4           HA       GLU   4  49.658   6.817   4.273
   28    HB2  GLU   4           HB2      GLU   4  48.284   5.343   2.390
   29    HB3  GLU   4           HB1      GLU   4  49.427   4.154   3.009
   30    HG2  GLU   4           HG2      GLU   4  47.728   5.888   4.820
   31    HG3  GLU   4           HG1      GLU   4  47.214   4.294   4.266
   32    HA   PRO   5           HA       PRO   5  54.025   5.913   4.810
   33    HB2  PRO   5           HB2      PRO   5  52.866   4.396   7.131
   34    HB3  PRO   5           HB1      PRO   5  54.279   5.471   7.085
   35    HG2  PRO   5           HG2      PRO   5  51.919   6.291   8.029
   36    HG3  PRO   5           HG1      PRO   5  52.995   7.376   7.133
   37    HD2  PRO   5           HD2      PRO   5  50.410   6.202   6.289
   38    HD3  PRO   5           HD1      PRO   5  51.250   7.639   5.669
   39    HA   PRO   6           HA       PRO   6  54.160   1.818   2.996
   40    HB2  PRO   6           HB2      PRO   6  56.856   1.417   3.044
   41    HB3  PRO   6           HB1      PRO   6  56.074   2.540   1.913
   42    HG2  PRO   6           HG2      PRO   6  57.504   3.123   4.458
   43    HG3  PRO   6           HG1      PRO   6  57.533   4.000   2.920
   44    HD2  PRO   6           HD2      PRO   6  56.036   4.802   5.082
   45    HD3  PRO   6           HD1      PRO   6  55.601   5.174   3.399
   46    H    LYS   7           HN       LYS   7  54.930  -0.418   3.554
   47    HA   LYS   7           HA       LYS   7  54.235  -1.328   6.060
   48    HB2  LYS   7           HB2      LYS   7  56.518  -2.448   4.406
   49    HB3  LYS   7           HB1      LYS   7  55.603  -3.317   5.637
   50    HG2  LYS   7           HG2      LYS   7  54.296  -3.981   3.897
   51    HG3  LYS   7           HG1      LYS   7  53.590  -2.370   4.028
   52    HD2  LYS   7           HD2      LYS   7  55.517  -1.620   2.469
   53    HD3  LYS   7           HD1      LYS   7  55.714  -3.337   2.118
   54    HE2  LYS   7           HE2      LYS   7  54.218  -2.336   0.463
   55    HE3  LYS   7           HE1      LYS   7  53.307  -3.449   1.483
   56    HZ1  LYS   7           HZ1      LYS   7  52.196  -1.770   2.493
   57    HZ2  LYS   7           HZ2      LYS   7  52.483  -1.008   1.002
   58    HZ3  LYS   7           HZ3      LYS   7  53.472  -0.663   2.340
   59    H    ALA   8           HN       ALA   8  57.617  -1.918   5.613
   60    HA   ALA   8           HA       ALA   8  59.452  -1.516   7.011
   61    HB1  ALA   8           HB1      ALA   8  58.002   1.085   7.584
   62    HB2  ALA   8           HB2      ALA   8  59.047   0.809   6.190
   63    HB3  ALA   8           HB3      ALA   8  59.720   0.765   7.819
   64    H    GLU   9           HN       GLU   9  56.881   0.153   8.855
   65    HA   GLU   9           HA       GLU   9  56.196  -0.143  11.076
   66    HB2  GLU   9           HB2      GLU   9  56.797  -3.012  10.298
   67    HB3  GLU   9           HB1      GLU   9  56.009  -2.553  11.806
   68    HG2  GLU   9           HG2      GLU   9  54.180  -1.508  10.588
   69    HG3  GLU   9           HG1      GLU   9  54.991  -1.807   9.050
   70    H1U  RCY  10           H1U      RCY  10  62.413  -5.632   7.925
   71    H1S  RCY  10           H1S      RCY  10  61.792  -3.747  11.480
   72    HB1  RCY  10           HB1      RCY  10  61.346  -1.974  13.335
   73    HB2  RCY  10           HB2      RCY  10  60.376  -2.145  11.873
   74    HA   RCY  10           HA       RCY  10  58.974  -2.283  14.513
   75    HN1  RCY  10           HN1      RCY  10  57.252  -2.153  12.930
   76    H    ARG  11           HN       ARG  11  59.131  -0.655  15.956
   77    HA   ARG  11           HA       ARG  11  59.381   1.526  16.805
   78    HE   ARG  11           HE       ARG  11  63.296   0.653  18.247
   79    HB2  ARG  11           HB2      ARG  11  61.781   0.536  16.018
   80    HB3  ARG  11           HB1      ARG  11  61.718   1.985  15.017
   81    HG2  ARG  11           HG2      ARG  11  61.250   3.348  17.033
   82    HG3  ARG  11           HG1      ARG  11  61.357   1.895  18.027
   83    HD2  ARG  11           HD2      ARG  11  63.617   2.739  16.211
   84    HD3  ARG  11           HD1      ARG  11  63.476   3.350  17.860
   85   HH11  ARG  11          HH21      ARG  11  65.398   2.671  16.406
   86   HH12  ARG  11          HH22      ARG  11  66.763   1.616  16.558
   87   HH21  ARG  11          HH11      ARG  11  65.066  -0.738  18.457
   88   HH22  ARG  11          HH12      ARG  11  66.575  -0.314  17.719
   89    H    SER  12           HN       SER  12  60.442   3.853  15.573
   90    HA   SER  12           HA       SER  12  59.399   4.411  12.990
   91    HG   SER  12           HG       SER  12  57.702   6.810  14.435
   92    HB2  SER  12           HB2      SER  12  57.177   4.141  13.664
   93    HB3  SER  12           HB1      SER  12  57.492   4.741  15.289
   94    H    ALA  13           HN       ALA  13  60.891   5.249  15.864
   95    HA   ALA  13           HA       ALA  13  60.957   8.159  15.247
   96    HB1  ALA  13           HB1      ALA  13  62.286   6.717  17.556
   97    HB2  ALA  13           HB2      ALA  13  60.620   7.295  17.616
   98    HB3  ALA  13           HB3      ALA  13  61.944   8.442  17.419
   99    H    THR  14           HN       THR  14  62.676   5.342  14.545
  100    HA   THR  14           HA       THR  14  64.857   6.882  13.361
  101    HB   THR  14           HB       THR  14  65.704   4.793  15.361
  102    HG1  THR  14           HG1      THR  14  64.396   6.489  16.352
  103   HG21  THR  14          HG21      THR  14  67.120   7.310  14.485
  104   HG22  THR  14          HG22      THR  14  67.200   5.825  13.535
  105   HG23  THR  14          HG23      THR  14  67.817   5.849  15.188
  106    H    ARG  15           HN       ARG  15  62.697   4.783  12.788
  107    HA   ARG  15           HA       ARG  15  64.256   2.444  11.942
  108    HE   ARG  15           HE       ARG  15  64.648   0.474  12.787
  109    HB2  ARG  15           HB2      ARG  15  61.850   2.339  12.746
  110    HB3  ARG  15           HB1      ARG  15  61.393   3.121  11.236
  111    HG2  ARG  15           HG2      ARG  15  61.166   0.861  10.682
  112    HG3  ARG  15           HG1      ARG  15  62.808   1.200  10.133
  113    HD2  ARG  15           HD2      ARG  15  62.313   0.234  12.941
  114    HD3  ARG  15           HD1      ARG  15  62.404  -0.913  11.605
  115   HH11  ARG  15          HH21      ARG  15  63.288  -0.732   9.858
  116   HH12  ARG  15          HH22      ARG  15  64.821  -0.970   9.088
  117   HH21  ARG  15          HH11      ARG  15  66.658   0.170  11.799
  118   HH22  ARG  15          HH12      ARG  15  66.729  -0.459  10.187
  119    H    VAL  16           HN       VAL  16  61.922   4.257   9.980
  120    HA   VAL  16           HA       VAL  16  63.804   4.043   7.692
  121    HB   VAL  16           HB       VAL  16  60.897   4.910   7.787
  122   HG11  VAL  16          HG11      VAL  16  61.133   5.455   5.616
  123   HG12  VAL  16          HG12      VAL  16  61.843   3.880   5.263
  124   HG13  VAL  16          HG13      VAL  16  62.872   5.214   5.785
  125   HG21  VAL  16          HG21      VAL  16  62.241   2.263   7.192
  126   HG22  VAL  16          HG22      VAL  16  60.588   2.624   6.695
  127   HG23  VAL  16          HG23      VAL  16  61.008   2.597   8.408
  128    H    MET  17           HN       MET  17  61.742   6.496   6.987
  129    HA   MET  17           HA       MET  17  63.747   8.512   6.960
  130    HB2  MET  17           HB2      MET  17  60.723   8.719   6.914
  131    HB3  MET  17           HB1      MET  17  61.801  10.088   6.639
  132    HG2  MET  17           HG2      MET  17  62.705   9.118   4.665
  133    HG3  MET  17           HG1      MET  17  62.025   7.535   5.041
  134    HE1  MET  17           HE1      MET  17  61.502   9.170   2.077
  135    HE2  MET  17           HE2      MET  17  60.036   8.199   1.952
  136    HE3  MET  17           HE3      MET  17  61.479   7.514   2.696
  137    H    GLY  18           HN       GLY  18  63.919  10.433   8.290
  138    HA2  GLY  18           HA2      GLY  18  62.620  10.272  10.965
  139    HA3  GLY  18           HA1      GLY  18  64.378  10.395  10.880
  140    H    GLY  19           HN       GLY  19  61.645  12.008   9.222
  141    HA2  GLY  19           HA2      GLY  19  61.103  14.321   9.239
  142    HA3  GLY  19           HA1      GLY  19  62.495  14.611  10.285
  143    HA   PRO  20           HA       PRO  20  63.265  16.042   5.804
  144    HB2  PRO  20           HB2      PRO  20  64.301  18.366   7.367
  145    HB3  PRO  20           HB1      PRO  20  63.325  18.347   5.887
  146    HG2  PRO  20           HG2      PRO  20  62.265  18.969   8.248
  147    HG3  PRO  20           HG1      PRO  20  61.354  18.056   7.032
  148    HD2  PRO  20           HD2      PRO  20  62.634  17.076   9.555
  149    HD3  PRO  20           HD1      PRO  20  61.149  16.518   8.752
  150    H1U  RCY  21           H1U      RCY  21  69.680   7.419   3.030
  151    H1S  RCY  21           H1S      RCY  21  67.388  11.268   4.908
  152    HB1  RCY  21           HB1      RCY  21  66.405  12.474   6.028
  153    HB2  RCY  21           HB2      RCY  21  66.903  12.565   7.715
  154    HA   RCY  21           HA       RCY  21  67.443  14.865   7.549
  155    HN1  RCY  21           HN1      RCY  21  64.860  14.120   6.486
  156    H    THR  22           HN       THR  22  68.291  16.615   6.359
  157    HA   THR  22           HA       THR  22  69.266  15.898   3.645
  158    HB   THR  22           HB       THR  22  67.458  17.134   2.881
  159    HG1  THR  22           HG1      THR  22  68.300  19.023   2.219
  160   HG21  THR  22          HG21      THR  22  66.814  19.305   4.221
  161   HG22  THR  22          HG22      THR  22  67.683  18.513   5.536
  162   HG23  THR  22          HG23      THR  22  66.285  17.727   4.803
  163    HA   PRO  23           HA       PRO  23  72.649  17.734   6.172
  164    HB2  PRO  23           HB2      PRO  23  74.276  16.520   4.005
  165    HB3  PRO  23           HB1      PRO  23  74.420  16.328   5.762
  166    HG2  PRO  23           HG2      PRO  23  73.478  14.381   4.183
  167    HG3  PRO  23           HG1      PRO  23  72.888  14.629   5.834
  168    HD2  PRO  23           HD2      PRO  23  71.565  15.326   3.237
  169    HD3  PRO  23           HD1      PRO  23  70.836  14.776   4.763
  170    H    ARG  24           HN       ARG  24  73.113  17.529   2.634
  171    HA   ARG  24           HA       ARG  24  72.871  20.424   2.313
  172    HE   ARG  24           HE       ARG  24  76.652  22.636   1.548
  173    HB2  ARG  24           HB2      ARG  24  75.556  19.033   2.101
  174    HB3  ARG  24           HB1      ARG  24  75.223  20.576   1.315
  175    HG2  ARG  24           HG2      ARG  24  74.416  21.344   3.669
  176    HG3  ARG  24           HG1      ARG  24  75.317  19.948   4.261
  177    HD2  ARG  24           HD2      ARG  24  76.845  21.785   4.329
  178    HD3  ARG  24           HD1      ARG  24  77.303  20.827   2.921
  179   HH11  ARG  24          HH21      ARG  24  75.408  22.908   4.752
  180   HH12  ARG  24          HH22      ARG  24  74.789  24.508   4.519
  181   HH21  ARG  24          HH11      ARG  24  75.850  24.725   1.225
  182   HH22  ARG  24          HH12      ARG  24  75.039  25.537   2.522
  183    H    LYS  25           HN       LYS  25  75.042  19.299   0.059
  184    HA   LYS  25           HA       LYS  25  72.858  18.355  -1.762
  185    HB2  LYS  25           HB2      LYS  25  74.322  19.395  -3.596
  186    HB3  LYS  25           HB1      LYS  25  73.451  20.518  -2.552
  187    HG2  LYS  25           HG2      LYS  25  75.541  20.619  -1.107
  188    HG3  LYS  25           HG1      LYS  25  76.374  19.745  -2.393
  189    HD2  LYS  25           HD2      LYS  25  76.098  21.512  -3.935
  190    HD3  LYS  25           HD1      LYS  25  74.824  22.267  -2.976
  191    HE2  LYS  25           HE2      LYS  25  77.689  21.995  -2.031
  192    HE3  LYS  25           HE1      LYS  25  77.059  23.434  -2.832
  193    HZ1  LYS  25           HZ1      LYS  25  75.247  22.791  -0.847
  194    HZ2  LYS  25           HZ2      LYS  25  76.330  24.099  -0.866
  195    HZ3  LYS  25           HZ3      LYS  25  76.778  22.633  -0.133
  196    H    GLY  26           HN       GLY  26  73.400  16.615  -3.120
  197    HA2  GLY  26           HA2      GLY  26  75.605  14.950  -2.181
  198    HA3  GLY  26           HA1      GLY  26  74.473  14.535  -3.469
  199    HA   PRO  27           HA       PRO  27  78.944  16.233  -4.780
  200    HB2  PRO  27           HB2      PRO  27  79.102  13.338  -5.551
  201    HB3  PRO  27           HB1      PRO  27  80.391  14.427  -5.002
  202    HG2  PRO  27           HG2      PRO  27  79.293  12.608  -3.381
  203    HG3  PRO  27           HG1      PRO  27  79.841  14.185  -2.791
  204    HD2  PRO  27           HD2      PRO  27  77.072  13.179  -3.141
  205    HD3  PRO  27           HD1      PRO  27  77.679  14.468  -2.079
  206    HA   PRO  28           HA       PRO  28  77.606  16.971  -8.936
  207    HB2  PRO  28           HB2      PRO  28  80.063  15.467  -9.789
  208    HB3  PRO  28           HB1      PRO  28  79.444  17.028 -10.366
  209    HG2  PRO  28           HG2      PRO  28  81.472  16.855  -8.625
  210    HG3  PRO  28           HG1      PRO  28  80.296  18.178  -8.579
  211    HD2  PRO  28           HD2      PRO  28  80.652  15.943  -6.681
  212    HD3  PRO  28           HD1      PRO  28  79.822  17.497  -6.447
  213    H    LYS  29           HN       LYS  29  76.509  15.855 -10.635
  214    HA   LYS  29           HA       LYS  29  75.361  13.375 -10.118
  215    HB2  LYS  29           HB2      LYS  29  75.182  13.236 -12.727
  216    HB3  LYS  29           HB1      LYS  29  74.372  14.557 -11.884
  217    HG2  LYS  29           HG2      LYS  29  76.149  16.089 -12.404
  218    HG3  LYS  29           HG1      LYS  29  77.174  14.786 -13.006
  219    HD2  LYS  29           HD2      LYS  29  75.791  14.442 -14.916
  220    HD3  LYS  29           HD1      LYS  29  74.487  15.418 -14.239
  221    HE2  LYS  29           HE2      LYS  29  76.059  16.475 -16.049
  222    HE3  LYS  29           HE1      LYS  29  75.609  17.432 -14.638
  223    HZ1  LYS  29           HZ1      LYS  29  77.660  17.014 -13.619
  224    HZ2  LYS  29           HZ2      LYS  29  78.045  17.374 -15.234
  225    HZ3  LYS  29           HZ3      LYS  29  78.051  15.762 -14.696
  226    H1U  RCY  30           H1U      RCY  30  84.431  11.980  -6.642
  227    H1S  RCY  30           H1S      RCY  30  80.665  11.164  -8.509
  228    HB1  RCY  30           HB1      RCY  30  79.587   9.516  -9.120
  229    HB2  RCY  30           HB2      RCY  30  77.852   9.246  -8.979
  230    HA   RCY  30           HA       RCY  30  79.318  11.190 -10.738
  231    HN1  RCY  30           HN1      RCY  30  76.903  11.878  -9.335
  232    H    LYS  31           HN       LYS  31  75.986  10.233 -11.093
  233    HA   LYS  31           HA       LYS  31  76.178   7.736 -12.332
  234    HB2  LYS  31           HB2      LYS  31  74.378  10.035 -13.156
  235    HB3  LYS  31           HB1      LYS  31  74.120   8.335 -13.550
  236    HG2  LYS  31           HG2      LYS  31  74.176   7.895 -11.028
  237    HG3  LYS  31           HG1      LYS  31  74.045   9.643 -10.826
  238    HD2  LYS  31           HD2      LYS  31  71.999   9.540 -12.341
  239    HD3  LYS  31           HD1      LYS  31  72.072   7.785 -12.172
  240    HE2  LYS  31           HE2      LYS  31  70.558   8.542 -10.483
  241    HE3  LYS  31           HE1      LYS  31  72.064   8.159  -9.648
  242    HZ1  LYS  31           HZ1      LYS  31  72.062  10.839 -10.593
  243    HZ2  LYS  31           HZ2      LYS  31  72.282  10.256  -9.013
  244    HZ3  LYS  31           HZ3      LYS  31  70.716  10.554  -9.601
  245    H    GLN  32           HN       GLN  32  77.627  10.617 -13.356
  246    HA   GLN  32           HA       GLN  32  77.545  10.136 -16.218
  247    HB2  GLN  32           HB2      GLN  32  78.182  12.306 -14.733
  248    HB3  GLN  32           HB1      GLN  32  79.804  11.689 -15.042
  249    HG2  GLN  32           HG2      GLN  32  77.701  12.371 -17.118
  250    HG3  GLN  32           HG1      GLN  32  79.215  13.230 -16.827
  251   HE21  GLN  32          HE21      GLN  32  77.838  10.228 -18.140
  252   HE22  GLN  32          HE22      GLN  32  79.247   9.733 -18.946
  253    H    ARG  33           HN       ARG  33  79.317   8.822 -13.598
  254    HA   ARG  33           HA       ARG  33  81.577   7.931 -15.279
  255    HE   ARG  33           HE       ARG  33  84.466  10.309 -11.263
  256    HB2  ARG  33           HB2      ARG  33  80.868   7.461 -12.368
  257    HB3  ARG  33           HB1      ARG  33  82.310   6.808 -13.145
  258    HG2  ARG  33           HG2      ARG  33  83.205   8.977 -13.547
  259    HG3  ARG  33           HG1      ARG  33  81.665   9.759 -13.188
  260    HD2  ARG  33           HD2      ARG  33  82.149   9.849 -10.990
  261    HD3  ARG  33           HD1      ARG  33  82.523   8.126 -10.953
  262   HH11  ARG  33          HH21      ARG  33  83.691   6.966 -11.602
  263   HH12  ARG  33          HH22      ARG  33  85.343   6.444 -11.574
  264   HH21  ARG  33          HH11      ARG  33  86.627   9.646 -11.225
  265   HH22  ARG  33          HH12      ARG  33  87.004   7.961 -11.361
  266    H    GLN  34           HN       GLN  34  81.871   5.352 -13.994
  267    HA   GLN  34           HA       GLN  34  79.445   3.815 -14.557
  268    HB2  GLN  34           HB2      GLN  34  80.604   4.312 -16.813
  269    HB3  GLN  34           HB1      GLN  34  81.865   3.210 -16.263
  270    HG2  GLN  34           HG2      GLN  34  80.336   1.866 -17.511
  271    HG3  GLN  34           HG1      GLN  34  80.001   1.520 -15.814
  272   HE21  GLN  34          HE21      GLN  34  78.951   3.982 -18.252
  273   HE22  GLN  34          HE22      GLN  34  77.310   3.913 -17.822
  274    H    THR  35           HN       THR  35  81.851   1.736 -15.270
  275    HA   THR  35           HA       THR  35  82.621   1.255 -12.422
  276    HB   THR  35           HB       THR  35  80.793  -0.277 -12.842
  277    HG1  THR  35           HG1      THR  35  83.050  -1.012 -12.076
  278   HG21  THR  35          HG21      THR  35  81.488  -1.980 -14.858
  279   HG22  THR  35          HG22      THR  35  82.099  -0.450 -15.486
  280   HG23  THR  35          HG23      THR  35  80.396  -0.610 -15.058
  281    H    ARG  36           HN       ARG  36  83.562  -1.380 -14.085
  282    HA   ARG  36           HA       ARG  36  85.597  -2.083 -15.006
  283    HE   ARG  36           HE       ARG  36  82.872   0.804 -18.650
  284    HB2  ARG  36           HB2      ARG  36  86.116   0.763 -15.859
  285    HB3  ARG  36           HB1      ARG  36  86.590  -0.734 -16.661
  286    HG2  ARG  36           HG2      ARG  36  84.015  -1.160 -16.834
  287    HG3  ARG  36           HG1      ARG  36  83.885   0.579 -16.564
  288    HD2  ARG  36           HD2      ARG  36  85.594   0.845 -18.457
  289    HD3  ARG  36           HD1      ARG  36  85.288  -0.852 -18.826
  290   HH11  ARG  36          HH21      ARG  36  85.422  -0.492 -20.573
  291   HH12  ARG  36          HH22      ARG  36  84.546  -0.360 -22.062
  292   HH21  ARG  36          HH11      ARG  36  81.713   0.984 -20.582
  293   HH22  ARG  36          HH12      ARG  36  82.446   0.476 -22.067
  294    H    GLN  37           HN       GLN  37  85.440   0.528 -12.761
  295    HA   GLN  37           HA       GLN  37  88.327   0.610 -12.259
  296    HB2  GLN  37           HB2      GLN  37  85.897   1.973 -11.188
  297    HB3  GLN  37           HB1      GLN  37  87.274   1.849 -10.095
  298    HG2  GLN  37           HG2      GLN  37  87.643   2.807 -12.929
  299    HG3  GLN  37           HG1      GLN  37  87.139   3.921 -11.658
  300   HE21  GLN  37          HE21      GLN  37  89.842   3.336 -13.219
  301   HE22  GLN  37          HE22      GLN  37  90.990   3.359 -11.969
  302    H1U  RCY  38           H1U      RCY  38  85.873  -2.265  -4.623
  303    H1S  RCY  38           H1S      RCY  38  84.261  -0.629  -8.632
  304    HB1  RCY  38           HB1      RCY  38  85.988  -3.522  -8.720
  305    HB2  RCY  38           HB2      RCY  38  85.779  -4.286 -10.296
  306    HA   RCY  38           HA       RCY  38  88.003  -2.639  -9.293
  307    HN1  RCY  38           HN1      RCY  38  87.363  -2.015 -12.113
  308    H    LYS  39           HN       LYS  39  89.460  -4.288  -9.293
  309    HA   LYS  39           HA       LYS  39  89.238  -6.524 -11.152
  310    HB2  LYS  39           HB2      LYS  39  91.344  -6.164 -12.323
  311    HB3  LYS  39           HB1      LYS  39  90.307  -4.758 -12.568
  312    HG2  LYS  39           HG2      LYS  39  91.507  -3.789 -10.472
  313    HG3  LYS  39           HG1      LYS  39  92.725  -5.025 -10.790
  314    HD2  LYS  39           HD2      LYS  39  92.742  -4.135 -13.208
  315    HD3  LYS  39           HD1      LYS  39  91.877  -2.737 -12.569
  316    HE2  LYS  39           HE2      LYS  39  94.121  -2.066 -12.412
  317    HE3  LYS  39           HE1      LYS  39  93.784  -2.671 -10.790
  318    HZ1  LYS  39           HZ1      LYS  39  95.722  -3.563 -12.579
  319    HZ2  LYS  39           HZ2      LYS  39  94.581  -4.812 -12.424
  320    HZ3  LYS  39           HZ3      LYS  39  95.354  -4.188 -11.046
  321    H    SER  40           HN       SER  40  90.728  -4.870  -8.498
  322    HA   SER  40           HA       SER  40  92.636  -7.000  -7.889
  323    HG   SER  40           HG       SER  40  92.279  -3.781  -7.805
  324    HB2  SER  40           HB2      SER  40  91.654  -4.859  -5.993
  325    HB3  SER  40           HB1      SER  40  93.191  -5.718  -5.953
  326    H    LYS  41           HN       LYS  41  89.558  -7.389  -8.050
  327    HA   LYS  41           HA       LYS  41  89.144  -8.549  -5.330
  328    HB2  LYS  41           HB2      LYS  41  86.966  -8.397  -7.384
  329    HB3  LYS  41           HB1      LYS  41  86.862  -8.253  -5.628
  330    HG2  LYS  41           HG2      LYS  41  88.219  -6.074  -5.916
  331    HG3  LYS  41           HG1      LYS  41  87.791  -6.189  -7.623
  332    HD2  LYS  41           HD2      LYS  41  85.998  -4.943  -6.860
  333    HD3  LYS  41           HD1      LYS  41  85.353  -6.568  -6.622
  334    HE2  LYS  41           HE2      LYS  41  86.371  -6.455  -4.268
  335    HE3  LYS  41           HE1      LYS  41  86.570  -4.727  -4.557
  336    HZ1  LYS  41           HZ1      LYS  41  84.034  -5.121  -5.324
  337    HZ2  LYS  41           HZ2      LYS  41  84.494  -4.613  -3.769
  338    HZ3  LYS  41           HZ3      LYS  41  84.164  -6.253  -4.067
  339    HA   PRO  42           HA       PRO  42  89.853 -12.335  -7.769
  340    HB2  PRO  42           HB2      PRO  42  90.726 -13.890  -5.724
  341    HB3  PRO  42           HB1      PRO  42  91.762 -12.674  -6.497
  342    HG2  PRO  42           HG2      PRO  42  90.323 -12.554  -3.903
  343    HG3  PRO  42           HG1      PRO  42  91.906 -11.900  -4.350
  344    HD2  PRO  42           HD2      PRO  42  89.549 -10.410  -4.196
  345    HD3  PRO  42           HD1      PRO  42  91.007  -9.922  -5.086
  346    HA   PRO  43           HA       PRO  43  86.092 -14.510  -6.899
  347    HB2  PRO  43           HB2      PRO  43  86.724 -17.064  -7.667
  348    HB3  PRO  43           HB1      PRO  43  86.454 -15.740  -8.817
  349    HG2  PRO  43           HG2      PRO  43  89.015 -16.886  -7.829
  350    HG3  PRO  43           HG1      PRO  43  88.574 -16.339  -9.456
  351    HD2  PRO  43           HD2      PRO  43  90.087 -14.832  -7.739
  352    HD3  PRO  43           HD1      PRO  43  89.033 -14.121  -8.981
  353    H    LYS  44           HN       LYS  44  85.326 -15.059  -4.908
  354    HA   LYS  44           HA       LYS  44  86.205 -17.384  -3.473
  355    HB2  LYS  44           HB2      LYS  44  88.059 -15.538  -3.099
  356    HB3  LYS  44           HB1      LYS  44  86.878 -14.871  -1.977
  357    HG2  LYS  44           HG2      LYS  44  88.025 -16.305  -0.557
  358    HG3  LYS  44           HG1      LYS  44  86.749 -17.381  -1.129
  359    HD2  LYS  44           HD2      LYS  44  88.323 -18.120  -2.966
  360    HD3  LYS  44           HD1      LYS  44  89.595 -17.209  -2.150
  361    HE2  LYS  44           HE2      LYS  44  87.951 -19.355  -0.784
  362    HE3  LYS  44           HE1      LYS  44  89.511 -19.666  -1.546
  363    HZ1  LYS  44           HZ1      LYS  44  90.611 -18.328  -0.028
  364    HZ2  LYS  44           HZ2      LYS  44  89.459 -19.119   0.938
  365    HZ3  LYS  44           HZ3      LYS  44  89.201 -17.513   0.447
  366    H    LYS  45           HN       LYS  45  83.746 -17.011  -4.058
  367    HA   LYS  45           HA       LYS  45  81.993 -15.302  -2.815
  368    HB2  LYS  45           HB2      LYS  45  81.754 -17.748  -4.100
  369    HB3  LYS  45           HB1      LYS  45  81.119 -18.097  -2.495
  370    HG2  LYS  45           HG2      LYS  45  79.219 -17.314  -3.628
  371    HG3  LYS  45           HG1      LYS  45  79.793 -15.864  -2.805
  372    HD2  LYS  45           HD2      LYS  45  81.136 -15.385  -4.947
  373    HD3  LYS  45           HD1      LYS  45  80.129 -16.615  -5.711
  374    HE2  LYS  45           HE2      LYS  45  78.108 -15.329  -4.872
  375    HE3  LYS  45           HE1      LYS  45  79.216 -14.036  -4.414
  376    HZ1  LYS  45           HZ1      LYS  45  79.992 -13.977  -6.726
  377    HZ2  LYS  45           HZ2      LYS  45  78.336 -13.620  -6.595
  378    HZ3  LYS  45           HZ3      LYS  45  78.837 -15.148  -7.141
  379    H    GLY  46           HN       GLY  46  82.072 -14.580  -0.743
  380    HA2  GLY  46           HA2      GLY  46  81.395 -16.038   1.514
  381    HA3  GLY  46           HA1      GLY  46  83.151 -16.190   1.424
  382    H    VAL  47           HN       VAL  47  81.989 -14.862   3.583
  383    HA   VAL  47           HA       VAL  47  81.666 -12.061   3.297
  384    HB   VAL  47           HB       VAL  47  81.146 -13.382   5.360
  385   HG11  VAL  47          HG11      VAL  47  84.115 -13.212   5.916
  386   HG12  VAL  47          HG12      VAL  47  83.363 -14.652   5.230
  387   HG13  VAL  47          HG13      VAL  47  82.889 -14.089   6.833
  388   HG21  VAL  47          HG21      VAL  47  81.512 -10.850   5.297
  389   HG22  VAL  47          HG22      VAL  47  83.122 -11.164   5.944
  390   HG23  VAL  47          HG23      VAL  47  81.694 -11.613   6.876
  391    H    GLN  48           HN       GLN  48  84.423 -13.957   2.780
  392    HA   GLN  48           HA       GLN  48  86.367 -11.893   3.557
  393    HB2  GLN  48           HB2      GLN  48  86.445 -14.694   2.632
  394    HB3  GLN  48           HB1      GLN  48  87.742 -13.696   1.977
  395    HG2  GLN  48           HG2      GLN  48  87.054 -13.709   4.922
  396    HG3  GLN  48           HG1      GLN  48  88.218 -14.836   4.223
  397   HE21  GLN  48          HE21      GLN  48  89.873 -13.683   5.601
  398   HE22  GLN  48          HE22      GLN  48  90.526 -12.217   5.046
  399    H    GLY  49           HN       GLY  49  85.605 -13.499   0.438
  400    HA2  GLY  49           HA2      GLY  49  86.675 -11.140  -0.986
  401    HA3  GLY  49           HA1      GLY  49  86.197 -12.666  -1.730
  402    H1U  RCY  50           H1U      RCY  50  82.057  -5.161   0.503
  403    H1S  RCY  50           H1S      RCY  50  81.535  -7.632  -3.388
  404    HB1  RCY  50           HB1      RCY  50  82.116 -10.525  -5.018
  405    HB2  RCY  50           HB2      RCY  50  83.864 -10.747  -4.979
  406    HA   RCY  50           HA       RCY  50  82.713  -9.829  -2.422
  407    HN1  RCY  50           HN1      RCY  50  84.888 -11.581  -3.293
  408    H    GLY  51           HN       GLY  51  81.553 -11.246  -0.973
  409    HA2  GLY  51           HA2      GLY  51  80.461 -13.764  -1.994
  410    HA3  GLY  51           HA1      GLY  51  80.104 -13.041  -0.425
  411    H    ASP  52           HN       ASP  52  77.828 -13.316  -0.676
  412    HA   ASP  52           HA       ASP  52  75.684 -12.570  -1.270
  413    HB2  ASP  52           HB2      ASP  52  76.816 -10.306  -2.870
  414    HB3  ASP  52           HB1      ASP  52  75.459 -10.314  -1.743
  415    H    ASP  53           HN       ASP  53  74.974 -14.126  -2.707
  416    HA   ASP  53           HA       ASP  53  76.033 -14.257  -5.436
  417    HB2  ASP  53           HB2      ASP  53  73.841 -15.745  -3.975
  418    HB3  ASP  53           HB1      ASP  53  74.200 -16.017  -5.680
  419    H    ILE  54           HN       ILE  54  73.651 -12.445  -3.847
  420    HA   ILE  54           HA       ILE  54  72.212 -11.924  -6.423
  421    HB   ILE  54           HB       ILE  54  71.296 -11.678  -3.546
  422   HG12  ILE  54          HG12      ILE  54  69.479 -13.203  -4.466
  423   HG13  ILE  54          HG11      ILE  54  70.457 -13.353  -5.926
  424   HG21  ILE  54          HG21      ILE  54  70.164 -10.566  -6.105
  425   HG22  ILE  54          HG22      ILE  54  70.330  -9.779  -4.535
  426   HG23  ILE  54          HG23      ILE  54  69.093 -11.013  -4.778
  427   HD11  ILE  54          HD11      ILE  54  70.696 -14.973  -3.720
  428   HD12  ILE  54          HD12      ILE  54  71.960 -13.777  -3.429
  429   HD13  ILE  54          HD13      ILE  54  71.965 -14.721  -4.919
  430    HA   PRO  55           HA       PRO  55  74.448  -8.027  -5.452
  431    HB2  PRO  55           HB2      PRO  55  75.262  -7.456  -7.972
  432    HB3  PRO  55           HB1      PRO  55  76.105  -8.641  -6.955
  433    HG2  PRO  55           HG2      PRO  55  74.213  -9.088  -9.198
  434    HG3  PRO  55           HG1      PRO  55  75.649 -10.010  -8.729
  435    HD2  PRO  55           HD2      PRO  55  73.014 -10.730  -8.131
  436    HD3  PRO  55           HD1      PRO  55  74.458 -11.352  -7.304
  437    H    GLY  56           HN       GLY  56  71.715  -7.940  -5.435
  438    HA2  GLY  56           HA2      GLY  56  69.968  -6.416  -5.818
  439    HA3  GLY  56           HA1      GLY  56  71.141  -5.381  -6.634
  440    H    MET  57           HN       MET  57  70.903  -8.627  -7.776
  441    HA   MET  57           HA       MET  57  70.142  -9.500  -9.810
  442    HB2  MET  57           HB2      MET  57  67.993  -7.728  -8.843
  443    HB3  MET  57           HB1      MET  57  67.973  -7.962 -10.589
  444    HG2  MET  57           HG2      MET  57  66.635  -9.712  -9.571
  445    HG3  MET  57           HG1      MET  57  68.114 -10.439 -10.198
  446    HE1  MET  57           HE1      MET  57  68.502 -12.690  -8.280
  447    HE2  MET  57           HE2      MET  57  66.944 -12.156  -8.906
  448    HE3  MET  57           HE3      MET  57  67.133 -12.474  -7.183
  449    H    GLU  58           HN       GLU  58  71.040  -6.211  -9.510
  450    HA   GLU  58           HA       GLU  58  72.278  -6.155 -12.092
  451    HB2  GLU  58           HB2      GLU  58  70.039  -5.904 -12.984
  452    HB3  GLU  58           HB1      GLU  58  69.659  -4.651 -11.804
  453    HG2  GLU  58           HG2      GLU  58  72.008  -4.271 -13.634
  454    HG3  GLU  58           HG1      GLU  58  70.381  -3.969 -14.245
  455    H    GLY  59           HN       GLY  59  71.270  -4.685  -9.141
  456    HA2  GLY  59           HA2      GLY  59  73.394  -3.374  -8.270
  457    HA3  GLY  59           HA1      GLY  59  72.982  -2.300  -9.608
  458    H1U  RCY  60           H1U      RCY  60  71.637   3.882  -4.042
  459    H1S  RCY  60           H1S      RCY  60  69.037   1.160  -6.043
  460    HB1  RCY  60           HB1      RCY  60  67.506  -0.468  -8.273
  461    HB2  RCY  60           HB2      RCY  60  68.647  -0.791  -9.579
  462    HA   RCY  60           HA       RCY  60  69.712  -1.046  -6.813
  463    HN1  RCY  60           HN1      RCY  60  70.111  -2.606  -9.336
  464    H    GLY  61           HN       GLY  61  69.421  -3.107  -5.651
  465    HA2  GLY  61           HA2      GLY  61  67.031  -4.694  -6.384
  466    HA3  GLY  61           HA1      GLY  61  68.179  -5.089  -5.103
  467    H    THR  62           HN       THR  62  65.727  -2.623  -5.938
  468    HA   THR  62           HA       THR  62  65.429  -1.430  -3.425
  469    HB   THR  62           HB       THR  62  63.263  -0.723  -4.132
  470    HG1  THR  62           HG1      THR  62  61.973  -1.971  -5.246
  471   HG21  THR  62          HG21      THR  62  65.264  -0.068  -5.578
  472   HG22  THR  62          HG22      THR  62  63.679   0.086  -6.337
  473   HG23  THR  62          HG23      THR  62  64.711  -1.290  -6.723
  474    H    ASP  63           HN       ASP  63  64.936  -4.692  -4.188
  475    HA   ASP  63           HA       ASP  63  62.741  -5.487  -2.635
  476    HB2  ASP  63           HB2      ASP  63  65.442  -6.808  -3.017
  477    HB3  ASP  63           HB1      ASP  63  64.099  -7.594  -2.184
  478    H    ILE  64           HN       ILE  64  65.555  -3.878  -1.649
  479    HA   ILE  64           HA       ILE  64  65.164  -4.660   1.207
  480    HB   ILE  64           HB       ILE  64  67.431  -5.011   0.514
  481   HG12  ILE  64          HG12      ILE  64  68.633  -3.452   1.959
  482   HG13  ILE  64          HG11      ILE  64  67.292  -2.308   1.886
  483   HG21  ILE  64          HG21      ILE  64  68.433  -2.526  -0.258
  484   HG22  ILE  64          HG22      ILE  64  66.884  -2.637  -1.093
  485   HG23  ILE  64          HG23      ILE  64  68.103  -3.889  -1.328
  486   HD11  ILE  64          HD11      ILE  64  67.527  -4.000   3.922
  487   HD12  ILE  64          HD12      ILE  64  66.721  -5.098   2.802
  488   HD13  ILE  64          HD13      ILE  64  65.943  -3.586   3.267
  489    H    THR  65           HN       THR  65  66.810  -1.758   0.363
  490    HA   THR  65           HA       THR  65  65.210   0.345   0.068
  491    HB   THR  65           HB       THR  65  64.604  -0.792   2.807
  492    HG1  THR  65           HG1      THR  65  62.580   0.394   1.585
  493   HG21  THR  65          HG21      THR  65  63.378   1.555   2.981
  494   HG22  THR  65          HG22      THR  65  64.683   2.060   1.907
  495   HG23  THR  65          HG23      THR  65  65.058   1.374   3.488
  496    H    VAL  66           HN       VAL  66  67.276  -0.991   2.629
  497    HA   VAL  66           HA       VAL  66  69.097   1.337   2.270
  498    HB   VAL  66           HB       VAL  66  69.450   1.090   4.869
  499   HG11  VAL  66          HG11      VAL  66  67.088   2.444   3.542
  500   HG12  VAL  66          HG12      VAL  66  68.663   3.149   3.909
  501   HG13  VAL  66          HG13      VAL  66  67.553   2.742   5.217
  502   HG21  VAL  66          HG21      VAL  66  66.540   0.498   4.950
  503   HG22  VAL  66          HG22      VAL  66  67.812   0.043   6.083
  504   HG23  VAL  66          HG23      VAL  66  67.592  -0.871   4.591
  505    H    ILE  67           HN       ILE  67  69.217  -1.304   4.649
  506    HA   ILE  67           HA       ILE  67  71.727  -2.253   3.329
  507    HB   ILE  67           HB       ILE  67  70.805  -2.240   6.204
  508   HG12  ILE  67          HG12      ILE  67  73.206  -1.401   6.445
  509   HG13  ILE  67          HG11      ILE  67  73.259  -1.328   4.683
  510   HG21  ILE  67          HG21      ILE  67  72.984  -3.625   6.547
  511   HG22  ILE  67          HG22      ILE  67  72.766  -4.091   4.860
  512   HG23  ILE  67          HG23      ILE  67  71.522  -4.475   6.049
  513   HD11  ILE  67          HD11      ILE  67  71.626   0.353   4.575
  514   HD12  ILE  67          HD12      ILE  67  72.557   0.814   6.000
  515   HD13  ILE  67          HD13      ILE  67  71.009  -0.011   6.186
  516    H1U  RCY  68           H1U      RCY  68  75.018  -2.718  -3.645
  517    H1S  RCY  68           H1S      RCY  68  72.568  -3.984   0.365
  518    HB1  RCY  68           HB1      RCY  68  69.388  -6.509   0.378
  519    HB2  RCY  68           HB2      RCY  68  71.121  -6.524   0.700
  520    HA   RCY  68           HA       RCY  68  68.875  -5.651   2.448
  521    HN1  RCY  68           HN1      RCY  68  71.015  -3.832   1.948
  522    HA   PRO  69           HA       PRO  69  70.775  -8.608   5.111
  523    HB2  PRO  69           HB2      PRO  69  69.453 -10.890   4.467
  524    HB3  PRO  69           HB1      PRO  69  68.661  -9.526   5.281
  525    HG2  PRO  69           HG2      PRO  69  68.586 -10.302   2.407
  526    HG3  PRO  69           HG1      PRO  69  67.283  -9.709   3.451
  527    HD2  PRO  69           HD2      PRO  69  68.640  -8.114   1.660
  528    HD3  PRO  69           HD1      PRO  69  67.853  -7.496   3.129
  529    H    TRP  70           HN       TRP  70  70.859  -9.433   1.647
  530    HA   TRP  70           HA       TRP  70  72.662 -11.664   2.001
  531    HD1  TRP  70           HD1      TRP  70  73.070  -8.202  -0.574
  532    HE1  TRP  70           HE1      TRP  70  71.140  -6.727  -1.436
  533    HE3  TRP  70           HE3      TRP  70  69.252 -11.591  -0.461
  534    HZ2  TRP  70           HZ2      TRP  70  68.342  -6.955  -2.004
  535    HZ3  TRP  70           HZ3      TRP  70  66.971 -10.939  -1.165
  536    HH2  TRP  70           HH2      TRP  70  66.509  -8.629  -1.936
  537    HB2  TRP  70           HB2      TRP  70  73.232 -10.981  -0.519
  538    HB3  TRP  70           HB1      TRP  70  71.729 -11.796  -0.102
  539    H    GLU  71           HN       GLU  71  73.186  -8.701   2.994
  540    HA   GLU  71           HA       GLU  71  76.110  -8.880   2.503
  541    HB2  GLU  71           HB2      GLU  71  74.333  -6.526   1.867
  542    HB3  GLU  71           HB1      GLU  71  76.031  -6.288   2.277
  543    HG2  GLU  71           HG2      GLU  71  75.265  -8.314   0.190
  544    HG3  GLU  71           HG1      GLU  71  75.366  -6.605  -0.237
  545    H    ALA  72           HN       ALA  72  74.127  -9.292   4.772
  546    HA   ALA  72           HA       ALA  72  74.531  -7.139   6.659
  547    HB1  ALA  72           HB1      ALA  72  73.513  -8.588   8.268
  548    HB2  ALA  72           HB2      ALA  72  73.943 -10.027   7.345
  549    HB3  ALA  72           HB3      ALA  72  72.706  -8.927   6.737
  550    H1U  RCY  73           H1U      RCY  73  76.360  -4.027   1.168
  551    H1S  RCY  73           H1S      RCY  73  77.663  -5.978   4.471
  552    HB1  RCY  73           HB1      RCY  73  80.388  -8.455   6.110
  553    HB2  RCY  73           HB2      RCY  73  79.831  -6.787   6.228
  554    HA   RCY  73           HA       RCY  73  78.582  -9.292   7.280
  555    HN1  RCY  73           HN1      RCY  73  77.000  -7.272   5.877
  556    H    ASN  74           HN       ASN  74  77.313  -6.144   7.993
  557    HA   ASN  74           HA       ASN  74  78.176  -6.319  10.739
  558    HB2  ASN  74           HB2      ASN  74  79.760  -4.498  10.816
  559    HB3  ASN  74           HB1      ASN  74  80.320  -5.637   9.592
  560   HD21  ASN  74          HD21      ASN  74  80.388  -2.480   9.960
  561   HD22  ASN  74          HD22      ASN  74  79.971  -1.931   8.410
  562    H    HIS  75           HN       HIS  75  77.940  -3.815  11.650
  563    HA   HIS  75           HA       HIS  75  75.196  -3.049  10.795
  564    HD1  HIS  75           HD1      HIS  75  74.726  -0.557  14.367
  565    HD2  HIS  75           HD2      HIS  75  73.196  -3.533  11.876
  566    HE1  HIS  75           HE1      HIS  75  72.204  -0.344  14.463
  567    HE2  HIS  75           HE2      HIS  75  71.260  -2.151  12.952
  568    HB2  HIS  75           HB2      HIS  75  76.132  -3.470  13.278
  569    HB3  HIS  75           HB1      HIS  75  76.545  -1.763  13.136
  570    H1U  RCY  76           H1U      RCY  76  77.940  -1.957   3.545
  571    H1S  RCY  76           H1S      RCY  76  75.362   0.708   6.286
  572    HB1  RCY  76           HB1      RCY  76  77.970  -0.892   8.074
  573    HB2  RCY  76           HB2      RCY  76  78.825   0.641   7.938
  574    HA   RCY  76           HA       RCY  76  79.470   0.068  10.068
  575    HN1  RCY  76           HN1      RCY  76  78.481  -1.893  10.869
  576    H    GLU  77           HN       GLU  77  76.755   0.122  11.924
  577    HA   GLU  77           HA       GLU  77  76.012   2.921  11.717
  578    HB2  GLU  77           HB2      GLU  77  74.472   1.270  12.709
  579    HB3  GLU  77           HB1      GLU  77  75.633   0.952  13.999
  580    HG2  GLU  77           HG2      GLU  77  75.427   3.204  14.838
  581    HG3  GLU  77           HG1      GLU  77  74.460   3.689  13.445
  582    H    LEU  78           HN       LEU  78  77.912   1.078  14.120
  583    HA   LEU  78           HA       LEU  78  79.127   3.629  15.060
  584    HG   LEU  78           HG       LEU  78  80.947   2.990  16.805
  585    HB2  LEU  78           HB2      LEU  78  78.151   1.878  16.672
  586    HB3  LEU  78           HB1      LEU  78  79.524   0.865  16.231
  587   HD11  LEU  78          HD11      LEU  78  78.310   3.524  18.195
  588   HD12  LEU  78          HD12      LEU  78  79.178   4.590  17.091
  589   HD13  LEU  78          HD13      LEU  78  79.829   4.266  18.698
  590   HD21  LEU  78          HD21      LEU  78  79.558   1.391  18.981
  591   HD22  LEU  78          HD22      LEU  78  81.093   2.244  19.147
  592   HD23  LEU  78          HD23      LEU  78  80.968   0.854  18.068
  593    H    HIS  79           HN       HIS  79  79.825   2.648  12.480
  594    HA   HIS  79           HA       HIS  79  82.725   2.435  12.807
  595    HD1  HIS  79           HD1      HIS  79  84.263   1.457  13.458
  596    HD2  HIS  79           HD2      HIS  79  81.862  -1.941  13.755
  597    HE1  HIS  79           HE1      HIS  79  85.216   0.071  15.352
  598    HE2  HIS  79           HE2      HIS  79  83.763  -2.001  15.542
  599    HB2  HIS  79           HB2      HIS  79  81.018   0.108  12.033
  600    HB3  HIS  79           HB1      HIS  79  82.512   0.333  11.131
  601    H    GLU  80           HN       GLU  80  81.777   4.558  11.692
  602    HA   GLU  80           HA       GLU  80  80.779   4.630   9.090
  603    HB2  GLU  80           HB2      GLU  80  81.295   6.628  10.529
  604    HB3  GLU  80           HB1      GLU  80  82.999   6.420  10.123
  605    HG2  GLU  80           HG2      GLU  80  82.095   8.052   8.596
  606    HG3  GLU  80           HG1      GLU  80  82.344   6.562   7.685
  607    H    LEU  81           HN       LEU  81  84.286   4.996   9.730
  608    HA   LEU  81           HA       LEU  81  84.793   3.698   7.098
  609    HG   LEU  81           HG       LEU  81  85.994   5.288  10.046
  610    HB2  LEU  81           HB2      LEU  81  87.238   4.510   7.804
  611    HB3  LEU  81           HB1      LEU  81  86.078   5.621   7.079
  612   HD11  LEU  81          HD11      LEU  81  87.749   7.136  10.184
  613   HD12  LEU  81          HD12      LEU  81  88.165   6.738   8.517
  614   HD13  LEU  81          HD13      LEU  81  88.360   5.530   9.787
  615   HD21  LEU  81          HD21      LEU  81  84.532   6.781   8.446
  616   HD22  LEU  81          HD22      LEU  81  85.931   7.855   8.482
  617   HD23  LEU  81          HD23      LEU  81  85.094   7.445   9.980
  618    H    ALA  82           HN       ALA  82  86.161   3.623  10.411
  619    HA   ALA  82           HA       ALA  82  87.571   1.153   9.980
  620    HB1  ALA  82           HB1      ALA  82  88.292   2.625  11.755
  621    HB2  ALA  82           HB2      ALA  82  87.725   1.130  12.497
  622    HB3  ALA  82           HB3      ALA  82  86.702   2.566  12.515
  623    H    GLN  83           HN       GLN  83  86.763  -0.884   9.952
  624    HA   GLN  83           HA       GLN  83  84.582  -1.697  11.692
  625    HB2  GLN  83           HB2      GLN  83  82.813  -1.780  10.240
  626    HB3  GLN  83           HB1      GLN  83  83.706  -0.525   9.384
  627    HG2  GLN  83           HG2      GLN  83  84.867  -2.377   8.092
  628    HG3  GLN  83           HG1      GLN  83  83.714  -3.501   8.812
  629   HE21  GLN  83          HE21      GLN  83  82.067  -3.926   7.341
  630   HE22  GLN  83          HE22      GLN  83  81.350  -2.776   6.319
  631    H    TYR  84           HN       TYR  84  86.777  -2.360   9.035
  632    HA   TYR  84           HA       TYR  84  87.385  -4.991  10.159
  633    HD1  TYR  84           HD2      TYR  84  88.311  -7.164   8.549
  634    HD2  TYR  84           HD1      TYR  84  84.117  -6.550   9.247
  635    HE1  TYR  84           HE2      TYR  84  88.123  -9.469   9.444
  636    HE2  TYR  84           HE1      TYR  84  83.929  -8.855  10.143
  637    HH   TYR  84           HH       TYR  84  86.139 -10.569  11.281
  638    HB2  TYR  84           HB2      TYR  84  85.360  -4.864   8.224
  639    HB3  TYR  84           HB1      TYR  84  86.789  -5.336   7.311
  640    H    GLY  85           HN       GLY  85  87.728  -2.766   7.411
  641    HA2  GLY  85           HA2      GLY  85  90.318  -2.072   7.460
  642    HA3  GLY  85           HA1      GLY  85  90.484  -3.745   6.928
  643    H    ILE  86           HN       ILE  86  88.299  -1.024   6.095
  644    HA   ILE  86           HA       ILE  86  89.238  -1.153   3.303
  645    HB   ILE  86           HB       ILE  86  86.449  -1.133   2.982
  646   HG12  ILE  86          HG12      ILE  86  87.235  -3.401   4.835
  647   HG13  ILE  86          HG11      ILE  86  86.346  -1.972   5.364
  648   HG21  ILE  86          HG21      ILE  86  86.856  -3.412   2.000
  649   HG22  ILE  86          HG22      ILE  86  88.485  -3.358   2.672
  650   HG23  ILE  86          HG23      ILE  86  87.999  -2.190   1.444
  651   HD11  ILE  86          HD11      ILE  86  84.911  -3.987   4.759
  652   HD12  ILE  86          HD12      ILE  86  85.409  -3.730   3.087
  653   HD13  ILE  86          HD13      ILE  86  84.493  -2.485   3.935
  654    H1U  RCY  87           H1U      RCY  87  84.124  -2.387   0.668
  655    H1S  RCY  87           H1S      RCY  87  83.000   1.566   2.556
  656    HB1  RCY  87           HB1      RCY  87  84.468   3.096   4.629
  657    HB2  RCY  87           HB2      RCY  87  84.436   1.442   4.019
  658    HA   RCY  87           HA       RCY  87  86.979   2.810   3.491
  659    HN1  RCY  87           HN1      RCY  87  86.108   0.129   4.292
  Start of MODEL   90
    1    HA   MET   1           HA       MET   1  90.250  -2.635  23.396
    2    HB2  MET   1           HB2      MET   1  88.646  -4.488  24.283
    3    HB3  MET   1           HB1      MET   1  87.428  -3.695  23.284
    4    HG2  MET   1           HG2      MET   1  89.212  -3.830  21.395
    5    HG3  MET   1           HG1      MET   1  89.984  -5.038  22.421
    6    HE1  MET   1           HE1      MET   1  89.109  -7.125  23.164
    7    HE2  MET   1           HE2      MET   1  87.583  -7.894  22.737
    8    HE3  MET   1           HE3      MET   1  87.594  -6.537  23.860
    9    H    ASN   2           HN       ASN   2  87.677  -2.862  21.598
   10    HA   ASN   2           HA       ASN   2  87.572   0.063  20.953
   11    HB2  ASN   2           HB2      ASN   2  87.392  -2.390  19.188
   12    HB3  ASN   2           HB1      ASN   2  86.944  -0.777  18.631
   13   HD21  ASN   2          HD21      ASN   2  88.693  -0.292  17.234
   14   HD22  ASN   2          HD22      ASN   2  90.316  -0.274  17.728
   15    H    LEU   3           HN       LEU   3  85.680   0.800  21.839
   16    HA   LEU   3           HA       LEU   3  83.335  -0.843  22.182
   17    HG   LEU   3           HG       LEU   3  84.740   2.363  21.520
   18    HB2  LEU   3           HB2      LEU   3  82.307   1.651  22.332
   19    HB3  LEU   3           HB1      LEU   3  83.213   0.921  23.656
   20   HD11  LEU   3          HD11      LEU   3  84.459   4.455  22.978
   21   HD12  LEU   3          HD12      LEU   3  83.062   3.644  23.685
   22   HD13  LEU   3          HD13      LEU   3  83.084   4.020  21.962
   23   HD21  LEU   3          HD21      LEU   3  86.341   2.614  23.221
   24   HD22  LEU   3          HD22      LEU   3  85.638   1.040  23.590
   25   HD23  LEU   3          HD23      LEU   3  85.140   2.464  24.504
   26    H    GLU   4           HN       GLU   4  82.819  -1.734  20.139
   27    HA   GLU   4           HA       GLU   4  82.267   0.105  17.895
   28    HB2  GLU   4           HB2      GLU   4  83.399  -2.217  17.713
   29    HB3  GLU   4           HB1      GLU   4  81.776  -2.874  17.916
   30    HG2  GLU   4           HG2      GLU   4  80.985  -1.664  15.960
   31    HG3  GLU   4           HG1      GLU   4  82.540  -0.848  15.794
   32    HA   PRO   5           HA       PRO   5  77.976   0.835  18.887
   33    HB2  PRO   5           HB2      PRO   5  77.667   0.113  15.986
   34    HB3  PRO   5           HB1      PRO   5  76.939   1.455  16.893
   35    HG2  PRO   5           HG2      PRO   5  79.071   1.804  15.314
   36    HG3  PRO   5           HG1      PRO   5  78.851   2.720  16.813
   37    HD2  PRO   5           HD2      PRO   5  80.817   0.602  16.204
   38    HD3  PRO   5           HD1      PRO   5  80.844   1.824  17.494
   39    HA   PRO   6           HA       PRO   6  76.989  -3.622  19.159
   40    HB2  PRO   6           HB2      PRO   6  75.643  -3.525  21.509
   41    HB3  PRO   6           HB1      PRO   6  77.415  -3.462  21.432
   42    HG2  PRO   6           HG2      PRO   6  75.467  -1.262  21.863
   43    HG3  PRO   6           HG1      PRO   6  77.072  -1.506  22.569
   44    HD2  PRO   6           HD2      PRO   6  76.509   0.212  20.442
   45    HD3  PRO   6           HD1      PRO   6  78.121  -0.419  20.843
   46    H    LYS   7           HN       LYS   7  74.984  -4.826  18.967
   47    HA   LYS   7           HA       LYS   7  72.773  -3.194  17.868
   48    HB2  LYS   7           HB2      LYS   7  71.843  -5.479  17.257
   49    HB3  LYS   7           HB1      LYS   7  73.385  -5.071  16.506
   50    HG2  LYS   7           HG2      LYS   7  73.872  -6.300  19.067
   51    HG3  LYS   7           HG1      LYS   7  72.802  -7.332  18.118
   52    HD2  LYS   7           HD2      LYS   7  74.384  -7.180  16.208
   53    HD3  LYS   7           HD1      LYS   7  75.471  -6.215  17.208
   54    HE2  LYS   7           HE2      LYS   7  76.268  -8.469  17.344
   55    HE3  LYS   7           HE1      LYS   7  75.452  -8.143  18.873
   56    HZ1  LYS   7           HZ1      LYS   7  74.235  -9.513  16.536
   57    HZ2  LYS   7           HZ2      LYS   7  73.480  -9.227  18.031
   58    HZ3  LYS   7           HZ3      LYS   7  74.807 -10.284  17.935
   59    H    ALA   8           HN       ALA   8  71.111  -2.623  19.173
   60    HA   ALA   8           HA       ALA   8  69.851  -4.515  20.967
   61    HB1  ALA   8           HB1      ALA   8  70.396  -3.543  23.076
   62    HB2  ALA   8           HB2      ALA   8  71.169  -2.151  22.316
   63    HB3  ALA   8           HB3      ALA   8  71.937  -3.737  22.239
   64    H    GLU   9           HN       GLU   9  69.718  -2.006  18.949
   65    HA   GLU   9           HA       GLU   9  68.113  -0.376  18.449
   66    HB2  GLU   9           HB2      GLU   9  66.539  -2.282  20.191
   67    HB3  GLU   9           HB1      GLU   9  65.801  -0.859  19.458
   68    HG2  GLU   9           HG2      GLU   9  66.558  -1.647  17.224
   69    HG3  GLU   9           HG1      GLU   9  67.209  -3.101  17.980
   70    H1U  RCY  10           H1U      RCY  10  65.447  -3.534  18.199
   71    H1S  RCY  10           H1S      RCY  10  65.482   0.751  19.699
   72    HB1  RCY  10           HB1      RCY  10  66.183   2.770  22.962
   73    HB2  RCY  10           HB2      RCY  10  67.366   1.479  23.172
   74    HA   RCY  10           HA       RCY  10  66.951   3.314  20.850
   75    HN1  RCY  10           HN1      RCY  10  67.149   1.555  19.311
   76    H    ARG  11           HN       ARG  11  69.513   2.665  19.778
   77    HA   ARG  11           HA       ARG  11  71.261   3.568  22.035
   78    HE   ARG  11           HE       ARG  11  73.738  -0.260  22.703
   79    HB2  ARG  11           HB2      ARG  11  72.037   1.658  19.806
   80    HB3  ARG  11           HB1      ARG  11  73.100   2.235  21.088
   81    HG2  ARG  11           HG2      ARG  11  70.514   0.847  21.764
   82    HG3  ARG  11           HG1      ARG  11  71.958  -0.091  21.382
   83    HD2  ARG  11           HD2      ARG  11  72.487   2.098  23.257
   84    HD3  ARG  11           HD1      ARG  11  71.324   0.927  23.879
   85   HH11  ARG  11          HH21      ARG  11  72.108   0.975  25.478
   86   HH12  ARG  11          HH22      ARG  11  73.080   0.092  26.608
   87   HH21  ARG  11          HH11      ARG  11  75.017  -1.421  24.162
   88   HH22  ARG  11          HH12      ARG  11  74.727  -1.264  25.862
   89    H    SER  12           HN       SER  12  70.224   3.887  18.754
   90    HA   SER  12           HA       SER  12  72.398   5.844  18.169
   91    HG   SER  12           HG       SER  12  73.178   4.511  16.377
   92    HB2  SER  12           HB2      SER  12  70.348   4.464  16.421
   93    HB3  SER  12           HB1      SER  12  71.374   5.773  15.840
   94    H    ALA  13           HN       ALA  13  68.861   5.629  17.604
   95    HA   ALA  13           HA       ALA  13  67.209   7.285  17.742
   96    HB1  ALA  13           HB1      ALA  13  68.301   7.404  20.096
   97    HB2  ALA  13           HB2      ALA  13  67.319   8.770  19.570
   98    HB3  ALA  13           HB3      ALA  13  69.078   8.870  19.500
   99    H    THR  14           HN       THR  14  70.055   9.405  18.112
  100    HA   THR  14           HA       THR  14  70.042  10.220  15.328
  101    HB   THR  14           HB       THR  14  69.015  12.258  17.323
  102    HG1  THR  14           HG1      THR  14  67.540  10.929  15.310
  103   HG21  THR  14          HG21      THR  14  70.283  12.903  15.160
  104   HG22  THR  14          HG22      THR  14  68.723  13.670  15.456
  105   HG23  THR  14          HG23      THR  14  68.845  12.332  14.314
  106    H    ARG  15           HN       ARG  15  70.597  12.919  17.255
  107    HA   ARG  15           HA       ARG  15  72.569  13.990  17.917
  108    HE   ARG  15           HE       ARG  15  77.249  12.259  20.353
  109    HB2  ARG  15           HB2      ARG  15  72.488  12.056  19.553
  110    HB3  ARG  15           HB1      ARG  15  73.572  11.183  18.478
  111    HG2  ARG  15           HG2      ARG  15  74.379  13.952  19.219
  112    HG3  ARG  15           HG1      ARG  15  74.484  12.730  20.486
  113    HD2  ARG  15           HD2      ARG  15  75.520  11.628  18.044
  114    HD3  ARG  15           HD1      ARG  15  76.307  13.175  18.353
  115   HH11  ARG  15          HH21      ARG  15  75.006  10.173  18.770
  116   HH12  ARG  15          HH22      ARG  15  75.451   8.776  19.692
  117   HH21  ARG  15          HH11      ARG  15  77.843  10.446  21.566
  118   HH22  ARG  15          HH12      ARG  15  77.057   8.930  21.275
  119    H    VAL  16           HN       VAL  16  72.364  12.107  15.234
  120    HA   VAL  16           HA       VAL  16  74.980  13.101  14.247
  121    HB   VAL  16           HB       VAL  16  74.090  10.213  13.965
  122   HG11  VAL  16          HG11      VAL  16  76.554  10.113  13.091
  123   HG12  VAL  16          HG12      VAL  16  76.349  11.844  12.827
  124   HG13  VAL  16          HG13      VAL  16  75.290  10.696  12.008
  125   HG21  VAL  16          HG21      VAL  16  74.909  10.468  16.183
  126   HG22  VAL  16          HG22      VAL  16  76.173  11.587  15.671
  127   HG23  VAL  16          HG23      VAL  16  76.292   9.875  15.263
  128    H    MET  17           HN       MET  17  71.718  12.849  13.842
  129    HA   MET  17           HA       MET  17  71.973  13.346  10.909
  130    HB2  MET  17           HB2      MET  17  69.780  11.655  12.145
  131    HB3  MET  17           HB1      MET  17  70.037  11.972  10.429
  132    HG2  MET  17           HG2      MET  17  71.062   9.899  10.615
  133    HG3  MET  17           HG1      MET  17  72.436  10.955  10.945
  134    HE1  MET  17           HE1      MET  17  72.227   7.826  11.863
  135    HE2  MET  17           HE2      MET  17  73.146   8.062  13.347
  136    HE3  MET  17           HE3      MET  17  73.589   8.953  11.893
  137    H    GLY  18           HN       GLY  18  70.420  14.828  10.097
  138    HA2  GLY  18           HA2      GLY  18  68.095  15.830  10.936
  139    HA3  GLY  18           HA1      GLY  18  69.139  16.482  12.200
  140    H    GLY  19           HN       GLY  19  70.596  18.152  11.673
  141    HA2  GLY  19           HA2      GLY  19  69.859  19.740   9.343
  142    HA3  GLY  19           HA1      GLY  19  71.072  20.171  10.547
  143    HA   PRO  20           HA       PRO  20  74.524  18.546   8.282
  144    HB2  PRO  20           HB2      PRO  20  74.469  15.764   9.345
  145    HB3  PRO  20           HB1      PRO  20  75.771  16.968   9.398
  146    HG2  PRO  20           HG2      PRO  20  74.353  16.346  11.565
  147    HG3  PRO  20           HG1      PRO  20  74.916  17.999  11.267
  148    HD2  PRO  20           HD2      PRO  20  72.160  16.861  10.942
  149    HD3  PRO  20           HD1      PRO  20  72.654  18.478  11.492
  150    H1U  RCY  21           H1U      RCY  21  66.740  11.158   8.133
  151    H1S  RCY  21           H1S      RCY  21  68.594  14.453   6.512
  152    HB1  RCY  21           HB1      RCY  21  70.153  15.684   6.852
  153    HB2  RCY  21           HB2      RCY  21  71.393  14.486   6.489
  154    HA   RCY  21           HA       RCY  21  72.616  15.999   5.131
  155    HN1  RCY  21           HN1      RCY  21  71.686  17.814   7.305
  156    H    THR  22           HN       THR  22  72.404  17.196   3.306
  157    HA   THR  22           HA       THR  22  70.284  19.267   3.173
  158    HB   THR  22           HB       THR  22  72.298  20.201   2.439
  159    HG1  THR  22           HG1      THR  22  70.940  19.106   0.214
  160   HG21  THR  22          HG21      THR  22  73.657  18.200   2.478
  161   HG22  THR  22          HG22      THR  22  73.851  18.961   0.899
  162   HG23  THR  22          HG23      THR  22  72.812  17.546   1.074
  163    HA   PRO  23           HA       PRO  23  67.435  16.771   0.834
  164    HB2  PRO  23           HB2      PRO  23  67.267  19.200  -0.917
  165    HB3  PRO  23           HB1      PRO  23  65.962  18.238  -0.196
  166    HG2  PRO  23           HG2      PRO  23  66.694  20.598   0.816
  167    HG3  PRO  23           HG1      PRO  23  66.154  19.263   1.847
  168    HD2  PRO  23           HD2      PRO  23  68.888  20.370   1.499
  169    HD3  PRO  23           HD1      PRO  23  68.195  19.487   2.876
  170    H    ARG  24           HN       ARG  24  69.495  15.559   0.080
  171    HA   ARG  24           HA       ARG  24  70.899  14.758  -1.641
  172    HE   ARG  24           HE       ARG  24  66.489  11.274  -1.958
  173    HB2  ARG  24           HB2      ARG  24  68.561  15.412  -3.438
  174    HB3  ARG  24           HB1      ARG  24  69.679  14.052  -3.546
  175    HG2  ARG  24           HG2      ARG  24  68.788  13.179  -1.395
  176    HG3  ARG  24           HG1      ARG  24  67.625  14.505  -1.362
  177    HD2  ARG  24           HD2      ARG  24  66.679  13.730  -3.508
  178    HD3  ARG  24           HD1      ARG  24  67.836  12.399  -3.535
  179   HH11  ARG  24          HH21      ARG  24  65.766  14.641  -2.125
  180   HH12  ARG  24          HH22      ARG  24  64.387  14.533  -1.083
  181   HH21  ARG  24          HH11      ARG  24  64.692  11.113  -0.596
  182   HH22  ARG  24          HH12      ARG  24  63.778  12.535  -0.218
  183    H    LYS  25           HN       LYS  25  72.531  16.329  -1.864
  184    HA   LYS  25           HA       LYS  25  71.997  18.701  -3.539
  185    HB2  LYS  25           HB2      LYS  25  73.818  19.639  -2.529
  186    HB3  LYS  25           HB1      LYS  25  73.584  18.353  -1.352
  187    HG2  LYS  25           HG2      LYS  25  75.376  18.148  -3.794
  188    HG3  LYS  25           HG1      LYS  25  75.945  18.472  -2.156
  189    HD2  LYS  25           HD2      LYS  25  74.178  16.109  -2.458
  190    HD3  LYS  25           HD1      LYS  25  75.773  15.973  -3.200
  191    HE2  LYS  25           HE2      LYS  25  75.606  15.228  -0.758
  192    HE3  LYS  25           HE1      LYS  25  76.883  16.387  -1.130
  193    HZ1  LYS  25           HZ1      LYS  25  75.166  18.140  -0.517
  194    HZ2  LYS  25           HZ2      LYS  25  75.845  17.240   0.754
  195    HZ3  LYS  25           HZ3      LYS  25  74.284  16.875   0.190
  196    H    GLY  26           HN       GLY  26  72.995  15.503  -4.013
  197    HA2  GLY  26           HA2      GLY  26  74.713  16.131  -6.337
  198    HA3  GLY  26           HA1      GLY  26  74.369  14.516  -5.714
  199    HA   PRO  27           HA       PRO  27  71.229  16.278  -9.125
  200    HB2  PRO  27           HB2      PRO  27  73.210  15.248 -11.108
  201    HB3  PRO  27           HB1      PRO  27  72.161  16.676 -11.200
  202    HG2  PRO  27           HG2      PRO  27  74.777  16.884 -10.722
  203    HG3  PRO  27           HG1      PRO  27  73.601  17.978  -9.975
  204    HD2  PRO  27           HD2      PRO  27  75.113  15.714  -8.742
  205    HD3  PRO  27           HD1      PRO  27  74.548  17.229  -8.005
  206    HA   PRO  28           HA       PRO  28  69.429  12.224  -9.310
  207    HB2  PRO  28           HB2      PRO  28  69.013  12.796 -12.225
  208    HB3  PRO  28           HB1      PRO  28  67.857  12.198 -11.019
  209    HG2  PRO  28           HG2      PRO  28  67.865  14.746 -11.836
  210    HG3  PRO  28           HG1      PRO  28  67.447  14.287 -10.178
  211    HD2  PRO  28           HD2      PRO  28  69.873  15.663 -11.177
  212    HD3  PRO  28           HD1      PRO  28  69.176  15.650  -9.542
  213    H    LYS  29           HN       LYS  29  69.726  10.085 -10.425
  214    HA   LYS  29           HA       LYS  29  72.447   9.441 -10.858
  215    HB2  LYS  29           HB2      LYS  29  70.128   7.917 -12.063
  216    HB3  LYS  29           HB1      LYS  29  71.688   7.279 -11.544
  217    HG2  LYS  29           HG2      LYS  29  69.513   8.418  -9.768
  218    HG3  LYS  29           HG1      LYS  29  70.045   6.738  -9.842
  219    HD2  LYS  29           HD2      LYS  29  72.385   7.662  -9.231
  220    HD3  LYS  29           HD1      LYS  29  71.529   9.129  -8.755
  221    HE2  LYS  29           HE2      LYS  29  71.654   7.837  -6.767
  222    HE3  LYS  29           HE1      LYS  29  70.013   7.586  -7.361
  223    HZ1  LYS  29           HZ1      LYS  29  70.486   5.470  -8.055
  224    HZ2  LYS  29           HZ2      LYS  29  71.476   5.571  -6.678
  225    HZ3  LYS  29           HZ3      LYS  29  72.148   5.765  -8.226
  226    H1U  RCY  30           H1U      RCY  30  69.760  11.136 -10.268
  227    H1S  RCY  30           H1S      RCY  30  73.009  13.463 -12.517
  228    HB1  RCY  30           HB1      RCY  30  74.958  11.323 -15.700
  229    HB2  RCY  30           HB2      RCY  30  75.475  10.363 -14.317
  230    HA   RCY  30           HA       RCY  30  72.609  11.085 -15.002
  231    HN1  RCY  30           HN1      RCY  30  73.735  10.014 -12.536
  232    H    LYS  31           HN       LYS  31  75.340   9.009 -15.397
  233    HA   LYS  31           HA       LYS  31  73.675   6.821 -16.520
  234    HB2  LYS  31           HB2      LYS  31  75.698   7.087 -18.418
  235    HB3  LYS  31           HB1      LYS  31  74.024   7.588 -18.630
  236    HG2  LYS  31           HG2      LYS  31  75.461   9.477 -19.153
  237    HG3  LYS  31           HG1      LYS  31  74.624   9.816 -17.638
  238    HD2  LYS  31           HD2      LYS  31  76.820  10.379 -17.087
  239    HD3  LYS  31           HD1      LYS  31  76.741   8.702 -16.546
  240    HE2  LYS  31           HE2      LYS  31  78.634   8.506 -17.818
  241    HE3  LYS  31           HE1      LYS  31  77.465   8.315 -19.125
  242    HZ1  LYS  31           HZ1      LYS  31  78.021  11.058 -18.493
  243    HZ2  LYS  31           HZ2      LYS  31  78.024  10.269 -19.997
  244    HZ3  LYS  31           HZ3      LYS  31  79.400  10.211 -19.002
  245    H    GLN  32           HN       GLN  32  74.567   5.785 -14.558
  246    HA   GLN  32           HA       GLN  32  77.432   5.415 -14.293
  247    HB2  GLN  32           HB2      GLN  32  75.866   5.282 -12.364
  248    HB3  GLN  32           HB1      GLN  32  75.163   3.822 -13.060
  249    HG2  GLN  32           HG2      GLN  32  76.833   3.215 -11.370
  250    HG3  GLN  32           HG1      GLN  32  77.395   2.730 -12.971
  251   HE21  GLN  32          HE21      GLN  32  79.171   3.953 -13.932
  252   HE22  GLN  32          HE22      GLN  32  80.118   5.013 -13.004
  253    H    ARG  33           HN       ARG  33  78.681   3.918 -15.304
  254    HA   ARG  33           HA       ARG  33  77.520   1.382 -16.244
  255    HE   ARG  33           HE       ARG  33  77.998   4.037 -20.050
  256    HB2  ARG  33           HB2      ARG  33  78.556   3.519 -18.117
  257    HB3  ARG  33           HB1      ARG  33  78.544   1.815 -18.571
  258    HG2  ARG  33           HG2      ARG  33  76.048   1.864 -17.844
  259    HG3  ARG  33           HG1      ARG  33  76.202   3.617 -17.971
  260    HD2  ARG  33           HD2      ARG  33  76.429   1.539 -20.133
  261    HD3  ARG  33           HD1      ARG  33  75.496   3.036 -20.125
  262   HH11  ARG  33          HH21      ARG  33  76.621   1.426 -21.831
  263   HH12  ARG  33          HH22      ARG  33  77.691   1.609 -23.182
  264   HH21  ARG  33          HH11      ARG  33  79.402   4.291 -21.803
  265   HH22  ARG  33          HH12      ARG  33  79.265   3.231 -23.165
  266    H    GLN  34           HN       GLN  34  79.359   1.654 -14.257
  267    HA   GLN  34           HA       GLN  34  81.478   0.903 -13.592
  268    HB2  GLN  34           HB2      GLN  34  80.715  -0.951 -15.250
  269    HB3  GLN  34           HB1      GLN  34  81.847  -0.202 -16.376
  270    HG2  GLN  34           HG2      GLN  34  83.119  -1.874 -15.271
  271    HG3  GLN  34           HG1      GLN  34  83.578  -0.367 -14.478
  272   HE21  GLN  34          HE21      GLN  34  83.078  -0.134 -12.246
  273   HE22  GLN  34          HE22      GLN  34  82.280  -1.325 -11.338
  274    H    THR  35           HN       THR  35  83.044   2.413 -13.340
  275    HA   THR  35           HA       THR  35  84.844   3.148 -15.439
  276    HB   THR  35           HB       THR  35  83.298   4.587 -16.434
  277    HG1  THR  35           HG1      THR  35  85.219   5.660 -15.276
  278   HG21  THR  35          HG21      THR  35  81.388   4.403 -15.096
  279   HG22  THR  35          HG22      THR  35  81.840   6.092 -14.867
  280   HG23  THR  35          HG23      THR  35  82.246   4.897 -13.635
  281    H    ARG  36           HN       ARG  36  83.736   3.180 -12.253
  282    HA   ARG  36           HA       ARG  36  85.820   5.080 -11.316
  283    HE   ARG  36           HE       ARG  36  83.343   6.532  -8.060
  284    HB2  ARG  36           HB2      ARG  36  83.760   3.513  -9.730
  285    HB3  ARG  36           HB1      ARG  36  84.785   4.809  -9.113
  286    HG2  ARG  36           HG2      ARG  36  83.067   5.366 -11.504
  287    HG3  ARG  36           HG1      ARG  36  82.305   5.318  -9.913
  288    HD2  ARG  36           HD2      ARG  36  84.827   6.904 -10.296
  289    HD3  ARG  36           HD1      ARG  36  83.284   7.587 -10.809
  290   HH11  ARG  36          HH21      ARG  36  83.661   9.188 -10.235
  291   HH12  ARG  36          HH22      ARG  36  83.350  10.388  -9.025
  292   HH21  ARG  36          HH11      ARG  36  82.936   8.084  -6.468
  293   HH22  ARG  36          HH12      ARG  36  82.940   9.763  -6.893
  294    H    GLN  37           HN       GLN  37  86.477   2.446 -12.543
  295    HA   GLN  37           HA       GLN  37  87.913   0.636 -12.139
  296    HB2  GLN  37           HB2      GLN  37  88.751   2.352  -9.779
  297    HB3  GLN  37           HB1      GLN  37  89.674   1.019 -10.473
  298    HG2  GLN  37           HG2      GLN  37  90.070   2.194 -12.493
  299    HG3  GLN  37           HG1      GLN  37  88.808   3.377 -12.148
  300   HE21  GLN  37          HE21      GLN  37  92.154   2.909 -12.023
  301   HE22  GLN  37          HE22      GLN  37  92.540   4.133 -10.912
  302    H1U  RCY  38           H1U      RCY  38  82.519  -0.848  -4.599
  303    H1S  RCY  38           H1S      RCY  38  84.385  -2.338  -7.333
  304    HB1  RCY  38           HB1      RCY  38  84.024  -2.465  -9.325
  305    HB2  RCY  38           HB2      RCY  38  84.216  -1.121 -10.450
  306    HA   RCY  38           HA       RCY  38  86.517  -1.709  -8.647
  307    HN1  RCY  38           HN1      RCY  38  86.835  -1.183 -11.519
  308    H    LYS  39           HN       LYS  39  87.687  -2.735 -11.373
  309    HA   LYS  39           HA       LYS  39  86.501  -5.309 -11.836
  310    HB2  LYS  39           HB2      LYS  39  88.873  -3.834 -12.719
  311    HB3  LYS  39           HB1      LYS  39  89.203  -5.555 -12.525
  312    HG2  LYS  39           HG2      LYS  39  88.406  -5.132 -14.797
  313    HG3  LYS  39           HG1      LYS  39  87.195  -6.062 -13.915
  314    HD2  LYS  39           HD2      LYS  39  85.665  -4.416 -14.111
  315    HD3  LYS  39           HD1      LYS  39  86.812  -3.198 -13.552
  316    HE2  LYS  39           HE2      LYS  39  87.814  -3.122 -15.820
  317    HE3  LYS  39           HE1      LYS  39  86.622  -4.298 -16.372
  318    HZ1  LYS  39           HZ1      LYS  39  85.890  -2.087 -16.905
  319    HZ2  LYS  39           HZ2      LYS  39  86.058  -1.592 -15.288
  320    HZ3  LYS  39           HZ3      LYS  39  84.872  -2.733 -15.711
  321    H    SER  40           HN       SER  40  88.686  -4.102  -9.419
  322    HA   SER  40           HA       SER  40  89.999  -6.479  -8.627
  323    HG   SER  40           HG       SER  40  88.105  -3.943  -7.612
  324    HB2  SER  40           HB2      SER  40  89.982  -5.387  -6.312
  325    HB3  SER  40           HB1      SER  40  90.692  -4.435  -7.612
  326    H    LYS  41           HN       LYS  41  88.378  -8.161  -8.927
  327    HA   LYS  41           HA       LYS  41  85.875  -8.262  -7.618
  328    HB2  LYS  41           HB2      LYS  41  86.071 -10.732  -7.860
  329    HB3  LYS  41           HB1      LYS  41  86.493  -9.875  -9.341
  330    HG2  LYS  41           HG2      LYS  41  88.424 -11.059  -9.303
  331    HG3  LYS  41           HG1      LYS  41  88.909 -10.003  -7.976
  332    HD2  LYS  41           HD2      LYS  41  89.180 -12.137  -7.044
  333    HD3  LYS  41           HD1      LYS  41  87.572 -11.679  -6.482
  334    HE2  LYS  41           HE2      LYS  41  87.274 -13.868  -7.323
  335    HE3  LYS  41           HE1      LYS  41  86.709 -12.831  -8.633
  336    HZ1  LYS  41           HZ1      LYS  41  89.448 -13.960  -8.426
  337    HZ2  LYS  41           HZ2      LYS  41  88.826 -13.047  -9.717
  338    HZ3  LYS  41           HZ3      LYS  41  88.210 -14.597  -9.396
  339    HA   PRO  42           HA       PRO  42  87.560  -8.605  -3.441
  340    HB2  PRO  42           HB2      PRO  42  85.213  -8.381  -2.089
  341    HB3  PRO  42           HB1      PRO  42  86.002  -6.989  -2.856
  342    HG2  PRO  42           HG2      PRO  42  83.689  -8.601  -3.800
  343    HG3  PRO  42           HG1      PRO  42  83.973  -6.857  -3.912
  344    HD2  PRO  42           HD2      PRO  42  84.378  -8.636  -6.000
  345    HD3  PRO  42           HD1      PRO  42  85.169  -7.051  -5.868
  346    HA   PRO  43           HA       PRO  43  87.078 -12.862  -2.353
  347    HB2  PRO  43           HB2      PRO  43  86.845 -12.695   0.422
  348    HB3  PRO  43           HB1      PRO  43  88.374 -12.657  -0.475
  349    HG2  PRO  43           HG2      PRO  43  86.798 -10.416   0.667
  350    HG3  PRO  43           HG1      PRO  43  88.554 -10.627   0.557
  351    HD2  PRO  43           HD2      PRO  43  87.199  -8.974  -1.119
  352    HD3  PRO  43           HD1      PRO  43  88.646  -9.867  -1.641
  353    H    LYS  44           HN       LYS  44  85.254 -14.059  -2.652
  354    HA   LYS  44           HA       LYS  44  82.962 -13.766  -0.853
  355    HB2  LYS  44           HB2      LYS  44  82.611 -11.987  -2.605
  356    HB3  LYS  44           HB1      LYS  44  82.575 -13.264  -3.819
  357    HG2  LYS  44           HG2      LYS  44  80.358 -13.431  -3.403
  358    HG3  LYS  44           HG1      LYS  44  80.801 -14.158  -1.858
  359    HD2  LYS  44           HD2      LYS  44  80.551 -11.169  -2.283
  360    HD3  LYS  44           HD1      LYS  44  79.240 -12.178  -1.668
  361    HE2  LYS  44           HE2      LYS  44  81.957 -11.741  -0.401
  362    HE3  LYS  44           HE1      LYS  44  80.391 -11.241   0.238
  363    HZ1  LYS  44           HZ1      LYS  44  79.762 -13.599   0.338
  364    HZ2  LYS  44           HZ2      LYS  44  81.101 -13.245   1.322
  365    HZ3  LYS  44           HZ3      LYS  44  81.323 -14.031  -0.168
  366    H    LYS  45           HN       LYS  45  81.852 -14.909  -3.775
  367    HA   LYS  45           HA       LYS  45  83.017 -17.559  -3.775
  368    HB2  LYS  45           HB2      LYS  45  81.664 -17.743  -1.719
  369    HB3  LYS  45           HB1      LYS  45  80.229 -17.250  -2.619
  370    HG2  LYS  45           HG2      LYS  45  80.086 -19.259  -3.766
  371    HG3  LYS  45           HG1      LYS  45  81.818 -19.569  -3.648
  372    HD2  LYS  45           HD2      LYS  45  80.678 -21.121  -2.177
  373    HD3  LYS  45           HD1      LYS  45  81.515 -19.933  -1.177
  374    HE2  LYS  45           HE2      LYS  45  79.253 -20.254  -0.317
  375    HE3  LYS  45           HE1      LYS  45  79.390 -18.636  -1.005
  376    HZ1  LYS  45           HZ1      LYS  45  78.409 -20.933  -2.589
  377    HZ2  LYS  45           HZ2      LYS  45  78.233 -19.275  -2.914
  378    HZ3  LYS  45           HZ3      LYS  45  77.365 -19.991  -1.641
  379    H    GLY  46           HN       GLY  46  81.300 -15.088  -5.156
  380    HA2  GLY  46           HA2      GLY  46  80.637 -16.788  -7.499
  381    HA3  GLY  46           HA1      GLY  46  79.353 -15.782  -6.827
  382    H    VAL  47           HN       VAL  47  80.273 -15.425  -9.464
  383    HA   VAL  47           HA       VAL  47  81.375 -12.666  -9.248
  384    HB   VAL  47           HB       VAL  47  82.406 -14.826 -11.113
  385   HG11  VAL  47          HG11      VAL  47  82.354 -12.803 -12.376
  386   HG12  VAL  47          HG12      VAL  47  84.007 -12.938 -11.776
  387   HG13  VAL  47          HG13      VAL  47  82.871 -11.840 -10.991
  388   HG21  VAL  47          HG21      VAL  47  84.571 -14.290  -9.960
  389   HG22  VAL  47          HG22      VAL  47  83.363 -14.989  -8.881
  390   HG23  VAL  47          HG23      VAL  47  83.675 -13.253  -8.850
  391    H    GLN  48           HN       GLN  48  79.551 -15.095 -11.007
  392    HA   GLN  48           HA       GLN  48  78.850 -13.481 -13.271
  393    HB2  GLN  48           HB2      GLN  48  77.050 -15.090 -13.626
  394    HB3  GLN  48           HB1      GLN  48  78.507 -15.955 -13.137
  395    HG2  GLN  48           HG2      GLN  48  77.598 -15.759 -10.731
  396    HG3  GLN  48           HG1      GLN  48  76.061 -15.330 -11.482
  397   HE21  GLN  48          HE21      GLN  48  75.177 -17.409 -10.614
  398   HE22  GLN  48          HE22      GLN  48  75.529 -18.867 -11.409
  399    H    GLY  49           HN       GLY  49  77.252 -14.006 -10.126
  400    HA2  GLY  49           HA2      GLY  49  75.160 -12.047 -10.775
  401    HA3  GLY  49           HA1      GLY  49  75.335 -12.909  -9.244
  402    H1U  RCY  50           H1U      RCY  50  82.896  -8.152  -2.996
  403    H1S  RCY  50           H1S      RCY  50  80.267  -9.037  -6.542
  404    HB1  RCY  50           HB1      RCY  50  80.054 -10.228  -9.920
  405    HB2  RCY  50           HB2      RCY  50  79.464 -10.382  -8.265
  406    HA   RCY  50           HA       RCY  50  77.583  -8.921  -8.743
  407    HN1  RCY  50           HN1      RCY  50  77.645 -10.848 -11.018
  408    H    GLY  51           HN       GLY  51  77.270  -9.399 -11.977
  409    HA2  GLY  51           HA2      GLY  51  77.816  -6.545 -12.533
  410    HA3  GLY  51           HA1      GLY  51  78.671  -7.720 -13.535
  411    H    ASP  52           HN       ASP  52  76.673  -9.670 -13.816
  412    HA   ASP  52           HA       ASP  52  74.916  -8.311 -15.746
  413    HB2  ASP  52           HB2      ASP  52  74.120 -10.754 -16.094
  414    HB3  ASP  52           HB1      ASP  52  75.772 -10.356 -16.567
  415    H    ASP  53           HN       ASP  53  73.842  -7.136 -13.848
  416    HA   ASP  53           HA       ASP  53  72.034  -8.762 -12.199
  417    HB2  ASP  53           HB2      ASP  53  71.860  -5.767 -12.453
  418    HB3  ASP  53           HB1      ASP  53  71.551  -6.781 -11.044
  419    H    ILE  54           HN       ILE  54  69.635  -7.924 -12.156
  420    HA   ILE  54           HA       ILE  54  68.576  -8.334 -14.834
  421    HB   ILE  54           HB       ILE  54  66.386  -7.635 -13.365
  422   HG12  ILE  54          HG12      ILE  54  68.158  -7.245 -11.460
  423   HG13  ILE  54          HG11      ILE  54  66.649  -8.077 -11.082
  424   HG21  ILE  54          HG21      ILE  54  66.469  -9.740 -14.451
  425   HG22  ILE  54          HG22      ILE  54  66.343 -10.138 -12.737
  426   HG23  ILE  54          HG23      ILE  54  67.903 -10.239 -13.554
  427   HD11  ILE  54          HD11      ILE  54  67.673 -10.160 -10.943
  428   HD12  ILE  54          HD12      ILE  54  68.963  -9.119 -10.340
  429   HD13  ILE  54          HD13      ILE  54  68.999  -9.693 -12.007
  430    HA   PRO  55           HA       PRO  55  68.423  -3.971 -15.784
  431    HB2  PRO  55           HB2      PRO  55  66.951  -4.078 -18.062
  432    HB3  PRO  55           HB1      PRO  55  68.627  -4.660 -17.989
  433    HG2  PRO  55           HG2      PRO  55  66.090  -6.219 -17.898
  434    HG3  PRO  55           HG1      PRO  55  67.605  -6.575 -18.746
  435    HD2  PRO  55           HD2      PRO  55  66.904  -7.729 -16.344
  436    HD3  PRO  55           HD1      PRO  55  68.586  -7.511 -16.876
  437    H    GLY  56           HN       GLY  56  66.943  -3.796 -13.757
  438    HA2  GLY  56           HA2      GLY  56  65.083  -2.568 -12.951
  439    HA3  GLY  56           HA1      GLY  56  64.451  -2.507 -14.595
  440    H    MET  57           HN       MET  57  64.999  -4.863 -11.953
  441    HA   MET  57           HA       MET  57  62.273  -5.763 -12.011
  442    HB2  MET  57           HB2      MET  57  63.421  -6.748 -14.174
  443    HB3  MET  57           HB1      MET  57  64.127  -7.896 -13.040
  444    HG2  MET  57           HG2      MET  57  61.161  -7.330 -13.320
  445    HG3  MET  57           HG1      MET  57  61.992  -8.736 -13.985
  446    HE1  MET  57           HE1      MET  57  60.412 -10.773 -11.323
  447    HE2  MET  57           HE2      MET  57  61.362 -10.878 -12.803
  448    HE3  MET  57           HE3      MET  57  59.954  -9.821 -12.741
  449    H    GLU  58           HN       GLU  58  62.948  -5.250  -9.749
  450    HA   GLU  58           HA       GLU  58  63.359  -6.054  -7.584
  451    HB2  GLU  58           HB2      GLU  58  62.469  -8.240  -8.795
  452    HB3  GLU  58           HB1      GLU  58  64.151  -8.747  -8.645
  453    HG2  GLU  58           HG2      GLU  58  64.058  -8.261  -6.210
  454    HG3  GLU  58           HG1      GLU  58  62.354  -7.834  -6.378
  455    H    GLY  59           HN       GLY  59  65.191  -5.359  -6.617
  456    HA2  GLY  59           HA2      GLY  59  67.473  -5.457  -5.960
  457    HA3  GLY  59           HA1      GLY  59  67.761  -6.641  -7.234
  458    H1U  RCY  60           H1U      RCY  60  72.223  -1.328  -5.120
  459    H1S  RCY  60           H1S      RCY  60  69.824  -3.043  -8.571
  460    HB1  RCY  60           HB1      RCY  60  68.040  -3.588 -11.584
  461    HB2  RCY  60           HB2      RCY  60  68.813  -4.506 -10.295
  462    HA   RCY  60           HA       RCY  60  68.063  -2.168  -9.012
  463    HN1  RCY  60           HN1      RCY  60  66.093  -4.239  -8.725
  464    H    GLY  61           HN       GLY  61  65.104  -2.762  -8.892
  465    HA2  GLY  61           HA2      GLY  61  63.607  -2.398 -11.145
  466    HA3  GLY  61           HA1      GLY  61  63.257  -1.492  -9.674
  467    H    THR  62           HN       THR  62  65.446   0.199  -9.543
  468    HA   THR  62           HA       THR  62  66.238   1.506 -11.913
  469    HB   THR  62           HB       THR  62  63.977   2.051 -12.448
  470    HG1  THR  62           HG1      THR  62  65.262   3.859 -12.602
  471   HG21  THR  62          HG21      THR  62  62.764   1.513 -10.504
  472   HG22  THR  62          HG22      THR  62  62.582   3.263 -10.625
  473   HG23  THR  62          HG23      THR  62  63.743   2.574  -9.491
  474    H    ASP  63           HN       ASP  63  65.067   4.035 -10.167
  475    HA   ASP  63           HA       ASP  63  67.630   4.600  -8.949
  476    HB2  ASP  63           HB2      ASP  63  65.062   5.991  -8.195
  477    HB3  ASP  63           HB1      ASP  63  66.689   6.663  -8.309
  478    H    ILE  64           HN       ILE  64  64.404   4.067  -7.479
  479    HA   ILE  64           HA       ILE  64  65.366   3.802  -4.810
  480    HB   ILE  64           HB       ILE  64  62.866   2.872  -6.230
  481   HG12  ILE  64          HG12      ILE  64  62.015   4.427  -4.246
  482   HG13  ILE  64          HG11      ILE  64  63.672   5.029  -4.313
  483   HG21  ILE  64          HG21      ILE  64  63.100   1.136  -4.645
  484   HG22  ILE  64          HG22      ILE  64  62.083   2.319  -3.822
  485   HG23  ILE  64          HG23      ILE  64  63.801   2.214  -3.438
  486   HD11  ILE  64          HD11      ILE  64  61.622   5.010  -6.538
  487   HD12  ILE  64          HD12      ILE  64  63.336   5.311  -6.823
  488   HD13  ILE  64          HD13      ILE  64  62.406   6.409  -5.804
  489    H    THR  65           HN       THR  65  65.609   1.709  -7.506
  490    HA   THR  65           HA       THR  65  66.171  -0.581  -7.686
  491    HB   THR  65           HB       THR  65  67.974   0.411  -5.459
  492    HG1  THR  65           HG1      THR  65  68.777  -0.058  -8.086
  493   HG21  THR  65          HG21      THR  65  68.457  -1.800  -5.242
  494   HG22  THR  65          HG22      THR  65  69.347  -1.570  -6.747
  495   HG23  THR  65          HG23      THR  65  67.705  -2.213  -6.784
  496    H    VAL  66           HN       VAL  66  63.973   0.070  -5.790
  497    HA   VAL  66           HA       VAL  66  62.611  -1.122  -4.305
  498    HB   VAL  66           HB       VAL  66  64.547  -3.430  -4.518
  499   HG11  VAL  66          HG11      VAL  66  61.524  -3.415  -4.434
  500   HG12  VAL  66          HG12      VAL  66  62.505  -3.410  -2.968
  501   HG13  VAL  66          HG13      VAL  66  62.614  -4.760  -4.098
  502   HG21  VAL  66          HG21      VAL  66  62.650  -2.318  -6.574
  503   HG22  VAL  66          HG22      VAL  66  62.945  -4.055  -6.499
  504   HG23  VAL  66          HG23      VAL  66  64.283  -2.945  -6.798
  505    H    ILE  67           HN       ILE  67  66.107  -1.237  -3.763
  506    HA   ILE  67           HA       ILE  67  65.554  -0.839  -0.858
  507    HB   ILE  67           HB       ILE  67  67.798  -2.567  -1.919
  508   HG12  ILE  67          HG12      ILE  67  65.101  -3.363  -0.777
  509   HG13  ILE  67          HG11      ILE  67  65.642  -3.625  -2.435
  510   HG21  ILE  67          HG21      ILE  67  68.050  -3.215   0.402
  511   HG22  ILE  67          HG22      ILE  67  66.607  -2.309   0.856
  512   HG23  ILE  67          HG23      ILE  67  68.054  -1.453   0.324
  513   HD11  ILE  67          HD11      ILE  67  66.568  -4.967   0.089
  514   HD12  ILE  67          HD12      ILE  67  67.657  -4.859  -1.294
  515   HD13  ILE  67          HD13      ILE  67  66.111  -5.693  -1.452
  516    H1U  RCY  68           H1U      RCY  68  72.089   0.558  -0.780
  517    H1S  RCY  68           H1S      RCY  68  69.088   0.967  -3.508
  518    HB1  RCY  68           HB1      RCY  68  67.954   4.320  -2.321
  519    HB2  RCY  68           HB2      RCY  68  66.378   3.540  -2.371
  520    HA   RCY  68           HA       RCY  68  68.888   2.016  -1.640
  521    HN1  RCY  68           HN1      RCY  68  66.012   1.378  -1.105
  522    HA   PRO  69           HA       PRO  69  69.689   3.995   2.230
  523    HB2  PRO  69           HB2      PRO  69  68.866   6.574   0.925
  524    HB3  PRO  69           HB1      PRO  69  70.243   6.248   1.998
  525    HG2  PRO  69           HG2      PRO  69  70.408   6.338  -0.731
  526    HG3  PRO  69           HG1      PRO  69  71.528   5.451   0.311
  527    HD2  PRO  69           HD2      PRO  69  69.675   4.360  -1.610
  528    HD3  PRO  69           HD1      PRO  69  70.791   3.472  -0.548
  529    H    TRP  70           HN       TRP  70  66.747   5.372   0.651
  530    HA   TRP  70           HA       TRP  70  65.494   5.894   3.223
  531    HD1  TRP  70           HD1      TRP  70  63.680   4.275  -0.549
  532    HE1  TRP  70           HE1      TRP  70  64.753   4.645  -2.862
  533    HE3  TRP  70           HE3      TRP  70  66.379   8.504   0.399
  534    HZ2  TRP  70           HZ2      TRP  70  66.526   6.494  -4.144
  535    HZ3  TRP  70           HZ3      TRP  70  67.748   9.547  -1.380
  536    HH2  TRP  70           HH2      TRP  70  67.827   8.551  -3.648
  537    HB2  TRP  70           HB2      TRP  70  63.379   5.925   1.545
  538    HB3  TRP  70           HB1      TRP  70  64.501   7.276   1.681
  539    H    GLU  71           HN       GLU  71  65.659   3.169   1.070
  540    HA   GLU  71           HA       GLU  71  63.802   1.668   2.878
  541    HB2  GLU  71           HB2      GLU  71  64.228   1.387  -0.111
  542    HB3  GLU  71           HB1      GLU  71  63.328   0.226   0.865
  543    HG2  GLU  71           HG2      GLU  71  62.574   3.101   1.125
  544    HG3  GLU  71           HG1      GLU  71  62.112   2.275  -0.364
  545    H    ALA  72           HN       ALA  72  65.871   1.317   4.056
  546    HA   ALA  72           HA       ALA  72  68.132   0.008   2.983
  547    HB1  ALA  72           HB1      ALA  72  68.729  -0.512   5.226
  548    HB2  ALA  72           HB2      ALA  72  67.044  -0.532   5.749
  549    HB3  ALA  72           HB3      ALA  72  67.819   0.995   5.326
  550    H1U  RCY  73           H1U      RCY  73  71.691  -0.969   5.195
  551    H1S  RCY  73           H1S      RCY  73  69.081  -4.011   4.797
  552    HB1  RCY  73           HB1      RCY  73  69.432  -3.978   2.120
  553    HB2  RCY  73           HB2      RCY  73  68.366  -5.238   1.504
  554    HA   RCY  73           HA       RCY  73  66.636  -4.061   2.357
  555    HN1  RCY  73           HN1      RCY  73  68.765  -2.292   3.299
  556    H    ASN  74           HN       ASN  74  67.270  -2.942   5.340
  557    HA   ASN  74           HA       ASN  74  66.857  -3.740   7.509
  558    HB2  ASN  74           HB2      ASN  74  65.033  -5.319   5.730
  559    HB3  ASN  74           HB1      ASN  74  65.202  -5.840   7.406
  560   HD21  ASN  74          HD21      ASN  74  63.963  -3.282   5.323
  561   HD22  ASN  74          HD22      ASN  74  63.181  -2.408   6.550
  562    H    HIS  75           HN       HIS  75  67.052  -5.835   8.888
  563    HA   HIS  75           HA       HIS  75  68.655  -7.399   9.631
  564    HD1  HIS  75           HD1      HIS  75  69.979  -9.090   6.026
  565    HD2  HIS  75           HD2      HIS  75  65.975  -7.930   5.885
  566    HE1  HIS  75           HE1      HIS  75  69.403  -8.805   3.577
  567    HE2  HIS  75           HE2      HIS  75  66.968  -8.099   3.477
  568    HB2  HIS  75           HB2      HIS  75  68.650  -9.445   8.286
  569    HB3  HIS  75           HB1      HIS  75  67.020  -8.777   8.361
  570    H1U  RCY  76           H1U      RCY  76  75.455   1.970   5.140
  571    H1S  RCY  76           H1S      RCY  76  72.735  -2.023   4.555
  572    HB1  RCY  76           HB1      RCY  76  71.225  -3.398   7.238
  573    HB2  RCY  76           HB2      RCY  76  70.984  -4.093   5.635
  574    HA   RCY  76           HA       RCY  76  71.876  -6.224   6.354
  575    HN1  RCY  76           HN1      RCY  76  69.637  -5.101   7.838
  576    H    GLU  77           HN       GLU  77  71.423  -4.746   9.544
  577    HA   GLU  77           HA       GLU  77  74.101  -4.466  10.348
  578    HB2  GLU  77           HB2      GLU  77  71.868  -5.517  12.111
  579    HB3  GLU  77           HB1      GLU  77  73.303  -4.629  12.625
  580    HG2  GLU  77           HG2      GLU  77  71.093  -3.550  10.850
  581    HG3  GLU  77           HG1      GLU  77  71.356  -3.129  12.543
  582    H    LEU  78           HN       LEU  78  74.895  -6.108  12.297
  583    HA   LEU  78           HA       LEU  78  76.051  -8.154  12.524
  584    HG   LEU  78           HG       LEU  78  75.492 -10.745  11.973
  585    HB2  LEU  78           HB2      LEU  78  73.701  -8.696  13.270
  586    HB3  LEU  78           HB1      LEU  78  73.370  -9.263  11.635
  587   HD11  LEU  78          HD11      LEU  78  74.773  -9.930  14.797
  588   HD12  LEU  78          HD12      LEU  78  76.348  -9.832  14.010
  589   HD13  LEU  78          HD13      LEU  78  75.671 -11.404  14.436
  590   HD21  LEU  78          HD21      LEU  78  73.199 -11.626  11.786
  591   HD22  LEU  78          HD22      LEU  78  72.918 -11.279  13.493
  592   HD23  LEU  78          HD23      LEU  78  74.096 -12.506  13.024
  593    H    HIS  79           HN       HIS  79  77.093  -7.286  10.367
  594    HA   HIS  79           HA       HIS  79  76.649  -9.343   8.234
  595    HD1  HIS  79           HD1      HIS  79  76.929  -6.765   4.836
  596    HD2  HIS  79           HD2      HIS  79  74.502  -8.944   7.436
  597    HE1  HIS  79           HE1      HIS  79  75.028  -7.685   3.438
  598    HE2  HIS  79           HE2      HIS  79  73.543  -9.013   5.008
  599    HB2  HIS  79           HB2      HIS  79  76.669  -6.454   8.110
  600    HB3  HIS  79           HB1      HIS  79  77.991  -7.090   7.134
  601    H    GLU  80           HN       GLU  80  78.300 -10.791   8.483
  602    HA   GLU  80           HA       GLU  80  80.824 -10.258   9.670
  603    HB2  GLU  80           HB2      GLU  80  79.623 -12.416   8.048
  604    HB3  GLU  80           HB1      GLU  80  81.369 -12.276   7.857
  605    HG2  GLU  80           HG2      GLU  80  80.050 -12.314  10.577
  606    HG3  GLU  80           HG1      GLU  80  80.558 -13.792   9.758
  607    H    LEU  81           HN       LEU  81  79.591  -9.613   6.484
  608    HA   LEU  81           HA       LEU  81  82.252  -9.094   5.338
  609    HG   LEU  81           HG       LEU  81  79.785 -10.611   2.966
  610    HB2  LEU  81           HB2      LEU  81  79.574  -8.356   4.135
  611    HB3  LEU  81           HB1      LEU  81  81.098  -8.629   3.297
  612   HD11  LEU  81          HD11      LEU  81  82.225 -10.840   3.735
  613   HD12  LEU  81          HD12      LEU  81  81.215 -12.277   3.885
  614   HD13  LEU  81          HD13      LEU  81  81.570 -11.296   5.307
  615   HD21  LEU  81          HD21      LEU  81  78.501  -9.906   5.268
  616   HD22  LEU  81          HD22      LEU  81  79.481 -11.255   5.842
  617   HD23  LEU  81          HD23      LEU  81  78.349 -11.491   4.511
  618    H    ALA  82           HN       ALA  82  80.635  -7.554   7.604
  619    HA   ALA  82           HA       ALA  82  80.106  -4.923   6.855
  620    HB1  ALA  82           HB1      ALA  82  81.385  -6.031   9.359
  621    HB2  ALA  82           HB2      ALA  82  79.706  -5.544   9.123
  622    HB3  ALA  82           HB3      ALA  82  80.978  -4.324   9.186
  623    H    GLN  83           HN       GLN  83  81.451  -4.027   5.301
  624    HA   GLN  83           HA       GLN  83  84.151  -4.167   4.881
  625    HB2  GLN  83           HB2      GLN  83  82.245  -1.843   4.744
  626    HB3  GLN  83           HB1      GLN  83  83.960  -1.558   4.453
  627    HG2  GLN  83           HG2      GLN  83  82.568  -2.092   2.383
  628    HG3  GLN  83           HG1      GLN  83  84.000  -3.096   2.617
  629   HE21  GLN  83          HE21      GLN  83  80.613  -3.178   3.894
  630   HE22  GLN  83          HE22      GLN  83  80.375  -4.823   3.552
  631    H    TYR  84           HN       TYR  84  86.005  -3.624   5.997
  632    HA   TYR  84           HA       TYR  84  86.138  -3.260   8.720
  633    HD1  TYR  84           HD2      TYR  84  87.447  -3.213   4.935
  634    HD2  TYR  84           HD1      TYR  84  89.045  -4.770   8.606
  635    HE1  TYR  84           HE2      TYR  84  88.093  -5.303   3.767
  636    HE2  TYR  84           HE1      TYR  84  89.691  -6.860   7.438
  637    HH   TYR  84           HH       TYR  84  88.496  -7.893   4.726
  638    HB2  TYR  84           HB2      TYR  84  88.026  -1.733   6.929
  639    HB3  TYR  84           HB1      TYR  84  88.369  -2.495   8.479
  640    H    GLY  85           HN       GLY  85  84.393  -1.850   9.390
  641    HA2  GLY  85           HA2      GLY  85  84.074   0.311  10.446
  642    HA3  GLY  85           HA1      GLY  85  85.159   1.023   9.252
  643    H    ILE  86           HN       ILE  86  82.458  -1.159   8.582
  644    HA   ILE  86           HA       ILE  86  80.791  -0.875   6.915
  645    HB   ILE  86           HB       ILE  86  79.118   0.814   7.680
  646   HG12  ILE  86          HG12      ILE  86  81.155   1.458   9.829
  647   HG13  ILE  86          HG11      ILE  86  80.901   2.471   8.408
  648   HG21  ILE  86          HG21      ILE  86  80.285  -0.640  10.058
  649   HG22  ILE  86          HG22      ILE  86  79.479  -1.500   8.745
  650   HG23  ILE  86          HG23      ILE  86  78.588  -0.316   9.703
  651   HD11  ILE  86          HD11      ILE  86  79.569   3.323  10.279
  652   HD12  ILE  86          HD12      ILE  86  78.809   1.745  10.481
  653   HD13  ILE  86          HD13      ILE  86  78.502   2.691   9.025
  654    H1U  RCY  87           H1U      RCY  87  74.115   2.812   2.454
  655    H1S  RCY  87           H1S      RCY  87  77.473   5.156   2.889
  656    HB1  RCY  87           HB1      RCY  87  79.142   4.227   5.391
  657    HB2  RCY  87           HB2      RCY  87  78.643   2.901   4.344
  658    HA   RCY  87           HA       RCY  87  81.098   2.400   3.973
  659    HN1  RCY  87           HN1      RCY  87  79.555   1.723   6.263
  Start of MODEL   91
    1    HA   MET   1           HA       MET   1  56.777  -2.183  16.652
    2    HB2  MET   1           HB2      MET   1  57.706  -4.416  17.390
    3    HB3  MET   1           HB1      MET   1  56.480  -5.187  16.383
    4    HG2  MET   1           HG2      MET   1  57.370  -4.179  14.388
    5    HG3  MET   1           HG1      MET   1  58.446  -3.143  15.324
    6    HE1  MET   1           HE1      MET   1  61.358  -5.066  14.170
    7    HE2  MET   1           HE2      MET   1  60.913  -3.683  15.167
    8    HE3  MET   1           HE3      MET   1  60.144  -3.914  13.598
    9    H    ASN   2           HN       ASN   2  53.807  -4.021  16.644
   10    HA   ASN   2           HA       ASN   2  52.082  -4.155  15.061
   11    HB2  ASN   2           HB2      ASN   2  53.306  -1.694  13.804
   12    HB3  ASN   2           HB1      ASN   2  51.607  -2.165  13.851
   13   HD21  ASN   2          HD21      ASN   2  50.480  -1.988  15.966
   14   HD22  ASN   2          HD22      ASN   2  51.085  -0.954  17.168
   15    H    LEU   3           HN       LEU   3  52.606  -2.941  12.274
   16    HA   LEU   3           HA       LEU   3  53.758  -5.406  11.144
   17    HG   LEU   3           HG       LEU   3  51.781  -5.931   9.983
   18    HB2  LEU   3           HB2      LEU   3  52.424  -2.965   9.964
   19    HB3  LEU   3           HB1      LEU   3  53.206  -4.175   8.947
   20   HD11  LEU   3          HD11      LEU   3  49.725  -4.948  11.235
   21   HD12  LEU   3          HD12      LEU   3  50.746  -3.532  11.487
   22   HD13  LEU   3          HD13      LEU   3  51.242  -5.101  12.122
   23   HD21  LEU   3          HD21      LEU   3  50.447  -3.544   8.686
   24   HD22  LEU   3          HD22      LEU   3  49.579  -5.044   9.011
   25   HD23  LEU   3          HD23      LEU   3  50.965  -5.046   7.920
   26    H    GLU   4           HN       GLU   4  55.384  -5.106   9.290
   27    HA   GLU   4           HA       GLU   4  57.642  -3.570  10.311
   28    HB2  GLU   4           HB2      GLU   4  58.832  -4.491   8.321
   29    HB3  GLU   4           HB1      GLU   4  58.033  -5.747   9.264
   30    HG2  GLU   4           HG2      GLU   4  57.429  -6.260   7.041
   31    HG3  GLU   4           HG1      GLU   4  56.027  -5.385   7.658
   32    HA   PRO   5           HA       PRO   5  57.267   0.400   8.415
   33    HB2  PRO   5           HB2      PRO   5  59.774  -0.422   6.973
   34    HB3  PRO   5           HB1      PRO   5  59.392   1.116   7.773
   35    HG2  PRO   5           HG2      PRO   5  60.901  -0.785   8.933
   36    HG3  PRO   5           HG1      PRO   5  59.852   0.302   9.856
   37    HD2  PRO   5           HD2      PRO   5  59.572  -2.586   9.424
   38    HD3  PRO   5           HD1      PRO   5  58.718  -1.541  10.580
   39    HA   PRO   6           HA       PRO   6  55.711  -1.271   4.430
   40    HB2  PRO   6           HB2      PRO   6  53.170  -0.407   4.632
   41    HB3  PRO   6           HB1      PRO   6  53.739  -1.820   5.541
   42    HG2  PRO   6           HG2      PRO   6  53.203   0.934   6.484
   43    HG3  PRO   6           HG1      PRO   6  53.020  -0.609   7.331
   44    HD2  PRO   6           HD2      PRO   6  55.198   1.193   7.572
   45    HD3  PRO   6           HD1      PRO   6  55.121  -0.464   8.208
   46    H    LYS   7           HN       LYS   7  55.991  -0.128   2.542
   47    HA   LYS   7           HA       LYS   7  55.793   2.849   2.659
   48    HB2  LYS   7           HB2      LYS   7  57.299   0.933   0.877
   49    HB3  LYS   7           HB1      LYS   7  57.021   2.601   0.382
   50    HG2  LYS   7           HG2      LYS   7  59.057   2.823   1.482
   51    HG3  LYS   7           HG1      LYS   7  57.938   3.137   2.810
   52    HD2  LYS   7           HD2      LYS   7  59.307   1.538   3.788
   53    HD3  LYS   7           HD1      LYS   7  58.053   0.506   3.099
   54    HE2  LYS   7           HE2      LYS   7  60.310  -0.346   2.554
   55    HE3  LYS   7           HE1      LYS   7  59.441   0.138   1.098
   56    HZ1  LYS   7           HZ1      LYS   7  61.837   0.920   1.373
   57    HZ2  LYS   7           HZ2      LYS   7  61.223   2.018   2.515
   58    HZ3  LYS   7           HZ3      LYS   7  60.684   2.073   0.904
   59    H    ALA   8           HN       ALA   8  55.732   1.359  -0.431
   60    HA   ALA   8           HA       ALA   8  52.791   1.356  -0.615
   61    HB1  ALA   8           HB1      ALA   8  52.842   2.967  -2.547
   62    HB2  ALA   8           HB2      ALA   8  54.524   3.316  -2.148
   63    HB3  ALA   8           HB3      ALA   8  53.246   3.707  -0.998
   64    H    GLU   9           HN       GLU   9  54.567   1.993  -3.496
   65    HA   GLU   9           HA       GLU   9  54.932   0.637  -5.379
   66    HB2  GLU   9           HB2      GLU   9  55.640  -1.512  -3.374
   67    HB3  GLU   9           HB1      GLU   9  56.299  -1.275  -4.993
   68    HG2  GLU   9           HG2      GLU   9  57.150   0.989  -4.159
   69    HG3  GLU   9           HG1      GLU   9  56.762   0.422  -2.534
   70    H1U  RCY  10           H1U      RCY  10  58.299  -3.805  -8.034
   71    H1S  RCY  10           H1S      RCY  10  53.806  -2.994  -8.314
   72    HB1  RCY  10           HB1      RCY  10  50.788  -1.657  -7.213
   73    HB2  RCY  10           HB2      RCY  10  51.603  -3.005  -8.004
   74    HA   RCY  10           HA       RCY  10  51.656  -2.440  -5.272
   75    HN1  RCY  10           HN1      RCY  10  54.306  -1.574  -6.368
   76    H    ARG  11           HN       ARG  11  54.566  -3.475  -5.153
   77    HA   ARG  11           HA       ARG  11  53.838  -6.299  -5.576
   78    HE   ARG  11           HE       ARG  11  58.010  -2.835  -8.013
   79    HB2  ARG  11           HB2      ARG  11  55.931  -6.722  -6.898
   80    HB3  ARG  11           HB1      ARG  11  54.750  -5.738  -7.763
   81    HG2  ARG  11           HG2      ARG  11  55.961  -3.690  -7.017
   82    HG3  ARG  11           HG1      ARG  11  57.180  -4.718  -6.262
   83    HD2  ARG  11           HD2      ARG  11  57.879  -5.606  -8.358
   84    HD3  ARG  11           HD1      ARG  11  56.457  -4.970  -9.186
   85   HH11  ARG  11          HH21      ARG  11  57.822  -5.099 -10.606
   86   HH12  ARG  11          HH22      ARG  11  58.717  -4.111 -11.711
   87   HH21  ARG  11          HH11      ARG  11  59.180  -1.530  -9.441
   88   HH22  ARG  11          HH12      ARG  11  59.486  -2.090 -11.051
   89    H    SER  12           HN       SER  12  54.374  -4.725  -3.232
   90    HA   SER  12           HA       SER  12  56.530  -6.354  -2.086
   91    HG   SER  12           HG       SER  12  58.771  -3.943  -1.067
   92    HB2  SER  12           HB2      SER  12  57.856  -4.518  -2.949
   93    HB3  SER  12           HB1      SER  12  56.738  -3.335  -2.275
   94    H    ALA  13           HN       ALA  13  56.556  -3.917  -0.047
   95    HA   ALA  13           HA       ALA  13  55.525  -3.560   2.030
   96    HB1  ALA  13           HB1      ALA  13  53.159  -3.867   0.172
   97    HB2  ALA  13           HB2      ALA  13  53.854  -2.377   0.808
   98    HB3  ALA  13           HB3      ALA  13  52.969  -3.464   1.878
   99    H    THR  14           HN       THR  14  55.658  -6.504   0.652
  100    HA   THR  14           HA       THR  14  55.139  -7.924   3.076
  101    HB   THR  14           HB       THR  14  53.122  -9.003   1.275
  102    HG1  THR  14           HG1      THR  14  52.918  -6.826   0.654
  103   HG21  THR  14          HG21      THR  14  51.784  -8.982   3.273
  104   HG22  THR  14          HG22      THR  14  52.811  -7.755   4.015
  105   HG23  THR  14          HG23      THR  14  53.431  -9.387   3.759
  106    H    ARG  15           HN       ARG  15  54.625  -8.535  -0.417
  107    HA   ARG  15           HA       ARG  15  56.066 -11.057  -0.277
  108    HE   ARG  15           HE       ARG  15  58.580 -10.234  -4.087
  109    HB2  ARG  15           HB2      ARG  15  54.751 -11.338  -2.102
  110    HB3  ARG  15           HB1      ARG  15  54.413  -9.615  -2.184
  111    HG2  ARG  15           HG2      ARG  15  55.516 -10.084  -4.237
  112    HG3  ARG  15           HG1      ARG  15  56.777  -9.387  -3.218
  113    HD2  ARG  15           HD2      ARG  15  57.068 -11.971  -2.531
  114    HD3  ARG  15           HD1      ARG  15  56.439 -12.190  -4.164
  115   HH11  ARG  15          HH21      ARG  15  57.766 -13.584  -4.100
  116   HH12  ARG  15          HH22      ARG  15  59.259 -14.080  -4.824
  117   HH21  ARG  15          HH11      ARG  15  60.534 -10.863  -5.033
  118   HH22  ARG  15          HH12      ARG  15  60.826 -12.540  -5.352
  119    H    VAL  16           HN       VAL  16  57.128  -7.982  -0.052
  120    HA   VAL  16           HA       VAL  16  59.178  -7.452  -1.793
  121    HB   VAL  16           HB       VAL  16  58.598  -6.195   0.341
  122   HG11  VAL  16          HG11      VAL  16  60.661  -7.967   1.641
  123   HG12  VAL  16          HG12      VAL  16  58.948  -8.381   1.708
  124   HG13  VAL  16          HG13      VAL  16  59.517  -6.864   2.404
  125   HG21  VAL  16          HG21      VAL  16  61.155  -5.696   0.771
  126   HG22  VAL  16          HG22      VAL  16  60.429  -5.280  -0.782
  127   HG23  VAL  16          HG23      VAL  16  61.389  -6.751  -0.623
  128    H    MET  17           HN       MET  17  60.868  -8.592  -2.564
  129    HA   MET  17           HA       MET  17  62.230 -10.508  -2.853
  130    HB2  MET  17           HB2      MET  17  64.046 -10.543  -1.195
  131    HB3  MET  17           HB1      MET  17  63.652  -8.888  -1.653
  132    HG2  MET  17           HG2      MET  17  62.429  -8.518   0.371
  133    HG3  MET  17           HG1      MET  17  62.441 -10.236   0.771
  134    HE1  MET  17           HE1      MET  17  64.559  -8.222   3.393
  135    HE2  MET  17           HE2      MET  17  62.923  -8.426   2.772
  136    HE3  MET  17           HE3      MET  17  63.929  -7.111   2.170
  137    H    GLY  18           HN       GLY  18  63.319 -12.017  -0.515
  138    HA2  GLY  18           HA2      GLY  18  62.193 -13.436   1.250
  139    HA3  GLY  18           HA1      GLY  18  60.881 -13.648   0.088
  140    H    GLY  19           HN       GLY  19  60.969 -15.658  -0.795
  141    HA2  GLY  19           HA2      GLY  19  63.338 -17.287  -0.780
  142    HA3  GLY  19           HA1      GLY  19  61.866 -17.641  -1.689
  143    HA   PRO  20           HA       PRO  20  63.872 -16.963  -5.570
  144    HB2  PRO  20           HB2      PRO  20  61.605 -15.085  -6.129
  145    HB3  PRO  20           HB1      PRO  20  62.238 -16.414  -7.120
  146    HG2  PRO  20           HG2      PRO  20  59.979 -16.642  -5.690
  147    HG3  PRO  20           HG1      PRO  20  61.069 -18.008  -5.974
  148    HD2  PRO  20           HD2      PRO  20  60.566 -16.515  -3.468
  149    HD3  PRO  20           HD1      PRO  20  61.231 -18.147  -3.694
  150    H1U  RCY  21           H1U      RCY  21  66.320  -6.527  -5.371
  151    H1S  RCY  21           H1S      RCY  21  67.610 -10.545  -5.006
  152    HB1  RCY  21           HB1      RCY  21  67.904 -13.476  -5.483
  153    HB2  RCY  21           HB2      RCY  21  66.976 -14.517  -4.404
  154    HA   RCY  21           HA       RCY  21  65.132 -12.638  -5.437
  155    HN1  RCY  21           HN1      RCY  21  65.357 -15.456  -6.381
  156    H    THR  22           HN       THR  22  64.694 -11.834  -7.487
  157    HA   THR  22           HA       THR  22  66.051 -12.722  -9.869
  158    HB   THR  22           HB       THR  22  64.590 -11.334 -10.937
  159    HG1  THR  22           HG1      THR  22  65.718  -9.490  -9.192
  160   HG21  THR  22          HG21      THR  22  63.319 -12.263  -8.923
  161   HG22  THR  22          HG22      THR  22  62.618 -10.839  -9.693
  162   HG23  THR  22          HG23      THR  22  63.523 -10.673  -8.188
  163    HA   PRO  23           HA       PRO  23  69.808 -10.412  -9.560
  164    HB2  PRO  23           HB2      PRO  23  70.336  -9.841 -12.183
  165    HB3  PRO  23           HB1      PRO  23  70.495 -11.470 -11.496
  166    HG2  PRO  23           HG2      PRO  23  68.292 -10.320 -13.132
  167    HG3  PRO  23           HG1      PRO  23  69.011 -11.939 -13.181
  168    HD2  PRO  23           HD2      PRO  23  66.623 -11.395 -11.940
  169    HD3  PRO  23           HD1      PRO  23  67.699 -12.720 -11.445
  170    H    ARG  24           HN       ARG  24  70.832  -8.241 -10.197
  171    HA   ARG  24           HA       ARG  24  68.831  -6.154 -10.889
  172    HE   ARG  24           HE       ARG  24  68.272  -8.196  -5.975
  173    HB2  ARG  24           HB2      ARG  24  70.667  -5.697  -8.548
  174    HB3  ARG  24           HB1      ARG  24  69.144  -4.897  -8.939
  175    HG2  ARG  24           HG2      ARG  24  67.982  -7.101  -8.521
  176    HG3  ARG  24           HG1      ARG  24  69.517  -7.721  -7.912
  177    HD2  ARG  24           HD2      ARG  24  69.530  -5.707  -6.329
  178    HD3  ARG  24           HD1      ARG  24  67.844  -5.469  -6.787
  179   HH11  ARG  24          HH21      ARG  24  68.016  -4.950  -4.840
  180   HH12  ARG  24          HH22      ARG  24  67.416  -5.402  -3.279
  181   HH21  ARG  24          HH11      ARG  24  67.490  -8.805  -3.943
  182   HH22  ARG  24          HH12      ARG  24  67.118  -7.584  -2.771
  183    H    LYS  25           HN       LYS  25  69.726  -4.831 -12.387
  184    HA   LYS  25           HA       LYS  25  72.519  -5.064 -13.109
  185    HB2  LYS  25           HB2      LYS  25  70.759  -2.789 -13.997
  186    HB3  LYS  25           HB1      LYS  25  71.997  -3.655 -14.907
  187    HG2  LYS  25           HG2      LYS  25  70.514  -5.715 -14.736
  188    HG3  LYS  25           HG1      LYS  25  69.248  -4.647 -14.129
  189    HD2  LYS  25           HD2      LYS  25  68.767  -4.580 -16.392
  190    HD3  LYS  25           HD1      LYS  25  69.894  -3.227 -16.283
  191    HE2  LYS  25           HE2      LYS  25  70.478  -4.723 -18.163
  192    HE3  LYS  25           HE1      LYS  25  71.750  -4.707 -16.941
  193    HZ1  LYS  25           HZ1      LYS  25  71.039  -6.771 -16.098
  194    HZ2  LYS  25           HZ2      LYS  25  71.072  -6.954 -17.787
  195    HZ3  LYS  25           HZ3      LYS  25  69.592  -6.735 -16.983
  196    H    GLY  26           HN       GLY  26  72.319  -1.934 -13.570
  197    HA2  GLY  26           HA2      GLY  26  72.504  -0.633 -11.065
  198    HA3  GLY  26           HA1      GLY  26  74.120  -1.221 -11.461
  199    HA   PRO  27           HA       PRO  27  72.452   2.101 -14.743
  200    HB2  PRO  27           HB2      PRO  27  71.494   3.976 -12.630
  201    HB3  PRO  27           HB1      PRO  27  70.791   3.613 -14.219
  202    HG2  PRO  27           HG2      PRO  27  69.701   2.699 -11.971
  203    HG3  PRO  27           HG1      PRO  27  69.714   1.731 -13.456
  204    HD2  PRO  27           HD2      PRO  27  71.418   1.443 -11.005
  205    HD3  PRO  27           HD1      PRO  27  70.757   0.185 -12.074
  206    HA   PRO  28           HA       PRO  28  76.018   4.655 -14.214
  207    HB2  PRO  28           HB2      PRO  28  74.666   7.206 -14.795
  208    HB3  PRO  28           HB1      PRO  28  75.858   6.322 -15.764
  209    HG2  PRO  28           HG2      PRO  28  73.263   6.532 -16.460
  210    HG3  PRO  28           HG1      PRO  28  74.265   5.134 -16.879
  211    HD2  PRO  28           HD2      PRO  28  72.186   5.386 -14.729
  212    HD3  PRO  28           HD1      PRO  28  72.578   3.991 -15.762
  213    H    LYS  29           HN       LYS  29  77.158   6.021 -12.771
  214    HA   LYS  29           HA       LYS  29  75.656   7.611 -10.792
  215    HB2  LYS  29           HB2      LYS  29  76.845   6.481  -8.886
  216    HB3  LYS  29           HB1      LYS  29  75.664   5.449  -9.688
  217    HG2  LYS  29           HG2      LYS  29  78.520   5.424 -10.624
  218    HG3  LYS  29           HG1      LYS  29  78.071   4.510  -9.184
  219    HD2  LYS  29           HD2      LYS  29  77.036   2.918 -10.405
  220    HD3  LYS  29           HD1      LYS  29  76.168   4.119 -11.362
  221    HE2  LYS  29           HE2      LYS  29  77.764   2.683 -12.696
  222    HE3  LYS  29           HE1      LYS  29  78.056   4.417 -12.835
  223    HZ1  LYS  29           HZ1      LYS  29  80.002   2.785 -12.326
  224    HZ2  LYS  29           HZ2      LYS  29  79.434   2.908 -10.730
  225    HZ3  LYS  29           HZ3      LYS  29  79.935   4.300 -11.566
  226    H1U  RCY  30           H1U      RCY  30  77.862  13.924  -2.756
  227    H1S  RCY  30           H1S      RCY  30  80.011  11.840  -6.171
  228    HB1  RCY  30           HB1      RCY  30  78.119  10.975  -9.110
  229    HB2  RCY  30           HB2      RCY  30  79.844  11.329  -9.201
  230    HA   RCY  30           HA       RCY  30  79.480   9.765 -10.942
  231    HN1  RCY  30           HN1      RCY  30  77.489   8.526  -9.160
  232    H    LYS  31           HN       LYS  31  79.332   7.127  -8.766
  233    HA   LYS  31           HA       LYS  31  81.895   7.059  -7.646
  234    HB2  LYS  31           HB2      LYS  31  79.739   5.348  -7.735
  235    HB3  LYS  31           HB1      LYS  31  80.930   4.456  -8.677
  236    HG2  LYS  31           HG2      LYS  31  81.361   5.580  -5.891
  237    HG3  LYS  31           HG1      LYS  31  81.112   3.879  -6.289
  238    HD2  LYS  31           HD2      LYS  31  83.399   5.585  -7.320
  239    HD3  LYS  31           HD1      LYS  31  83.521   4.421  -5.999
  240    HE2  LYS  31           HE2      LYS  31  83.134   3.924  -8.931
  241    HE3  LYS  31           HE1      LYS  31  84.212   3.114  -7.795
  242    HZ1  LYS  31           HZ1      LYS  31  82.092   2.293  -6.697
  243    HZ2  LYS  31           HZ2      LYS  31  82.506   1.596  -8.190
  244    HZ3  LYS  31           HZ3      LYS  31  81.291   2.782  -8.111
  245    H    GLN  32           HN       GLN  32  83.897   6.916  -8.556
  246    HA   GLN  32           HA       GLN  32  84.143   5.735 -11.292
  247    HB2  GLN  32           HB2      GLN  32  85.961   7.533 -11.646
  248    HB3  GLN  32           HB1      GLN  32  84.280   8.059 -11.746
  249    HG2  GLN  32           HG2      GLN  32  84.369   9.196  -9.733
  250    HG3  GLN  32           HG1      GLN  32  85.613   8.136  -9.069
  251   HE21  GLN  32          HE21      GLN  32  85.416  11.231  -9.587
  252   HE22  GLN  32          HE22      GLN  32  86.899  11.583 -10.333
  253    H    ARG  33           HN       ARG  33  84.920   3.830 -10.203
  254    HA   ARG  33           HA       ARG  33  86.487   2.488  -9.077
  255    HE   ARG  33           HE       ARG  33  88.778   3.200 -12.943
  256    HB2  ARG  33           HB2      ARG  33  88.740   2.671 -10.019
  257    HB3  ARG  33           HB1      ARG  33  87.534   2.854 -11.290
  258    HG2  ARG  33           HG2      ARG  33  87.815   5.234 -11.345
  259    HG3  ARG  33           HG1      ARG  33  88.761   5.221  -9.856
  260    HD2  ARG  33           HD2      ARG  33  90.279   5.461 -11.743
  261    HD3  ARG  33           HD1      ARG  33  90.503   3.863 -11.031
  262   HH11  ARG  33          HH21      ARG  33  91.328   5.520 -13.000
  263   HH12  ARG  33          HH22      ARG  33  91.617   5.358 -14.700
  264   HH21  ARG  33          HH11      ARG  33  89.142   2.974 -15.163
  265   HH22  ARG  33          HH12      ARG  33  90.380   3.916 -15.924
  266    H    GLN  34           HN       GLN  34  88.762   2.659  -7.857
  267    HA   GLN  34           HA       GLN  34  89.718   3.350  -5.829
  268    HB2  GLN  34           HB2      GLN  34  89.215   6.008  -7.194
  269    HB3  GLN  34           HB1      GLN  34  90.188   5.822  -5.734
  270    HG2  GLN  34           HG2      GLN  34  91.698   4.283  -6.917
  271    HG3  GLN  34           HG1      GLN  34  90.718   4.431  -8.377
  272   HE21  GLN  34          HE21      GLN  34  93.379   5.784  -6.709
  273   HE22  GLN  34          HE22      GLN  34  93.509   7.221  -7.602
  274    H    THR  35           HN       THR  35  89.316   5.006  -3.911
  275    HA   THR  35           HA       THR  35  86.484   5.700  -3.525
  276    HB   THR  35           HB       THR  35  86.536   4.337  -1.306
  277    HG1  THR  35           HG1      THR  35  88.898   3.804  -2.142
  278   HG21  THR  35          HG21      THR  35  86.436   2.731  -3.866
  279   HG22  THR  35          HG22      THR  35  85.170   3.869  -3.404
  280   HG23  THR  35          HG23      THR  35  85.511   2.468  -2.388
  281    H    ARG  36           HN       ARG  36  89.695   6.297  -3.115
  282    HA   ARG  36           HA       ARG  36  90.885   7.865  -1.847
  283    HE   ARG  36           HE       ARG  36  88.657  10.136  -5.383
  284    HB2  ARG  36           HB2      ARG  36  88.219   8.909  -0.884
  285    HB3  ARG  36           HB1      ARG  36  89.722   9.799  -1.120
  286    HG2  ARG  36           HG2      ARG  36  87.963   8.603  -3.279
  287    HG3  ARG  36           HG1      ARG  36  88.243  10.317  -2.971
  288    HD2  ARG  36           HD2      ARG  36  90.727   9.826  -3.372
  289    HD3  ARG  36           HD1      ARG  36  90.204   8.271  -4.021
  290   HH11  ARG  36          HH21      ARG  36  92.008   9.583  -4.787
  291   HH12  ARG  36          HH22      ARG  36  92.525  10.266  -6.292
  292   HH21  ARG  36          HH11      ARG  36  89.313  11.032  -7.352
  293   HH22  ARG  36          HH12      ARG  36  90.999  11.087  -7.744
  294    H    GLN  37           HN       GLN  37  88.889   5.544  -0.481
  295    HA   GLN  37           HA       GLN  37  90.423   5.472   1.962
  296    HB2  GLN  37           HB2      GLN  37  88.789   7.424   2.320
  297    HB3  GLN  37           HB1      GLN  37  87.517   6.203   2.356
  298    HG2  GLN  37           HG2      GLN  37  88.701   5.036   4.192
  299    HG3  GLN  37           HG1      GLN  37  89.944   6.288   4.174
  300   HE21  GLN  37          HE21      GLN  37  89.412   8.376   5.076
  301   HE22  GLN  37          HE22      GLN  37  87.969   8.653   5.927
  302    H1U  RCY  38           H1U      RCY  38  85.292   6.306   5.679
  303    H1S  RCY  38           H1S      RCY  38  87.443   3.197   3.099
  304    HB1  RCY  38           HB1      RCY  38  87.399   0.904  -0.132
  305    HB2  RCY  38           HB2      RCY  38  87.321   2.652   0.085
  306    HA   RCY  38           HA       RCY  38  89.068   1.322   2.040
  307    HN1  RCY  38           HN1      RCY  38  90.367   3.344   0.608
  308    H    LYS  39           HN       LYS  39  91.546   1.407   1.029
  309    HA   LYS  39           HA       LYS  39  91.586  -0.074  -1.544
  310    HB2  LYS  39           HB2      LYS  39  93.780   1.073   0.204
  311    HB3  LYS  39           HB1      LYS  39  94.093   0.127  -1.251
  312    HG2  LYS  39           HG2      LYS  39  92.649   1.767  -2.521
  313    HG3  LYS  39           HG1      LYS  39  92.615   2.764  -1.066
  314    HD2  LYS  39           HD2      LYS  39  95.038   2.983  -1.101
  315    HD3  LYS  39           HD1      LYS  39  95.152   1.871  -2.466
  316    HE2  LYS  39           HE2      LYS  39  93.638   3.509  -3.730
  317    HE3  LYS  39           HE1      LYS  39  93.963   4.650  -2.425
  318    HZ1  LYS  39           HZ1      LYS  39  96.422   3.927  -2.938
  319    HZ2  LYS  39           HZ2      LYS  39  95.659   5.160  -3.824
  320    HZ3  LYS  39           HZ3      LYS  39  95.770   3.592  -4.468
  321    H    SER  40           HN       SER  40  93.410  -0.504   1.508
  322    HA   SER  40           HA       SER  40  92.381  -3.164   1.974
  323    HG   SER  40           HG       SER  40  93.879  -5.386   0.901
  324    HB2  SER  40           HB2      SER  40  93.854  -3.533  -0.047
  325    HB3  SER  40           HB1      SER  40  95.224  -3.016   0.932
  326    H    LYS  41           HN       LYS  41  93.046  -0.625   3.374
  327    HA   LYS  41           HA       LYS  41  95.340  -0.743   4.972
  328    HB2  LYS  41           HB2      LYS  41  92.935   0.010   6.499
  329    HB3  LYS  41           HB1      LYS  41  94.358   0.974   6.104
  330    HG2  LYS  41           HG2      LYS  41  93.457   1.201   3.760
  331    HG3  LYS  41           HG1      LYS  41  91.974   0.425   4.317
  332    HD2  LYS  41           HD2      LYS  41  91.569   2.198   5.914
  333    HD3  LYS  41           HD1      LYS  41  93.139   2.925   5.571
  334    HE2  LYS  41           HE2      LYS  41  91.073   2.532   3.405
  335    HE3  LYS  41           HE1      LYS  41  91.090   3.977   4.416
  336    HZ1  LYS  41           HZ1      LYS  41  92.395   3.996   2.225
  337    HZ2  LYS  41           HZ2      LYS  41  93.543   3.063   3.061
  338    HZ3  LYS  41           HZ3      LYS  41  93.145   4.619   3.614
  339    HA   PRO  42           HA       PRO  42  94.881  -4.330   7.509
  340    HB2  PRO  42           HB2      PRO  42  96.007  -3.477   9.872
  341    HB3  PRO  42           HB1      PRO  42  96.950  -3.889   8.427
  342    HG2  PRO  42           HG2      PRO  42  96.151  -1.219   9.462
  343    HG3  PRO  42           HG1      PRO  42  97.671  -1.733   8.711
  344    HD2  PRO  42           HD2      PRO  42  95.750  -0.331   7.357
  345    HD3  PRO  42           HD1      PRO  42  96.853  -1.475   6.560
  346    HA   PRO  43           HA       PRO  43  91.217  -4.241   9.963
  347    HB2  PRO  43           HB2      PRO  43  92.064  -5.668  12.242
  348    HB3  PRO  43           HB1      PRO  43  91.400  -6.373  10.757
  349    HG2  PRO  43           HG2      PRO  43  94.217  -6.113  11.628
  350    HG3  PRO  43           HG1      PRO  43  93.437  -7.382  10.669
  351    HD2  PRO  43           HD2      PRO  43  95.047  -5.518   9.532
  352    HD3  PRO  43           HD1      PRO  43  93.639  -6.190   8.676
  353    H    LYS  44           HN       LYS  44  90.253  -3.110  11.722
  354    HA   LYS  44           HA       LYS  44  92.126  -1.573  13.476
  355    HB2  LYS  44           HB2      LYS  44  90.551  -0.516  11.388
  356    HB3  LYS  44           HB1      LYS  44  89.687  -0.101  12.866
  357    HG2  LYS  44           HG2      LYS  44  91.215   1.690  12.535
  358    HG3  LYS  44           HG1      LYS  44  91.963   0.685  13.776
  359    HD2  LYS  44           HD2      LYS  44  93.758   0.966  12.332
  360    HD3  LYS  44           HD1      LYS  44  93.056  -0.517  11.682
  361    HE2  LYS  44           HE2      LYS  44  93.507   1.054   9.857
  362    HE3  LYS  44           HE1      LYS  44  91.767   0.839  10.044
  363    HZ1  LYS  44           HZ1      LYS  44  91.655   3.034  10.226
  364    HZ2  LYS  44           HZ2      LYS  44  93.341   3.195  10.357
  365    HZ3  LYS  44           HZ3      LYS  44  92.404   2.888  11.741
  366    H    LYS  45           HN       LYS  45  90.605  -0.420  15.242
  367    HA   LYS  45           HA       LYS  45  89.246  -2.629  16.608
  368    HB2  LYS  45           HB2      LYS  45  88.842  -0.807  18.365
  369    HB3  LYS  45           HB1      LYS  45  90.527  -1.206  18.033
  370    HG2  LYS  45           HG2      LYS  45  89.308   0.930  16.355
  371    HG3  LYS  45           HG1      LYS  45  89.627   1.334  18.042
  372    HD2  LYS  45           HD2      LYS  45  91.764  -0.050  16.459
  373    HD3  LYS  45           HD1      LYS  45  91.508   1.679  16.217
  374    HE2  LYS  45           HE2      LYS  45  92.031   0.329  18.883
  375    HE3  LYS  45           HE1      LYS  45  93.199   1.283  17.968
  376    HZ1  LYS  45           HZ1      LYS  45  92.382   2.884  19.330
  377    HZ2  LYS  45           HZ2      LYS  45  90.853   2.158  19.475
  378    HZ3  LYS  45           HZ3      LYS  45  91.253   3.028  18.072
  379    H    GLY  46           HN       GLY  46  87.614  -2.718  14.751
  380    HA2  GLY  46           HA2      GLY  46  85.712  -0.622  14.355
  381    HA3  GLY  46           HA1      GLY  46  85.441  -2.320  13.962
  382    H    VAL  47           HN       VAL  47  84.962   0.170  16.358
  383    HA   VAL  47           HA       VAL  47  83.823  -1.670  18.337
  384    HB   VAL  47           HB       VAL  47  83.201   0.448  19.524
  385   HG11  VAL  47          HG11      VAL  47  86.030   0.063  18.528
  386   HG12  VAL  47          HG12      VAL  47  85.341  -0.458  20.066
  387   HG13  VAL  47          HG13      VAL  47  85.620   1.257  19.760
  388   HG21  VAL  47          HG21      VAL  47  82.845   1.806  17.469
  389   HG22  VAL  47          HG22      VAL  47  84.579   1.751  17.154
  390   HG23  VAL  47          HG23      VAL  47  83.969   2.582  18.585
  391    H    GLN  48           HN       GLN  48  81.523  -0.318  19.146
  392    HA   GLN  48           HA       GLN  48  79.643  -1.187  17.084
  393    HB2  GLN  48           HB2      GLN  48  79.333  -1.407  19.624
  394    HB3  GLN  48           HB1      GLN  48  78.956   0.315  19.615
  395    HG2  GLN  48           HG2      GLN  48  76.852  -0.783  19.419
  396    HG3  GLN  48           HG1      GLN  48  77.238  -0.226  17.790
  397   HE21  GLN  48          HE21      GLN  48  79.377  -2.705  18.396
  398   HE22  GLN  48          HE22      GLN  48  78.495  -4.000  17.743
  399    H    GLY  49           HN       GLY  49  80.856   0.644  15.693
  400    HA2  GLY  49           HA2      GLY  49  79.091   2.495  14.758
  401    HA3  GLY  49           HA1      GLY  49  79.772   3.336  16.150
  402    H1U  RCY  50           H1U      RCY  50  82.984   2.283   7.282
  403    H1S  RCY  50           H1S      RCY  50  84.918   0.927  10.539
  404    HB1  RCY  50           HB1      RCY  50  83.975   2.855  11.990
  405    HB2  RCY  50           HB2      RCY  50  82.379   2.207  12.375
  406    HA   RCY  50           HA       RCY  50  84.405   2.334  14.573
  407    HN1  RCY  50           HN1      RCY  50  82.369   1.770  15.600
  408    H    GLY  51           HN       GLY  51  82.245   4.553  15.379
  409    HA2  GLY  51           HA2      GLY  51  83.411   6.821  15.760
  410    HA3  GLY  51           HA1      GLY  51  83.643   6.816  14.011
  411    H    ASP  52           HN       ASP  52  82.343   8.925  14.408
  412    HA   ASP  52           HA       ASP  52  80.330  10.096  14.150
  413    HB2  ASP  52           HB2      ASP  52  79.618   9.238  12.169
  414    HB3  ASP  52           HB1      ASP  52  80.081   7.601  12.623
  415    H    ASP  53           HN       ASP  53  78.069  10.207  14.993
  416    HA   ASP  53           HA       ASP  53  77.127   8.179  16.842
  417    HB2  ASP  53           HB2      ASP  53  78.924  10.255  17.821
  418    HB3  ASP  53           HB1      ASP  53  77.355  10.354  18.618
  419    H    ILE  54           HN       ILE  54  76.386  10.176  14.608
  420    HA   ILE  54           HA       ILE  54  73.857  11.114  15.897
  421    HB   ILE  54           HB       ILE  54  75.569  12.649  13.921
  422   HG12  ILE  54          HG12      ILE  54  74.759  13.392  16.743
  423   HG13  ILE  54          HG11      ILE  54  76.282  12.584  16.368
  424   HG21  ILE  54          HG21      ILE  54  73.286  13.103  13.389
  425   HG22  ILE  54          HG22      ILE  54  73.811  14.444  14.406
  426   HG23  ILE  54          HG23      ILE  54  72.825  13.152  15.091
  427   HD11  ILE  54          HD11      ILE  54  76.850  14.442  14.811
  428   HD12  ILE  54          HD12      ILE  54  76.643  15.002  16.470
  429   HD13  ILE  54          HD13      ILE  54  75.364  15.264  15.285
  430    HA   PRO  55           HA       PRO  55  72.760   8.698  12.177
  431    HB2  PRO  55           HB2      PRO  55  70.355   7.796  13.070
  432    HB3  PRO  55           HB1      PRO  55  71.894   7.064  13.564
  433    HG2  PRO  55           HG2      PRO  55  70.133   8.936  15.050
  434    HG3  PRO  55           HG1      PRO  55  71.103   7.581  15.647
  435    HD2  PRO  55           HD2      PRO  55  71.844  10.260  15.828
  436    HD3  PRO  55           HD1      PRO  55  72.969   8.889  15.926
  437    H    GLY  56           HN       GLY  56  71.301   9.130  10.459
  438    HA2  GLY  56           HA2      GLY  56  68.957  10.333  10.136
  439    HA3  GLY  56           HA1      GLY  56  69.888  11.733  10.674
  440    H    MET  57           HN       MET  57  72.272  11.462   9.434
  441    HA   MET  57           HA       MET  57  71.732  11.016   6.542
  442    HB2  MET  57           HB2      MET  57  72.632  13.592   7.837
  443    HB3  MET  57           HB1      MET  57  73.043  13.224   6.162
  444    HG2  MET  57           HG2      MET  57  70.748  13.116   5.518
  445    HG3  MET  57           HG1      MET  57  70.205  13.085   7.196
  446    HE1  MET  57           HE1      MET  57  68.468  15.258   6.341
  447    HE2  MET  57           HE2      MET  57  69.236  14.727   4.847
  448    HE3  MET  57           HE3      MET  57  69.188  16.443   5.245
  449    H    GLU  58           HN       GLU  58  73.153   9.249   6.542
  450    HA   GLU  58           HA       GLU  58  75.227   8.150   6.509
  451    HB2  GLU  58           HB2      GLU  58  76.351  10.960   6.282
  452    HB3  GLU  58           HB1      GLU  58  77.135   9.462   5.784
  453    HG2  GLU  58           HG2      GLU  58  76.265  10.288   3.763
  454    HG3  GLU  58           HG1      GLU  58  75.033   9.135   4.277
  455    H    GLY  59           HN       GLY  59  74.393   8.105   8.970
  456    HA2  GLY  59           HA2      GLY  59  76.769   8.867  10.596
  457    HA3  GLY  59           HA1      GLY  59  75.165   9.327  11.169
  458    H1U  RCY  60           H1U      RCY  60  77.418   6.201   5.234
  459    H1S  RCY  60           H1S      RCY  60  78.231   6.547   9.493
  460    HB1  RCY  60           HB1      RCY  60  76.298   3.586  10.103
  461    HB2  RCY  60           HB2      RCY  60  76.140   3.439  11.851
  462    HA   RCY  60           HA       RCY  60  74.148   4.372  10.303
  463    HN1  RCY  60           HN1      RCY  60  74.800   6.492   9.525
  464    H    GLY  61           HN       GLY  61  73.231   3.236  12.079
  465    HA2  GLY  61           HA2      GLY  61  73.349   3.333  14.725
  466    HA3  GLY  61           HA1      GLY  61  72.726   4.960  14.446
  467    H    THR  62           HN       THR  62  70.795   4.834  12.698
  468    HA   THR  62           HA       THR  62  69.123   2.478  12.822
  469    HB   THR  62           HB       THR  62  68.630   3.045  15.072
  470    HG1  THR  62           HG1      THR  62  66.553   3.184  14.805
  471   HG21  THR  62          HG21      THR  62  68.031   5.407  15.708
  472   HG22  THR  62          HG22      THR  62  68.523   5.908  14.091
  473   HG23  THR  62          HG23      THR  62  69.706   5.205  15.194
  474    H    ASP  63           HN       ASP  63  69.836   5.672  11.842
  475    HA   ASP  63           HA       ASP  63  67.423   6.517  10.634
  476    HB2  ASP  63           HB2      ASP  63  68.988   7.691   8.977
  477    HB3  ASP  63           HB1      ASP  63  69.237   8.065  10.683
  478    H    ILE  64           HN       ILE  64  69.808   4.150   9.558
  479    HA   ILE  64           HA       ILE  64  69.112   3.873   6.861
  480    HB   ILE  64           HB       ILE  64  70.898   2.515   7.511
  481   HG12  ILE  64          HG12      ILE  64  68.652   0.495   7.670
  482   HG13  ILE  64          HG11      ILE  64  69.089   1.289   6.156
  483   HG21  ILE  64          HG21      ILE  64  69.128   1.738   9.837
  484   HG22  ILE  64          HG22      ILE  64  70.674   2.586   9.886
  485   HG23  ILE  64          HG23      ILE  64  70.620   0.876   9.460
  486   HD11  ILE  64          HD11      ILE  64  71.277   0.358   6.176
  487   HD12  ILE  64          HD12      ILE  64  70.212  -0.972   6.629
  488   HD13  ILE  64          HD13      ILE  64  71.139  -0.125   7.867
  489    H    THR  65           HN       THR  65  67.181   3.361   9.585
  490    HA   THR  65           HA       THR  65  65.196   2.018   9.885
  491    HB   THR  65           HB       THR  65  64.633   3.835   7.519
  492    HG1  THR  65           HG1      THR  65  64.886   4.178  10.256
  493   HG21  THR  65          HG21      THR  65  62.318   3.639   8.964
  494   HG22  THR  65          HG22      THR  65  62.963   2.004   9.119
  495   HG23  THR  65          HG23      THR  65  62.671   2.689   7.520
  496    H    VAL  66           HN       VAL  66  66.956   0.383   8.516
  497    HA   VAL  66           HA       VAL  66  66.939  -1.551   7.184
  498    HB   VAL  66           HB       VAL  66  64.055  -1.032   6.473
  499   HG11  VAL  66          HG11      VAL  66  65.541  -3.573   7.200
  500   HG12  VAL  66          HG12      VAL  66  65.367  -2.978   5.548
  501   HG13  VAL  66          HG13      VAL  66  63.940  -3.449   6.471
  502   HG21  VAL  66          HG21      VAL  66  63.716  -2.464   8.688
  503   HG22  VAL  66          HG22      VAL  66  63.800  -0.704   8.758
  504   HG23  VAL  66          HG23      VAL  66  65.219  -1.671   9.160
  505    H    ILE  67           HN       ILE  67  65.329   1.325   5.979
  506    HA   ILE  67           HA       ILE  67  66.766   1.014   3.394
  507    HB   ILE  67           HB       ILE  67  63.836   1.726   3.767
  508   HG12  ILE  67          HG12      ILE  67  64.364  -0.688   3.642
  509   HG13  ILE  67          HG11      ILE  67  63.493  -0.154   2.204
  510   HG21  ILE  67          HG21      ILE  67  63.975   1.947   1.196
  511   HG22  ILE  67          HG22      ILE  67  65.714   2.116   1.435
  512   HG23  ILE  67          HG23      ILE  67  64.608   3.284   2.157
  513   HD11  ILE  67          HD11      ILE  67  65.202  -1.268   1.148
  514   HD12  ILE  67          HD12      ILE  67  66.323  -1.032   2.488
  515   HD13  ILE  67          HD13      ILE  67  66.010   0.286   1.358
  516    H1U  RCY  68           H1U      RCY  68  71.671   4.373  -0.756
  517    H1S  RCY  68           H1S      RCY  68  70.611   1.791   2.809
  518    HB1  RCY  68           HB1      RCY  68  69.740   5.339   5.409
  519    HB2  RCY  68           HB2      RCY  68  69.867   5.323   3.651
  520    HA   RCY  68           HA       RCY  68  67.497   5.056   5.321
  521    HN1  RCY  68           HN1      RCY  68  68.245   2.610   4.035
  522    HA   PRO  69           HA       PRO  69  65.593   7.092   1.875
  523    HB2  PRO  69           HB2      PRO  69  65.913   9.715   2.739
  524    HB3  PRO  69           HB1      PRO  69  64.610   8.627   3.247
  525    HG2  PRO  69           HG2      PRO  69  67.097   9.390   4.663
  526    HG3  PRO  69           HG1      PRO  69  65.495   9.009   5.312
  527    HD2  PRO  69           HD2      PRO  69  67.615   7.265   5.411
  528    HD3  PRO  69           HD1      PRO  69  65.918   6.739   5.382
  529    H    TRP  70           HN       TRP  70  68.710   8.477   2.998
  530    HA   TRP  70           HA       TRP  70  69.219   9.699   0.409
  531    HD1  TRP  70           HD1      TRP  70  69.046  10.182   4.219
  532    HE1  TRP  70           HE1      TRP  70  69.760   8.864   6.314
  533    HE3  TRP  70           HE3      TRP  70  73.148   7.760   2.380
  534    HZ2  TRP  70           HZ2      TRP  70  71.805   7.021   7.108
  535    HZ3  TRP  70           HZ3      TRP  70  74.457   6.233   3.822
  536    HH2  TRP  70           HH2      TRP  70  73.794   5.859   6.180
  537    HB2  TRP  70           HB2      TRP  70  71.688   9.625   1.472
  538    HB3  TRP  70           HB1      TRP  70  70.488  10.811   1.977
  539    H    GLU  71           HN       GLU  71  68.678   6.697   0.739
  540    HA   GLU  71           HA       GLU  71  70.455   5.839  -1.364
  541    HB2  GLU  71           HB2      GLU  71  71.855   5.751   0.839
  542    HB3  GLU  71           HB1      GLU  71  70.877   4.332   1.214
  543    HG2  GLU  71           HG2      GLU  71  72.564   4.727  -1.275
  544    HG3  GLU  71           HG1      GLU  71  72.935   3.649   0.070
  545    H    ALA  72           HN       ALA  72  68.114   5.532  -1.987
  546    HA   ALA  72           HA       ALA  72  66.482   3.564  -0.681
  547    HB1  ALA  72           HB1      ALA  72  65.407   5.091  -2.184
  548    HB2  ALA  72           HB2      ALA  72  65.295   3.500  -2.937
  549    HB3  ALA  72           HB3      ALA  72  66.496   4.661  -3.503
  550    H1U  RCY  73           H1U      RCY  73  73.113  -0.543  -3.863
  551    H1S  RCY  73           H1S      RCY  73  69.926  -2.921  -2.890
  552    HB1  RCY  73           HB1      RCY  73  66.455  -1.073  -0.903
  553    HB2  RCY  73           HB2      RCY  73  67.893  -0.856   0.094
  554    HA   RCY  73           HA       RCY  73  69.092   0.112  -1.826
  555    HN1  RCY  73           HN1      RCY  73  67.016   1.440  -0.511
  556    H    ASN  74           HN       ASN  74  69.246   0.415  -4.042
  557    HA   ASN  74           HA       ASN  74  67.041  -0.766  -5.686
  558    HB2  ASN  74           HB2      ASN  74  67.828   1.000  -7.436
  559    HB3  ASN  74           HB1      ASN  74  66.781   1.533  -6.120
  560   HD21  ASN  74          HD21      ASN  74  67.542   3.614  -5.622
  561   HD22  ASN  74          HD22      ASN  74  69.164   3.984  -5.282
  562    H    HIS  75           HN       HIS  75  69.900   0.664  -7.081
  563    HA   HIS  75           HA       HIS  75  71.570  -1.671  -7.061
  564    HD1  HIS  75           HD1      HIS  75  69.943   0.846  -9.335
  565    HD2  HIS  75           HD2      HIS  75  67.774  -2.645 -10.045
  566    HE1  HIS  75           HE1      HIS  75  67.760   1.564 -10.399
  567    HE2  HIS  75           HE2      HIS  75  66.430  -0.552 -10.836
  568    HB2  HIS  75           HB2      HIS  75  71.188  -2.053  -9.642
  569    HB3  HIS  75           HB1      HIS  75  70.115  -2.827  -8.477
  570    H1U  RCY  76           H1U      RCY  76  77.000   2.175  -4.089
  571    H1S  RCY  76           H1S      RCY  76  75.710   0.938  -6.807
  572    HB1  RCY  76           HB1      RCY  76  73.512   2.569  -8.746
  573    HB2  RCY  76           HB2      RCY  76  75.198   2.373  -8.266
  574    HA   RCY  76           HA       RCY  76  74.064   0.747 -10.061
  575    HN1  RCY  76           HN1      RCY  76  73.561  -1.251  -8.141
  576    H    GLU  77           HN       GLU  77  76.314   0.859 -10.536
  577    HA   GLU  77           HA       GLU  77  77.887  -1.365  -9.658
  578    HB2  GLU  77           HB2      GLU  77  78.595   1.184 -11.123
  579    HB3  GLU  77           HB1      GLU  77  79.789  -0.065 -10.771
  580    HG2  GLU  77           HG2      GLU  77  78.859  -0.406 -13.015
  581    HG3  GLU  77           HG1      GLU  77  78.370  -1.727 -11.953
  582    H    LEU  78           HN       LEU  78  79.786  -1.361  -8.310
  583    HA   LEU  78           HA       LEU  78  79.931   0.944  -6.400
  584    HG   LEU  78           HG       LEU  78  78.335   0.305  -5.048
  585    HB2  LEU  78           HB2      LEU  78  80.020  -2.034  -5.886
  586    HB3  LEU  78           HB1      LEU  78  80.685  -0.878  -4.734
  587   HD11  LEU  78          HD11      LEU  78  77.444  -2.541  -5.389
  588   HD12  LEU  78          HD12      LEU  78  77.851  -1.593  -6.819
  589   HD13  LEU  78          HD13      LEU  78  76.570  -1.049  -5.736
  590   HD21  LEU  78          HD21      LEU  78  79.098  -0.532  -2.909
  591   HD22  LEU  78          HD22      LEU  78  78.848  -2.201  -3.419
  592   HD23  LEU  78          HD23      LEU  78  77.463  -1.139  -3.167
  593    H    HIS  79           HN       HIS  79  81.621  -1.251  -8.476
  594    HA   HIS  79           HA       HIS  79  84.096   0.256  -8.055
  595    HD1  HIS  79           HD1      HIS  79  84.944  -0.328  -4.875
  596    HD2  HIS  79           HD2      HIS  79  87.250  -1.412  -8.178
  597    HE1  HIS  79           HE1      HIS  79  87.279   0.550  -4.437
  598    HE2  HIS  79           HE2      HIS  79  88.693  -0.103  -6.440
  599    HB2  HIS  79           HB2      HIS  79  83.739  -1.959  -6.433
  600    HB3  HIS  79           HB1      HIS  79  84.649  -2.628  -7.785
  601    H    GLU  80           HN       GLU  80  85.875  -1.440  -9.334
  602    HA   GLU  80           HA       GLU  80  84.989  -1.205 -12.082
  603    HB2  GLU  80           HB2      GLU  80  87.437  -2.562 -10.907
  604    HB3  GLU  80           HB1      GLU  80  87.181  -2.239 -12.623
  605    HG2  GLU  80           HG2      GLU  80  87.193   0.134 -12.266
  606    HG3  GLU  80           HG1      GLU  80  87.133  -0.068 -10.514
  607    H    LEU  81           HN       LEU  81  86.008  -4.091 -10.198
  608    HA   LEU  81           HA       LEU  81  84.595  -5.816 -12.127
  609    HG   LEU  81           HG       LEU  81  85.730  -5.620  -8.779
  610    HB2  LEU  81           HB2      LEU  81  85.463  -7.655 -10.611
  611    HB3  LEU  81           HB1      LEU  81  86.708  -6.658 -11.362
  612   HD11  LEU  81          HD11      LEU  81  87.254  -8.240  -8.932
  613   HD12  LEU  81          HD12      LEU  81  85.641  -8.009  -8.257
  614   HD13  LEU  81          HD13      LEU  81  87.040  -7.285  -7.464
  615   HD21  LEU  81          HD21      LEU  81  87.676  -4.735 -10.074
  616   HD22  LEU  81          HD22      LEU  81  88.501  -6.275  -9.830
  617   HD23  LEU  81          HD23      LEU  81  88.124  -5.248  -8.447
  618    H    ALA  82           HN       ALA  82  83.164  -3.924 -10.211
  619    HA   ALA  82           HA       ALA  82  81.859  -5.504  -8.199
  620    HB1  ALA  82           HB1      ALA  82  80.213  -3.658  -8.131
  621    HB2  ALA  82           HB2      ALA  82  80.902  -2.996  -9.611
  622    HB3  ALA  82           HB3      ALA  82  81.865  -3.046  -8.136
  623    H    GLN  83           HN       GLN  83  81.535  -7.416  -9.777
  624    HA   GLN  83           HA       GLN  83  79.488  -7.238 -11.801
  625    HB2  GLN  83           HB2      GLN  83  80.527  -9.620 -10.232
  626    HB3  GLN  83           HB1      GLN  83  79.454  -9.732 -11.628
  627    HG2  GLN  83           HG2      GLN  83  81.171  -8.485 -12.970
  628    HG3  GLN  83           HG1      GLN  83  82.257  -8.581 -11.583
  629   HE21  GLN  83          HE21      GLN  83  83.798 -10.105 -12.313
  630   HE22  GLN  83          HE22      GLN  83  83.405 -11.675 -12.826
  631    H    TYR  84           HN       TYR  84  79.407  -7.389  -8.359
  632    HA   TYR  84           HA       TYR  84  76.485  -7.271  -8.394
  633    HD1  TYR  84           HD2      TYR  84  74.637  -8.685  -8.738
  634    HD2  TYR  84           HD1      TYR  84  78.138 -11.152  -9.063
  635    HE1  TYR  84           HE2      TYR  84  73.669  -9.795 -10.734
  636    HE2  TYR  84           HE1      TYR  84  77.171 -12.262 -11.059
  637    HH   TYR  84           HH       TYR  84  75.043 -11.191 -12.906
  638    HB2  TYR  84           HB2      TYR  84  77.957  -9.667  -7.277
  639    HB3  TYR  84           HB1      TYR  84  76.337  -9.226  -6.739
  640    H    GLY  85           HN       GLY  85  78.937  -5.760  -7.429
  641    HA2  GLY  85           HA2      GLY  85  79.334  -4.322  -5.608
  642    HA3  GLY  85           HA1      GLY  85  77.801  -4.862  -4.924
  643    H    ILE  86           HN       ILE  86  81.259  -5.502  -5.061
  644    HA   ILE  86           HA       ILE  86  81.008  -7.758  -3.169
  645    HB   ILE  86           HB       ILE  86  83.481  -6.394  -4.284
  646   HG12  ILE  86          HG12      ILE  86  82.283  -9.055  -5.089
  647   HG13  ILE  86          HG11      ILE  86  81.905  -7.553  -5.934
  648   HG21  ILE  86          HG21      ILE  86  83.966  -7.567  -2.210
  649   HG22  ILE  86          HG22      ILE  86  84.581  -8.527  -3.555
  650   HG23  ILE  86          HG23      ILE  86  83.074  -8.985  -2.761
  651   HD11  ILE  86          HD11      ILE  86  84.193  -7.228  -6.567
  652   HD12  ILE  86          HD12      ILE  86  83.814  -8.912  -6.931
  653   HD13  ILE  86          HD13      ILE  86  84.741  -8.509  -5.486
  654    H1U  RCY  87           H1U      RCY  87  76.272  -2.710  -1.419
  655    H1S  RCY  87           H1S      RCY  87  80.091  -5.499  -0.340
  656    HB1  RCY  87           HB1      RCY  87  81.169  -6.019   2.288
  657    HB2  RCY  87           HB2      RCY  87  81.894  -7.502   1.669
  658    HA   RCY  87           HA       RCY  87  81.385  -4.915   0.195
  659    HN1  RCY  87           HN1      RCY  87  81.292  -7.556  -0.982
  Start of MODEL   92
    1    HA   MET   1           HA       MET   1  55.575 -15.317  18.981
    2    HB2  MET   1           HB2      MET   1  58.350 -15.896  20.064
    3    HB3  MET   1           HB1      MET   1  56.875 -15.832  21.029
    4    HG2  MET   1           HG2      MET   1  57.227 -18.144  20.546
    5    HG3  MET   1           HG1      MET   1  55.938 -17.621  19.462
    6    HE1  MET   1           HE1      MET   1  57.148 -20.093  19.106
    7    HE2  MET   1           HE2      MET   1  58.885 -19.945  19.363
    8    HE3  MET   1           HE3      MET   1  58.268 -20.329  17.758
    9    H    ASN   2           HN       ASN   2  56.653 -13.072  17.511
   10    HA   ASN   2           HA       ASN   2  56.440 -11.035  19.526
   11    HB2  ASN   2           HB2      ASN   2  58.784 -10.113  19.213
   12    HB3  ASN   2           HB1      ASN   2  58.694 -11.607  20.146
   13   HD21  ASN   2          HD21      ASN   2  61.106 -10.911  18.807
   14   HD22  ASN   2          HD22      ASN   2  61.355 -11.998  17.527
   15    H    LEU   3           HN       LEU   3  58.731  -9.952  17.356
   16    HA   LEU   3           HA       LEU   3  56.849  -8.339  15.909
   17    HG   LEU   3           HG       LEU   3  59.546  -6.550  14.321
   18    HB2  LEU   3           HB2      LEU   3  59.454  -8.057  16.339
   19    HB3  LEU   3           HB1      LEU   3  59.585  -8.923  14.811
   20   HD11  LEU   3          HD11      LEU   3  57.734  -6.486  12.773
   21   HD12  LEU   3          HD12      LEU   3  56.746  -7.552  13.773
   22   HD13  LEU   3          HD13      LEU   3  58.155  -8.192  12.927
   23   HD21  LEU   3          HD21      LEU   3  58.138  -6.255  16.605
   24   HD22  LEU   3          HD22      LEU   3  56.814  -6.169  15.443
   25   HD23  LEU   3          HD23      LEU   3  58.155  -5.028  15.338
   26    H    GLU   4           HN       GLU   4  55.384  -9.328  14.573
   27    HA   GLU   4           HA       GLU   4  55.962 -11.786  13.168
   28    HB2  GLU   4           HB2      GLU   4  53.762 -11.594  12.259
   29    HB3  GLU   4           HB1      GLU   4  53.660 -10.935  13.889
   30    HG2  GLU   4           HG2      GLU   4  53.857  -9.388  11.292
   31    HG3  GLU   4           HG1      GLU   4  52.518  -9.388  12.440
   32    HA   PRO   5           HA       PRO   5  58.170 -10.582   9.541
   33    HB2  PRO   5           HB2      PRO   5  55.823 -11.727   8.061
   34    HB3  PRO   5           HB1      PRO   5  57.558 -11.995   7.797
   35    HG2  PRO   5           HG2      PRO   5  56.017 -13.774   9.080
   36    HG3  PRO   5           HG1      PRO   5  57.719 -13.520   9.495
   37    HD2  PRO   5           HD2      PRO   5  55.307 -12.805  11.039
   38    HD3  PRO   5           HD1      PRO   5  56.987 -12.973  11.591
   39    HA   PRO   6           HA       PRO   6  55.966  -6.767   8.564
   40    HB2  PRO   6           HB2      PRO   6  57.925  -5.537   7.145
   41    HB3  PRO   6           HB1      PRO   6  58.009  -5.723   8.909
   42    HG2  PRO   6           HG2      PRO   6  59.370  -7.300   6.782
   43    HG3  PRO   6           HG1      PRO   6  59.985  -6.750   8.350
   44    HD2  PRO   6           HD2      PRO   6  59.084  -9.319   7.866
   45    HD3  PRO   6           HD1      PRO   6  59.108  -8.561   9.474
   46    H    LYS   7           HN       LYS   7  55.193  -5.624   6.597
   47    HA   LYS   7           HA       LYS   7  55.714  -6.668   3.963
   48    HB2  LYS   7           HB2      LYS   7  54.225  -8.445   5.185
   49    HB3  LYS   7           HB1      LYS   7  52.925  -7.290   4.911
   50    HG2  LYS   7           HG2      LYS   7  54.751  -8.232   2.690
   51    HG3  LYS   7           HG1      LYS   7  53.240  -9.051   3.088
   52    HD2  LYS   7           HD2      LYS   7  52.239  -7.575   1.699
   53    HD3  LYS   7           HD1      LYS   7  52.503  -6.376   2.966
   54    HE2  LYS   7           HE2      LYS   7  53.471  -5.414   1.025
   55    HE3  LYS   7           HE1      LYS   7  54.840  -6.054   1.934
   56    HZ1  LYS   7           HZ1      LYS   7  53.624  -7.041  -0.542
   57    HZ2  LYS   7           HZ2      LYS   7  54.316  -8.173   0.520
   58    HZ3  LYS   7           HZ3      LYS   7  55.262  -6.914  -0.118
   59    H    ALA   8           HN       ALA   8  52.643  -5.597   5.359
   60    HA   ALA   8           HA       ALA   8  52.437  -3.449   3.401
   61    HB1  ALA   8           HB1      ALA   8  50.292  -3.014   4.353
   62    HB2  ALA   8           HB2      ALA   8  50.729  -3.792   5.874
   63    HB3  ALA   8           HB3      ALA   8  50.489  -4.765   4.423
   64    H    GLU   9           HN       GLU   9  53.187  -1.398   3.655
   65    HA   GLU   9           HA       GLU   9  53.449  -0.229   6.348
   66    HB2  GLU   9           HB2      GLU   9  55.592  -1.395   6.098
   67    HB3  GLU   9           HB1      GLU   9  55.845  -0.631   4.529
   68    HG2  GLU   9           HG2      GLU   9  56.035   1.542   5.515
   69    HG3  GLU   9           HG1      GLU   9  55.453   0.958   7.074
   70    H1U  RCY  10           H1U      RCY  10  56.484  -3.096   1.116
   71    H1S  RCY  10           H1S      RCY  10  56.884   0.443   3.176
   72    HB1  RCY  10           HB1      RCY  10  54.639   3.449   3.729
   73    HB2  RCY  10           HB2      RCY  10  54.444   4.028   2.075
   74    HA   RCY  10           HA       RCY  10  52.525   2.623   2.790
   75    HN1  RCY  10           HN1      RCY  10  53.905   0.093   2.847
   76    H    ARG  11           HN       ARG  11  52.589   0.013   1.427
   77    HA   ARG  11           HA       ARG  11  52.471   1.021  -1.323
   78    HE   ARG  11           HE       ARG  11  55.667  -3.820   0.134
   79    HB2  ARG  11           HB2      ARG  11  54.047  -0.657  -2.224
   80    HB3  ARG  11           HB1      ARG  11  54.864   0.446  -1.116
   81    HG2  ARG  11           HG2      ARG  11  54.390  -1.288   0.714
   82    HG3  ARG  11           HG1      ARG  11  53.979  -2.396  -0.595
   83    HD2  ARG  11           HD2      ARG  11  56.256  -1.790  -1.612
   84    HD3  ARG  11           HD1      ARG  11  56.635  -1.063  -0.050
   85   HH11  ARG  11          HH21      ARG  11  58.335  -1.674  -0.276
   86   HH12  ARG  11          HH22      ARG  11  59.507  -2.807   0.310
   87   HH21  ARG  11          HH11      ARG  11  57.182  -5.311   0.901
   88   HH22  ARG  11          HH12      ARG  11  58.854  -4.866   0.977
   89    H    SER  12           HN       SER  12  52.501  -1.585  -2.533
   90    HA   SER  12           HA       SER  12  50.910  -3.521  -1.212
   91    HG   SER  12           HG       SER  12  48.416  -3.915  -2.189
   92    HB2  SER  12           HB2      SER  12  49.047  -2.127  -1.020
   93    HB3  SER  12           HB1      SER  12  49.404  -1.275  -2.520
   94    H    ALA  13           HN       ALA  13  51.751  -1.882  -4.204
   95    HA   ALA  13           HA       ALA  13  52.439  -4.364  -5.497
   96    HB1  ALA  13           HB1      ALA  13  50.117  -4.737  -5.850
   97    HB2  ALA  13           HB2      ALA  13  50.700  -4.059  -7.370
   98    HB3  ALA  13           HB3      ALA  13  49.823  -3.040  -6.229
   99    H    THR  14           HN       THR  14  54.313  -3.481  -6.298
  100    HA   THR  14           HA       THR  14  54.037  -1.361  -8.340
  101    HB   THR  14           HB       THR  14  56.017  -1.077  -6.062
  102    HG1  THR  14           HG1      THR  14  54.611   0.639  -5.435
  103   HG21  THR  14          HG21      THR  14  56.098   1.282  -7.039
  104   HG22  THR  14          HG22      THR  14  55.223   0.632  -8.425
  105   HG23  THR  14          HG23      THR  14  56.825   0.012  -8.023
  106    H    ARG  15           HN       ARG  15  54.533  -3.648  -9.320
  107    HA   ARG  15           HA       ARG  15  57.293  -4.560  -9.103
  108    HE   ARG  15           HE       ARG  15  55.896  -6.801 -12.938
  109    HB2  ARG  15           HB2      ARG  15  56.665  -6.048 -11.010
  110    HB3  ARG  15           HB1      ARG  15  55.533  -6.161  -9.662
  111    HG2  ARG  15           HG2      ARG  15  54.059  -4.505 -10.818
  112    HG3  ARG  15           HG1      ARG  15  55.157  -4.543 -12.198
  113    HD2  ARG  15           HD2      ARG  15  53.693  -6.945 -11.063
  114    HD3  ARG  15           HD1      ARG  15  53.237  -6.073 -12.527
  115   HH11  ARG  15          HH21      ARG  15  52.920  -8.356 -12.156
  116   HH12  ARG  15          HH22      ARG  15  53.333  -9.839 -12.950
  117   HH21  ARG  15          HH11      ARG  15  56.452  -8.728 -13.980
  118   HH22  ARG  15          HH12      ARG  15  55.333 -10.050 -13.983
  119    H    VAL  16           HN       VAL  16  56.925  -1.749  -9.851
  120    HA   VAL  16           HA       VAL  16  57.176  -1.121 -12.548
  121    HB   VAL  16           HB       VAL  16  57.219   0.570 -10.750
  122   HG11  VAL  16          HG11      VAL  16  58.757  -0.808  -9.274
  123   HG12  VAL  16          HG12      VAL  16  59.166   0.905  -9.378
  124   HG13  VAL  16          HG13      VAL  16  60.091  -0.281 -10.300
  125   HG21  VAL  16          HG21      VAL  16  58.207   0.982 -13.074
  126   HG22  VAL  16          HG22      VAL  16  59.791   0.744 -12.337
  127   HG23  VAL  16          HG23      VAL  16  58.760   2.070 -11.801
  128    H    MET  17           HN       MET  17  58.864  -1.192 -14.073
  129    HA   MET  17           HA       MET  17  61.559  -1.960 -13.391
  130    HB2  MET  17           HB2      MET  17  60.296  -4.140 -13.089
  131    HB3  MET  17           HB1      MET  17  59.936  -4.087 -14.814
  132    HG2  MET  17           HG2      MET  17  62.783  -3.677 -14.089
  133    HG3  MET  17           HG1      MET  17  62.145  -5.294 -13.791
  134    HE1  MET  17           HE1      MET  17  61.578  -6.972 -15.401
  135    HE2  MET  17           HE2      MET  17  63.321  -6.724 -15.457
  136    HE3  MET  17           HE3      MET  17  62.427  -6.985 -16.952
  137    H    GLY  18           HN       GLY  18  61.485   0.067 -14.779
  138    HA2  GLY  18           HA2      GLY  18  60.751  -0.144 -17.568
  139    HA3  GLY  18           HA1      GLY  18  61.742   1.135 -16.863
  140    H    GLY  19           HN       GLY  19  61.894  -1.134 -19.170
  141    HA2  GLY  19           HA2      GLY  19  64.373  -2.487 -18.634
  142    HA3  GLY  19           HA1      GLY  19  63.647  -2.286 -20.228
  143    HA   PRO  20           HA       PRO  20  66.374   0.820 -21.718
  144    HB2  PRO  20           HB2      PRO  20  64.282   2.910 -21.212
  145    HB3  PRO  20           HB1      PRO  20  65.243   2.609 -22.673
  146    HG2  PRO  20           HG2      PRO  20  62.692   1.839 -22.477
  147    HG3  PRO  20           HG1      PRO  20  63.893   0.895 -23.372
  148    HD2  PRO  20           HD2      PRO  20  62.590   0.282 -20.781
  149    HD3  PRO  20           HD1      PRO  20  63.346  -0.820 -21.952
  150    H1U  RCY  21           H1U      RCY  21  67.615  -3.098 -13.605
  151    H1S  RCY  21           H1S      RCY  21  67.898   1.643 -13.465
  152    HB1  RCY  21           HB1      RCY  21  68.652   0.556 -17.053
  153    HB2  RCY  21           HB2      RCY  21  66.924   0.907 -17.042
  154    HA   RCY  21           HA       RCY  21  67.627   3.167 -18.152
  155    HN1  RCY  21           HN1      RCY  21  67.835   0.769 -19.912
  156    H    THR  22           HN       THR  22  69.331   4.308 -18.985
  157    HA   THR  22           HA       THR  22  71.727   3.084 -20.003
  158    HB   THR  22           HB       THR  22  70.642   5.514 -20.329
  159    HG1  THR  22           HG1      THR  22  72.624   4.414 -21.243
  160   HG21  THR  22          HG21      THR  22  71.683   7.214 -19.039
  161   HG22  THR  22          HG22      THR  22  72.872   6.092 -18.377
  162   HG23  THR  22          HG23      THR  22  71.187   5.995 -17.865
  163    HA   PRO  23           HA       PRO  23  74.253   2.525 -16.430
  164    HB2  PRO  23           HB2      PRO  23  76.315   4.463 -17.328
  165    HB3  PRO  23           HB1      PRO  23  76.455   2.717 -17.050
  166    HG2  PRO  23           HG2      PRO  23  76.456   3.768 -19.508
  167    HG3  PRO  23           HG1      PRO  23  75.719   2.194 -19.162
  168    HD2  PRO  23           HD2      PRO  23  74.377   4.846 -19.606
  169    HD3  PRO  23           HD1      PRO  23  73.862   3.222 -20.120
  170    H    ARG  24           HN       ARG  24  72.296   4.668 -16.198
  171    HA   ARG  24           HA       ARG  24  71.845   6.647 -14.988
  172    HE   ARG  24           HE       ARG  24  75.603   5.228 -10.284
  173    HB2  ARG  24           HB2      ARG  24  72.335   6.352 -12.620
  174    HB3  ARG  24           HB1      ARG  24  71.854   4.805 -13.314
  175    HG2  ARG  24           HG2      ARG  24  74.149   4.066 -13.448
  176    HG3  ARG  24           HG1      ARG  24  74.744   5.667 -13.006
  177    HD2  ARG  24           HD2      ARG  24  73.307   5.327 -10.848
  178    HD3  ARG  24           HD1      ARG  24  73.375   3.619 -11.278
  179   HH11  ARG  24          HH21      ARG  24  74.568   2.495 -12.113
  180   HH12  ARG  24          HH22      ARG  24  76.048   1.622 -11.895
  181   HH21  ARG  24          HH11      ARG  24  77.542   4.103  -9.989
  182   HH22  ARG  24          HH12      ARG  24  77.731   2.532 -10.693
  183    H    LYS  25           HN       LYS  25  74.344   6.768 -16.630
  184    HA   LYS  25           HA       LYS  25  76.330   8.185 -15.061
  185    HB2  LYS  25           HB2      LYS  25  77.309   8.761 -17.263
  186    HB3  LYS  25           HB1      LYS  25  76.936   7.042 -17.150
  187    HG2  LYS  25           HG2      LYS  25  75.856   7.364 -19.128
  188    HG3  LYS  25           HG1      LYS  25  74.575   8.045 -18.125
  189    HD2  LYS  25           HD2      LYS  25  74.934   9.764 -19.666
  190    HD3  LYS  25           HD1      LYS  25  75.968  10.260 -18.326
  191    HE2  LYS  25           HE2      LYS  25  77.300  10.458 -20.309
  192    HE3  LYS  25           HE1      LYS  25  77.860   9.006 -19.479
  193    HZ1  LYS  25           HZ1      LYS  25  75.985   7.937 -20.972
  194    HZ2  LYS  25           HZ2      LYS  25  77.570   8.159 -21.543
  195    HZ3  LYS  25           HZ3      LYS  25  76.350   9.264 -21.965
  196    H    GLY  26           HN       GLY  26  76.896  10.522 -15.592
  197    HA2  GLY  26           HA2      GLY  26  75.255  12.401 -16.806
  198    HA3  GLY  26           HA1      GLY  26  74.534  12.173 -15.212
  199    HA   PRO  27           HA       PRO  27  77.758  15.618 -15.084
  200    HB2  PRO  27           HB2      PRO  27  75.788  16.349 -12.948
  201    HB3  PRO  27           HB1      PRO  27  76.608  17.391 -14.129
  202    HG2  PRO  27           HG2      PRO  27  74.055  16.693 -14.422
  203    HG3  PRO  27           HG1      PRO  27  75.139  16.864 -15.813
  204    HD2  PRO  27           HD2      PRO  27  74.054  14.381 -14.571
  205    HD3  PRO  27           HD1      PRO  27  74.541  14.683 -16.254
  206    HA   PRO  28           HA       PRO  28  80.331  14.075 -11.833
  207    HB2  PRO  28           HB2      PRO  28  80.055  16.792 -10.591
  208    HB3  PRO  28           HB1      PRO  28  81.519  15.835 -10.892
  209    HG2  PRO  28           HG2      PRO  28  80.774  17.889 -12.465
  210    HG3  PRO  28           HG1      PRO  28  81.658  16.481 -13.072
  211    HD2  PRO  28           HD2      PRO  28  78.872  17.273 -13.588
  212    HD3  PRO  28           HD1      PRO  28  79.886  16.105 -14.461
  213    H    LYS  29           HN       LYS  29  80.250  13.495  -9.535
  214    HA   LYS  29           HA       LYS  29  77.767  12.727  -8.540
  215    HB2  LYS  29           HB2      LYS  29  80.324  12.422  -7.682
  216    HB3  LYS  29           HB1      LYS  29  79.750  13.584  -6.490
  217    HG2  LYS  29           HG2      LYS  29  79.198  11.516  -5.512
  218    HG3  LYS  29           HG1      LYS  29  77.687  12.004  -6.279
  219    HD2  LYS  29           HD2      LYS  29  77.998  10.521  -8.098
  220    HD3  LYS  29           HD1      LYS  29  79.709  10.299  -7.733
  221    HE2  LYS  29           HE2      LYS  29  79.211   9.023  -5.761
  222    HE3  LYS  29           HE1      LYS  29  77.500   9.443  -5.849
  223    HZ1  LYS  29           HZ1      LYS  29  78.590   8.182  -8.217
  224    HZ2  LYS  29           HZ2      LYS  29  77.114   7.912  -7.420
  225    HZ3  LYS  29           HZ3      LYS  29  78.539   7.192  -6.840
  226    H1U  RCY  30           H1U      RCY  30  79.253  12.077  -9.134
  227    H1S  RCY  30           H1S      RCY  30  75.996  13.772  -7.226
  228    HB1  RCY  30           HB1      RCY  30  73.717  16.362  -6.983
  229    HB2  RCY  30           HB2      RCY  30  74.252  15.216  -5.757
  230    HA   RCY  30           HA       RCY  30  75.835  16.681  -7.815
  231    HN1  RCY  30           HN1      RCY  30  76.029  13.922  -7.946
  232    H    LYS  31           HN       LYS  31  75.697  14.881  -4.750
  233    HA   LYS  31           HA       LYS  31  77.831  16.596  -3.624
  234    HB2  LYS  31           HB2      LYS  31  76.122  16.917  -1.610
  235    HB3  LYS  31           HB1      LYS  31  76.104  18.017  -2.988
  236    HG2  LYS  31           HG2      LYS  31  74.207  17.010  -3.934
  237    HG3  LYS  31           HG1      LYS  31  74.432  15.515  -3.026
  238    HD2  LYS  31           HD2      LYS  31  73.611  16.448  -1.036
  239    HD3  LYS  31           HD1      LYS  31  73.901  18.101  -1.580
  240    HE2  LYS  31           HE2      LYS  31  72.076  17.986  -3.148
  241    HE3  LYS  31           HE1      LYS  31  71.879  16.255  -2.875
  242    HZ1  LYS  31           HZ1      LYS  31  70.881  18.463  -1.351
  243    HZ2  LYS  31           HZ2      LYS  31  71.707  17.335  -0.385
  244    HZ3  LYS  31           HZ3      LYS  31  70.396  16.838  -1.344
  245    H    GLN  32           HN       GLN  32  75.662  15.192  -1.394
  246    HA   GLN  32           HA       GLN  32  76.870  12.539  -1.349
  247    HB2  GLN  32           HB2      GLN  32  78.683  13.855  -0.325
  248    HB3  GLN  32           HB1      GLN  32  77.545  14.516   0.849
  249    HG2  GLN  32           HG2      GLN  32  77.266  12.446   1.933
  250    HG3  GLN  32           HG1      GLN  32  77.882  11.537   0.552
  251   HE21  GLN  32          HE21      GLN  32  78.809  13.304   3.439
  252   HE22  GLN  32          HE22      GLN  32  80.476  13.003   3.320
  253    H    ARG  33           HN       ARG  33  75.954  14.211   1.571
  254    HA   ARG  33           HA       ARG  33  73.145  13.594   1.470
  255    HE   ARG  33           HE       ARG  33  71.238  10.112   4.721
  256    HB2  ARG  33           HB2      ARG  33  74.070  11.289   1.654
  257    HB3  ARG  33           HB1      ARG  33  74.867  11.751   3.157
  258    HG2  ARG  33           HG2      ARG  33  72.956  11.520   4.342
  259    HG3  ARG  33           HG1      ARG  33  72.042  12.475   3.174
  260    HD2  ARG  33           HD2      ARG  33  71.491  10.609   1.878
  261    HD3  ARG  33           HD1      ARG  33  72.846   9.660   2.491
  262   HH11  ARG  33          HH21      ARG  33  70.886   8.792   1.555
  263   HH12  ARG  33          HH22      ARG  33  69.651   7.669   2.016
  264   HH21  ARG  33          HH11      ARG  33  69.627   8.653   5.341
  265   HH22  ARG  33          HH12      ARG  33  68.937   7.590   4.160
  266    H    GLN  34           HN       GLN  34  75.282  15.586   2.367
  267    HA   GLN  34           HA       GLN  34  75.628  17.081   4.142
  268    HB2  GLN  34           HB2      GLN  34  73.088  17.260   3.506
  269    HB3  GLN  34           HB1      GLN  34  72.828  16.451   5.052
  270    HG2  GLN  34           HG2      GLN  34  74.103  18.206   6.206
  271    HG3  GLN  34           HG1      GLN  34  74.416  19.007   4.666
  272   HE21  GLN  34          HE21      GLN  34  72.604  20.093   3.601
  273   HE22  GLN  34          HE22      GLN  34  71.166  20.433   4.438
  274    H    THR  35           HN       THR  35  76.556  14.492   4.704
  275    HA   THR  35           HA       THR  35  75.673  13.944   7.497
  276    HB   THR  35           HB       THR  35  75.761  11.976   6.092
  277    HG1  THR  35           HG1      THR  35  77.627  10.904   7.159
  278   HG21  THR  35          HG21      THR  35  78.466  13.074   5.346
  279   HG22  THR  35          HG22      THR  35  77.145  12.584   4.285
  280   HG23  THR  35          HG23      THR  35  78.091  11.363   5.136
  281    H    ARG  36           HN       ARG  36  78.576  12.662   7.544
  282    HA   ARG  36           HA       ARG  36  80.311  14.986   7.727
  283    HE   ARG  36           HE       ARG  36  80.115  18.698  10.670
  284    HB2  ARG  36           HB2      ARG  36  79.030  13.832  10.190
  285    HB3  ARG  36           HB1      ARG  36  80.691  14.413  10.290
  286    HG2  ARG  36           HG2      ARG  36  79.568  16.494   8.972
  287    HG3  ARG  36           HG1      ARG  36  78.172  15.945   9.900
  288    HD2  ARG  36           HD2      ARG  36  79.386  16.152  11.979
  289    HD3  ARG  36           HD1      ARG  36  80.893  16.479  11.121
  290   HH11  ARG  36          HH21      ARG  36  77.780  16.666  12.189
  291   HH12  ARG  36          HH22      ARG  36  76.712  17.969  12.592
  292   HH21  ARG  36          HH11      ARG  36  78.733  20.411  11.187
  293   HH22  ARG  36          HH12      ARG  36  77.252  20.089  12.025
  294    H    GLN  37           HN       GLN  37  81.041  13.092   6.205
  295    HA   GLN  37           HA       GLN  37  82.799  11.592   5.799
  296    HB2  GLN  37           HB2      GLN  37  83.783  13.000   7.821
  297    HB3  GLN  37           HB1      GLN  37  83.511  11.504   8.713
  298    HG2  GLN  37           HG2      GLN  37  85.678  11.180   7.905
  299    HG3  GLN  37           HG1      GLN  37  84.713  10.388   6.659
  300   HE21  GLN  37          HE21      GLN  37  84.931  11.175   4.540
  301   HE22  GLN  37          HE22      GLN  37  85.740  12.610   4.130
  302    H1U  RCY  38           H1U      RCY  38  79.694   3.698   4.514
  303    H1S  RCY  38           H1S      RCY  38  78.078   6.019   7.475
  304    HB1  RCY  38           HB1      RCY  38  80.057   7.143   7.204
  305    HB2  RCY  38           HB2      RCY  38  80.114   8.659   6.306
  306    HA   RCY  38           HA       RCY  38  79.516   9.058   9.148
  307    HN1  RCY  38           HN1      RCY  38  80.530  11.034   8.394
  308    H    LYS  39           HN       LYS  39  80.489   8.077  10.847
  309    HA   LYS  39           HA       LYS  39  83.275   7.206  10.709
  310    HB2  LYS  39           HB2      LYS  39  82.820   6.441  13.074
  311    HB3  LYS  39           HB1      LYS  39  82.487   8.148  12.789
  312    HG2  LYS  39           HG2      LYS  39  80.134   7.775  12.676
  313    HG3  LYS  39           HG1      LYS  39  80.345   6.028  12.558
  314    HD2  LYS  39           HD2      LYS  39  81.231   5.952  14.840
  315    HD3  LYS  39           HD1      LYS  39  81.106   7.707  14.967
  316    HE2  LYS  39           HE2      LYS  39  78.727   7.646  14.889
  317    HE3  LYS  39           HE1      LYS  39  78.713   5.968  14.345
  318    HZ1  LYS  39           HZ1      LYS  39  80.055   6.505  16.870
  319    HZ2  LYS  39           HZ2      LYS  39  79.075   5.194  16.415
  320    HZ3  LYS  39           HZ3      LYS  39  78.366   6.669  16.872
  321    H    SER  40           HN       SER  40  82.551   4.878  12.570
  322    HA   SER  40           HA       SER  40  82.180   2.574  12.375
  323    HG   SER  40           HG       SER  40  79.553   1.301  10.577
  324    HB2  SER  40           HB2      SER  40  79.973   3.543  11.333
  325    HB3  SER  40           HB1      SER  40  80.679   3.025   9.806
  326    H    LYS  41           HN       LYS  41  84.494   2.411  11.883
  327    HA   LYS  41           HA       LYS  41  84.932   1.352   9.145
  328    HB2  LYS  41           HB2      LYS  41  87.154   2.621   9.103
  329    HB3  LYS  41           HB1      LYS  41  85.703   3.585   8.832
  330    HG2  LYS  41           HG2      LYS  41  86.547   3.279  11.663
  331    HG3  LYS  41           HG1      LYS  41  87.600   4.261  10.645
  332    HD2  LYS  41           HD2      LYS  41  85.864   5.783  10.119
  333    HD3  LYS  41           HD1      LYS  41  84.610   4.673  10.672
  334    HE2  LYS  41           HE2      LYS  41  85.352   6.680  12.210
  335    HE3  LYS  41           HE1      LYS  41  85.037   5.098  12.923
  336    HZ1  LYS  41           HZ1      LYS  41  87.732   5.486  11.950
  337    HZ2  LYS  41           HZ2      LYS  41  87.187   4.790  13.401
  338    HZ3  LYS  41           HZ3      LYS  41  87.305   6.479  13.257
  339    HA   PRO  42           HA       PRO  42  87.081  -1.174  12.333
  340    HB2  PRO  42           HB2      PRO  42  85.790  -3.506  11.901
  341    HB3  PRO  42           HB1      PRO  42  85.056  -2.202  12.855
  342    HG2  PRO  42           HG2      PRO  42  84.471  -3.076  10.092
  343    HG3  PRO  42           HG1      PRO  42  83.397  -2.373  11.310
  344    HD2  PRO  42           HD2      PRO  42  84.627  -1.001   9.147
  345    HD3  PRO  42           HD1      PRO  42  83.743  -0.269  10.504
  346    HA   PRO  43           HA       PRO  43  90.110  -3.018   9.684
  347    HB2  PRO  43           HB2      PRO  43  90.381  -5.554  10.884
  348    HB3  PRO  43           HB1      PRO  43  91.265  -4.088  11.340
  349    HG2  PRO  43           HG2      PRO  43  88.888  -5.326  12.595
  350    HG3  PRO  43           HG1      PRO  43  90.222  -4.426  13.334
  351    HD2  PRO  43           HD2      PRO  43  87.767  -3.321  12.989
  352    HD3  PRO  43           HD1      PRO  43  89.257  -2.354  12.880
  353    H    LYS  44           HN       LYS  44  89.675  -3.752   7.657
  354    HA   LYS  44           HA       LYS  44  87.896  -6.141   7.353
  355    HB2  LYS  44           HB2      LYS  44  86.911  -5.099   5.359
  356    HB3  LYS  44           HB1      LYS  44  86.670  -4.059   6.765
  357    HG2  LYS  44           HG2      LYS  44  88.926  -2.962   6.016
  358    HG3  LYS  44           HG1      LYS  44  88.566  -3.704   4.457
  359    HD2  LYS  44           HD2      LYS  44  86.271  -2.621   4.600
  360    HD3  LYS  44           HD1      LYS  44  86.878  -1.707   5.981
  361    HE2  LYS  44           HE2      LYS  44  87.767  -1.584   3.105
  362    HE3  LYS  44           HE1      LYS  44  87.287  -0.262   4.169
  363    HZ1  LYS  44           HZ1      LYS  44  89.308  -0.988   5.547
  364    HZ2  LYS  44           HZ2      LYS  44  89.578  -0.105   4.121
  365    HZ3  LYS  44           HZ3      LYS  44  89.810  -1.788   4.138
  366    H    LYS  45           HN       LYS  45  90.383  -4.084   5.831
  367    HA   LYS  45           HA       LYS  45  92.078  -6.224   5.096
  368    HB2  LYS  45           HB2      LYS  45  89.769  -5.898   3.362
  369    HB3  LYS  45           HB1      LYS  45  91.251  -5.602   2.460
  370    HG2  LYS  45           HG2      LYS  45  91.092  -7.984   4.285
  371    HG3  LYS  45           HG1      LYS  45  90.340  -8.064   2.692
  372    HD2  LYS  45           HD2      LYS  45  93.113  -6.980   2.823
  373    HD3  LYS  45           HD1      LYS  45  92.916  -8.714   3.082
  374    HE2  LYS  45           HE2      LYS  45  93.261  -7.932   0.652
  375    HE3  LYS  45           HE1      LYS  45  91.916  -9.031   0.954
  376    HZ1  LYS  45           HZ1      LYS  45  91.749  -6.074   0.736
  377    HZ2  LYS  45           HZ2      LYS  45  90.446  -7.101   1.104
  378    HZ3  LYS  45           HZ3      LYS  45  91.204  -7.196  -0.414
  379    H    GLY  46           HN       GLY  46  90.984  -3.559   2.984
  380    HA2  GLY  46           HA2      GLY  46  93.222  -1.857   3.806
  381    HA3  GLY  46           HA1      GLY  46  93.407  -2.548   2.193
  382    H    VAL  47           HN       VAL  47  93.309   0.048   2.010
  383    HA   VAL  47           HA       VAL  47  92.087   1.935   1.309
  384    HB   VAL  47           HB       VAL  47  90.542  -0.344   0.043
  385   HG11  VAL  47          HG11      VAL  47  90.341   2.653  -0.311
  386   HG12  VAL  47          HG12      VAL  47  89.042   1.511   0.034
  387   HG13  VAL  47          HG13      VAL  47  89.808   1.521  -1.554
  388   HG21  VAL  47          HG21      VAL  47  92.898  -0.143  -0.646
  389   HG22  VAL  47          HG22      VAL  47  92.656   1.567  -1.005
  390   HG23  VAL  47          HG23      VAL  47  91.830   0.339  -1.965
  391    H    GLN  48           HN       GLN  48  91.250   2.758   3.237
  392    HA   GLN  48           HA       GLN  48  88.748   1.616   4.319
  393    HB2  GLN  48           HB2      GLN  48  90.732   2.439   5.736
  394    HB3  GLN  48           HB1      GLN  48  90.185   4.069   5.339
  395    HG2  GLN  48           HG2      GLN  48  87.992   3.612   6.304
  396    HG3  GLN  48           HG1      GLN  48  88.447   1.935   6.613
  397   HE21  GLN  48          HE21      GLN  48  90.276   1.596   8.201
  398   HE22  GLN  48          HE22      GLN  48  90.524   2.749   9.422
  399    H    GLY  49           HN       GLY  49  88.040   2.504   1.915
  400    HA2  GLY  49           HA2      GLY  49  86.916   4.203   0.681
  401    HA3  GLY  49           HA1      GLY  49  85.891   4.133   2.111
  402    H1U  RCY  50           H1U      RCY  50  83.132   2.236   6.144
  403    H1S  RCY  50           H1S      RCY  50  85.395   6.523   6.305
  404    HB1  RCY  50           HB1      RCY  50  85.616   8.576   4.353
  405    HB2  RCY  50           HB2      RCY  50  87.302   9.068   4.265
  406    HA   RCY  50           HA       RCY  50  85.810   8.697   2.056
  407    HN1  RCY  50           HN1      RCY  50  85.392   6.360   1.991
  408    H    GLY  51           HN       GLY  51  87.369   7.960   0.070
  409    HA2  GLY  51           HA2      GLY  51  90.177   8.079   0.353
  410    HA3  GLY  51           HA1      GLY  51  89.307   8.571  -1.101
  411    H    ASP  52           HN       ASP  52  87.790  10.693   0.092
  412    HA   ASP  52           HA       ASP  52  89.607  12.540   1.414
  413    HB2  ASP  52           HB2      ASP  52  90.417  12.521  -0.989
  414    HB3  ASP  52           HB1      ASP  52  88.850  13.189  -1.445
  415    H    ASP  53           HN       ASP  53  86.824  11.450   1.567
  416    HA   ASP  53           HA       ASP  53  84.870  12.386   2.518
  417    HB2  ASP  53           HB2      ASP  53  86.464  14.507   2.787
  418    HB3  ASP  53           HB1      ASP  53  85.471  15.127   1.468
  419    H    ILE  54           HN       ILE  54  85.912  12.453  -0.683
  420    HA   ILE  54           HA       ILE  54  83.117  12.968  -1.643
  421    HB   ILE  54           HB       ILE  54  85.775  13.460  -3.018
  422   HG12  ILE  54          HG12      ILE  54  84.367  15.721  -3.319
  423   HG13  ILE  54          HG11      ILE  54  83.586  15.127  -1.854
  424   HG21  ILE  54          HG21      ILE  54  84.523  12.618  -4.794
  425   HG22  ILE  54          HG22      ILE  54  84.088  14.326  -4.851
  426   HG23  ILE  54          HG23      ILE  54  82.993  13.163  -4.105
  427   HD11  ILE  54          HD11      ILE  54  85.832  14.872  -0.801
  428   HD12  ILE  54          HD12      ILE  54  85.478  16.543  -1.240
  429   HD13  ILE  54          HD13      ILE  54  86.559  15.577  -2.245
  430    HA   PRO  55           HA       PRO  55  84.111   8.584  -2.616
  431    HB2  PRO  55           HB2      PRO  55  81.843   7.476  -1.640
  432    HB3  PRO  55           HB1      PRO  55  83.197   7.930  -0.586
  433    HG2  PRO  55           HG2      PRO  55  80.609   9.305  -1.032
  434    HG3  PRO  55           HG1      PRO  55  81.585   9.177   0.439
  435    HD2  PRO  55           HD2      PRO  55  81.511  11.397  -1.282
  436    HD3  PRO  55           HD1      PRO  55  82.750  11.084  -0.047
  437    H    GLY  56           HN       GLY  56  83.652   9.828  -4.814
  438    HA2  GLY  56           HA2      GLY  56  81.436   8.394  -6.116
  439    HA3  GLY  56           HA1      GLY  56  81.314  10.154  -6.151
  440    H    MET  57           HN       MET  57  84.540   9.395  -6.087
  441    HA   MET  57           HA       MET  57  85.105  10.362  -8.683
  442    HB2  MET  57           HB2      MET  57  86.800  10.235  -6.900
  443    HB3  MET  57           HB1      MET  57  86.754   8.473  -6.974
  444    HG2  MET  57           HG2      MET  57  87.761   8.408  -9.095
  445    HG3  MET  57           HG1      MET  57  87.332  10.081  -9.453
  446    HE1  MET  57           HE1      MET  57  89.018   8.361  -6.265
  447    HE2  MET  57           HE2      MET  57  90.695   8.486  -6.791
  448    HE3  MET  57           HE3      MET  57  89.537   7.584  -7.765
  449    H    GLU  58           HN       GLU  58  83.562   7.520  -7.906
  450    HA   GLU  58           HA       GLU  58  83.050   5.597  -9.146
  451    HB2  GLU  58           HB2      GLU  58  82.651   7.490 -10.858
  452    HB3  GLU  58           HB1      GLU  58  84.210   7.030 -11.540
  453    HG2  GLU  58           HG2      GLU  58  83.429   4.757 -11.919
  454    HG3  GLU  58           HG1      GLU  58  81.901   5.113 -11.112
  455    H    GLY  59           HN       GLY  59  84.945   4.692  -7.884
  456    HA2  GLY  59           HA2      GLY  59  86.821   3.441  -9.765
  457    HA3  GLY  59           HA1      GLY  59  87.578   4.481  -8.555
  458    H1U  RCY  60           H1U      RCY  60  77.733   2.963  -4.073
  459    H1S  RCY  60           H1S      RCY  60  80.638   0.872  -6.203
  460    HB1  RCY  60           HB1      RCY  60  84.155   2.616  -4.757
  461    HB2  RCY  60           HB2      RCY  60  83.885   0.875  -4.671
  462    HA   RCY  60           HA       RCY  60  86.182   1.473  -5.477
  463    HN1  RCY  60           HN1      RCY  60  84.724   3.124  -7.380
  464    H    GLY  61           HN       GLY  61  87.142  -0.298  -6.467
  465    HA2  GLY  61           HA2      GLY  61  85.670  -1.886  -8.445
  466    HA3  GLY  61           HA1      GLY  61  87.286  -2.238  -7.828
  467    H    THR  62           HN       THR  62  87.467  -3.314  -5.763
  468    HA   THR  62           HA       THR  62  84.976  -4.790  -4.993
  469    HB   THR  62           HB       THR  62  86.524  -6.393  -5.807
  470    HG1  THR  62           HG1      THR  62  86.796  -7.580  -4.030
  471   HG21  THR  62          HG21      THR  62  88.617  -4.885  -4.217
  472   HG22  THR  62          HG22      THR  62  88.484  -4.960  -5.974
  473   HG23  THR  62          HG23      THR  62  88.908  -6.407  -5.059
  474    H    ASP  63           HN       ASP  63  84.978  -2.477  -3.761
  475    HA   ASP  63           HA       ASP  63  86.644  -2.243  -1.424
  476    HB2  ASP  63           HB2      ASP  63  84.804  -0.654  -0.658
  477    HB3  ASP  63           HB1      ASP  63  85.539  -0.264  -2.213
  478    H    ILE  64           HN       ILE  64  86.178  -4.751  -1.079
  479    HA   ILE  64           HA       ILE  64  85.132  -6.429   0.190
  480    HB   ILE  64           HB       ILE  64  84.455  -4.169   2.071
  481   HG12  ILE  64          HG12      ILE  64  86.849  -4.102   1.120
  482   HG13  ILE  64          HG11      ILE  64  86.693  -4.163   2.876
  483   HG21  ILE  64          HG21      ILE  64  83.629  -6.397   2.679
  484   HG22  ILE  64          HG22      ILE  64  84.936  -5.924   3.764
  485   HG23  ILE  64          HG23      ILE  64  85.244  -7.073   2.462
  486   HD11  ILE  64          HD11      ILE  64  87.473  -6.324   3.010
  487   HD12  ILE  64          HD12      ILE  64  88.310  -5.834   1.537
  488   HD13  ILE  64          HD13      ILE  64  86.818  -6.769   1.434
  489    H    THR  65           HN       THR  65  83.413  -6.861  -1.235
  490    HA   THR  65           HA       THR  65  80.874  -5.403  -0.790
  491    HB   THR  65           HB       THR  65  81.028  -7.737  -2.643
  492    HG1  THR  65           HG1      THR  65  81.934  -5.915  -4.117
  493   HG21  THR  65          HG21      THR  65  79.448  -6.539  -3.842
  494   HG22  THR  65          HG22      THR  65  80.100  -4.978  -3.343
  495   HG23  THR  65          HG23      THR  65  79.136  -5.933  -2.216
  496    H    VAL  66           HN       VAL  66  82.010  -8.791  -0.874
  497    HA   VAL  66           HA       VAL  66  79.811 -10.145   0.085
  498    HB   VAL  66           HB       VAL  66  81.706 -11.432   1.510
  499   HG11  VAL  66          HG11      VAL  66  82.251 -12.652  -0.598
  500   HG12  VAL  66          HG12      VAL  66  81.462 -11.367  -1.513
  501   HG13  VAL  66          HG13      VAL  66  80.520 -12.369  -0.409
  502   HG21  VAL  66          HG21      VAL  66  83.279  -9.471   1.041
  503   HG22  VAL  66          HG22      VAL  66  83.291 -10.007  -0.640
  504   HG23  VAL  66          HG23      VAL  66  83.902 -11.068   0.629
  505    H    ILE  67           HN       ILE  67  82.314  -8.802   2.281
  506    HA   ILE  67           HA       ILE  67  80.133  -8.239   4.242
  507    HB   ILE  67           HB       ILE  67  82.756  -9.652   4.806
  508   HG12  ILE  67          HG12      ILE  67  80.867 -11.048   3.964
  509   HG13  ILE  67          HG11      ILE  67  81.300 -11.442   5.628
  510   HG21  ILE  67          HG21      ILE  67  81.647  -9.666   7.189
  511   HG22  ILE  67          HG22      ILE  67  80.788  -8.247   6.591
  512   HG23  ILE  67          HG23      ILE  67  82.550  -8.246   6.661
  513   HD11  ILE  67          HD11      ILE  67  79.461  -9.510   6.083
  514   HD12  ILE  67          HD12      ILE  67  79.045 -11.219   5.960
  515   HD13  ILE  67          HD13      ILE  67  78.841 -10.159   4.565
  516    H1U  RCY  68           H1U      RCY  68  77.071  -1.313  -0.729
  517    H1S  RCY  68           H1S      RCY  68  79.581  -0.545   2.710
  518    HB1  RCY  68           HB1      RCY  68  80.906  -4.289   2.292
  519    HB2  RCY  68           HB2      RCY  68  82.268  -3.213   2.596
  520    HA   RCY  68           HA       RCY  68  82.958  -4.719   4.142
  521    HN1  RCY  68           HN1      RCY  68  80.345  -6.033   3.651
  522    HA   PRO  69           HA       PRO  69  82.271  -2.803   8.052
  523    HB2  PRO  69           HB2      PRO  69  81.585  -0.234   6.657
  524    HB3  PRO  69           HB1      PRO  69  82.676  -0.510   8.029
  525    HG2  PRO  69           HG2      PRO  69  83.616  -0.153   5.567
  526    HG3  PRO  69           HG1      PRO  69  84.375  -1.299   6.685
  527    HD2  PRO  69           HD2      PRO  69  82.729  -1.850   4.270
  528    HD3  PRO  69           HD1      PRO  69  83.969  -2.860   5.045
  529    H    TRP  70           HN       TRP  70  79.806  -1.962   5.632
  530    HA   TRP  70           HA       TRP  70  77.766  -1.124   7.415
  531    HD1  TRP  70           HD1      TRP  70  75.016  -0.819   6.922
  532    HE1  TRP  70           HE1      TRP  70  72.871  -2.206   6.583
  533    HE3  TRP  70           HE3      TRP  70  76.740  -4.318   3.626
  534    HZ2  TRP  70           HZ2      TRP  70  71.999  -4.501   5.107
  535    HZ3  TRP  70           HZ3      TRP  70  75.236  -6.088   2.772
  536    HH2  TRP  70           HH2      TRP  70  72.871  -6.186   3.505
  537    HB2  TRP  70           HB2      TRP  70  77.264  -0.711   5.172
  538    HB3  TRP  70           HB1      TRP  70  77.783  -2.314   4.656
  539    H    GLU  71           HN       GLU  71  78.585  -4.398   6.243
  540    HA   GLU  71           HA       GLU  71  76.420  -5.762   7.479
  541    HB2  GLU  71           HB2      GLU  71  79.192  -6.539   6.617
  542    HB3  GLU  71           HB1      GLU  71  78.229  -7.686   7.549
  543    HG2  GLU  71           HG2      GLU  71  76.859  -6.349   5.271
  544    HG3  GLU  71           HG1      GLU  71  78.096  -7.538   4.859
  545    H    ALA  72           HN       ALA  72  78.947  -4.029   8.888
  546    HA   ALA  72           HA       ALA  72  79.312  -5.629  11.280
  547    HB1  ALA  72           HB1      ALA  72  80.916  -3.854  10.402
  548    HB2  ALA  72           HB2      ALA  72  80.555  -3.757  12.126
  549    HB3  ALA  72           HB3      ALA  72  79.774  -2.649  10.998
  550    H1U  RCY  73           H1U      RCY  73  78.603  -1.914   6.578
  551    H1S  RCY  73           H1S      RCY  73  75.189  -0.086   9.142
  552    HB1  RCY  73           HB1      RCY  73  73.997  -1.772  11.397
  553    HB2  RCY  73           HB2      RCY  73  75.081  -2.111  10.048
  554    HA   RCY  73           HA       RCY  73  76.067  -2.425  12.873
  555    HN1  RCY  73           HN1      RCY  73  77.142  -3.035  10.291
  556    H    ASN  74           HN       ASN  74  74.903  -4.644  10.319
  557    HA   ASN  74           HA       ASN  74  73.548  -6.547  10.477
  558    HB2  ASN  74           HB2      ASN  74  75.252  -6.948  12.422
  559    HB3  ASN  74           HB1      ASN  74  73.901  -6.518  13.469
  560   HD21  ASN  74          HD21      ASN  74  74.478  -8.623  10.584
  561   HD22  ASN  74          HD22      ASN  74  73.526  -9.907  11.156
  562    H    HIS  75           HN       HIS  75  71.793  -5.000   9.928
  563    HA   HIS  75           HA       HIS  75  69.642  -5.173  11.899
  564    HD1  HIS  75           HD1      HIS  75  68.096  -4.247  13.193
  565    HD2  HIS  75           HD2      HIS  75  71.458  -2.025  14.270
  566    HE1  HIS  75           HE1      HIS  75  68.016  -4.004  15.713
  567    HE2  HIS  75           HE2      HIS  75  70.058  -2.654  16.382
  568    HB2  HIS  75           HB2      HIS  75  71.214  -2.728  11.603
  569    HB3  HIS  75           HB1      HIS  75  69.515  -2.441  11.241
  570    H1U  RCY  76           H1U      RCY  76  72.953  -5.226   2.833
  571    H1S  RCY  76           H1S      RCY  76  70.809  -2.805   5.230
  572    HB1  RCY  76           HB1      RCY  76  68.667  -5.098   5.858
  573    HB2  RCY  76           HB2      RCY  76  70.151  -5.685   6.607
  574    HA   RCY  76           HA       RCY  76  67.546  -5.084   8.041
  575    HN1  RCY  76           HN1      RCY  76  69.776  -6.381   9.451
  576    H    GLU  77           HN       GLU  77  66.209  -6.623   7.214
  577    HA   GLU  77           HA       GLU  77  66.758  -9.416   7.727
  578    HB2  GLU  77           HB2      GLU  77  64.571  -9.799   6.659
  579    HB3  GLU  77           HB1      GLU  77  64.474  -8.464   7.808
  580    HG2  GLU  77           HG2      GLU  77  64.865  -6.885   5.880
  581    HG3  GLU  77           HG1      GLU  77  64.706  -8.267   4.795
  582    H    LEU  78           HN       LEU  78  65.480 -10.388   5.242
  583    HA   LEU  78           HA       LEU  78  66.154 -11.215   3.157
  584    HG   LEU  78           HG       LEU  78  67.351 -10.772   1.110
  585    HB2  LEU  78           HB2      LEU  78  66.221  -8.595   2.836
  586    HB3  LEU  78           HB1      LEU  78  67.967  -8.839   2.815
  587   HD11  LEU  78          HD11      LEU  78  65.129  -8.809   0.535
  588   HD12  LEU  78          HD12      LEU  78  64.859 -10.240   1.529
  589   HD13  LEU  78          HD13      LEU  78  65.374 -10.416  -0.148
  590   HD21  LEU  78          HD21      LEU  78  67.491  -9.026  -0.740
  591   HD22  LEU  78          HD22      LEU  78  68.769  -8.940   0.472
  592   HD23  LEU  78          HD23      LEU  78  67.424  -7.800   0.526
  593    H    HIS  79           HN       HIS  79  68.156 -11.998   1.969
  594    HA   HIS  79           HA       HIS  79  70.100 -12.961   3.945
  595    HD1  HIS  79           HD1      HIS  79  72.817 -13.601   2.199
  596    HD2  HIS  79           HD2      HIS  79  70.065 -16.638   2.974
  597    HE1  HIS  79           HE1      HIS  79  74.155 -15.581   3.040
  598    HE2  HIS  79           HE2      HIS  79  72.491 -17.436   3.516
  599    HB2  HIS  79           HB2      HIS  79  69.059 -14.283   1.954
  600    HB3  HIS  79           HB1      HIS  79  70.267 -13.452   0.975
  601    H    GLU  80           HN       GLU  80  71.992 -12.980   1.423
  602    HA   GLU  80           HA       GLU  80  72.899 -10.158   1.519
  603    HB2  GLU  80           HB2      GLU  80  74.002 -11.783   3.319
  604    HB3  GLU  80           HB1      GLU  80  74.967 -12.295   1.936
  605    HG2  GLU  80           HG2      GLU  80  76.189 -10.507   2.929
  606    HG3  GLU  80           HG1      GLU  80  75.408  -9.807   1.511
  607    H    LEU  81           HN       LEU  81  74.420 -13.207   0.451
  608    HA   LEU  81           HA       LEU  81  75.386 -12.216  -1.987
  609    HG   LEU  81           HG       LEU  81  74.548 -16.338  -1.293
  610    HB2  LEU  81           HB2      LEU  81  75.642 -14.504  -2.707
  611    HB3  LEU  81           HB1      LEU  81  75.980 -14.437  -0.984
  612   HD11  LEU  81          HD11      LEU  81  72.656 -14.113  -0.509
  613   HD12  LEU  81          HD12      LEU  81  73.960 -14.657   0.546
  614   HD13  LEU  81          HD13      LEU  81  72.678 -15.775   0.080
  615   HD21  LEU  81          HD21      LEU  81  72.278 -14.892  -2.498
  616   HD22  LEU  81          HD22      LEU  81  72.937 -16.480  -2.894
  617   HD23  LEU  81          HD23      LEU  81  73.686 -15.025  -3.551
  618    H    ALA  82           HN       ALA  82  72.173 -12.572  -1.080
  619    HA   ALA  82           HA       ALA  82  71.000 -13.316  -3.602
  620    HB1  ALA  82           HB1      ALA  82  68.913 -12.531  -2.648
  621    HB2  ALA  82           HB2      ALA  82  69.773 -11.591  -1.429
  622    HB3  ALA  82           HB3      ALA  82  69.817 -13.352  -1.376
  623    H    GLN  83           HN       GLN  83  69.182 -10.835  -3.477
  624    HA   GLN  83           HA       GLN  83  69.035  -8.807  -4.642
  625    HB2  GLN  83           HB2      GLN  83  71.981  -8.386  -4.190
  626    HB3  GLN  83           HB1      GLN  83  70.674  -7.203  -4.169
  627    HG2  GLN  83           HG2      GLN  83  69.789  -8.539  -2.123
  628    HG3  GLN  83           HG1      GLN  83  71.415  -9.221  -2.056
  629   HE21  GLN  83          HE21      GLN  83  69.727  -6.039  -2.150
  630   HE22  GLN  83          HE22      GLN  83  70.908  -5.219  -1.249
  631    H    TYR  84           HN       TYR  84  70.833 -11.380  -5.662
  632    HA   TYR  84           HA       TYR  84  71.504 -12.071  -7.797
  633    HD1  TYR  84           HD1      TYR  84  69.167 -12.937  -8.485
  634    HD2  TYR  84           HD2      TYR  84  68.489  -8.731  -7.935
  635    HE1  TYR  84           HE1      TYR  84  66.868 -13.412  -7.684
  636    HE2  TYR  84           HE2      TYR  84  66.191  -9.206  -7.134
  637    HH   TYR  84           HH       TYR  84  64.488 -11.350  -7.605
  638    HB2  TYR  84           HB2      TYR  84  70.492  -9.451  -8.898
  639    HB3  TYR  84           HB1      TYR  84  70.543 -11.029  -9.683
  640    H    GLY  85           HN       GLY  85  72.858  -9.695  -6.071
  641    HA2  GLY  85           HA2      GLY  85  75.293  -9.721  -7.640
  642    HA3  GLY  85           HA1      GLY  85  74.491  -8.154  -7.721
  643    H    ILE  86           HN       ILE  86  74.006  -9.910  -4.807
  644    HA   ILE  86           HA       ILE  86  74.543  -9.308  -2.609
  645    HB   ILE  86           HB       ILE  86  76.503 -10.705  -3.487
  646   HG12  ILE  86          HG12      ILE  86  76.061  -9.478  -1.061
  647   HG13  ILE  86          HG11      ILE  86  77.324 -10.672  -1.365
  648   HG21  ILE  86          HG21      ILE  86  77.627  -7.910  -3.742
  649   HG22  ILE  86          HG22      ILE  86  77.592  -9.183  -4.962
  650   HG23  ILE  86          HG23      ILE  86  78.664  -9.326  -3.570
  651   HD11  ILE  86          HD11      ILE  86  78.117  -8.505  -0.295
  652   HD12  ILE  86          HD12      ILE  86  77.726  -7.707  -1.818
  653   HD13  ILE  86          HD13      ILE  86  78.959  -8.966  -1.774
  654    H1U  RCY  87           H1U      RCY  87  78.591  -1.881   5.659
  655    H1S  RCY  87           H1S      RCY  87  75.668  -3.107   1.965
  656    HB1  RCY  87           HB1      RCY  87  76.040  -6.146   0.330
  657    HB2  RCY  87           HB2      RCY  87  74.706  -5.011   0.173
  658    HA   RCY  87           HA       RCY  87  74.829  -4.982  -2.123
  659    HN1  RCY  87           HN1      RCY  87  75.428  -7.597  -1.171
  Start of MODEL   93
    1    HA   MET   1           HA       MET   1  95.764   1.167  13.399
    2    HB2  MET   1           HB2      MET   1  95.136  -1.147  12.442
    3    HB3  MET   1           HB1      MET   1  93.461  -0.614  12.589
    4    HG2  MET   1           HG2      MET   1  94.109  -0.030  10.372
    5    HG3  MET   1           HG1      MET   1  94.171   1.477  11.286
    6    HE1  MET   1           HE1      MET   1  95.700  -0.319   8.674
    7    HE2  MET   1           HE2      MET   1  97.150   0.663   8.479
    8    HE3  MET   1           HE3      MET   1  95.576   1.443   8.615
    9    H    ASN   2           HN       ASN   2  94.993   3.083  14.263
   10    HA   ASN   2           HA       ASN   2  93.440   4.766  14.762
   11    HB2  ASN   2           HB2      ASN   2  92.632   3.907  12.433
   12    HB3  ASN   2           HB1      ASN   2  91.336   3.135  13.347
   13   HD21  ASN   2          HD21      ASN   2  92.931   6.366  13.074
   14   HD22  ASN   2          HD22      ASN   2  91.499   7.251  13.296
   15    H    LEU   3           HN       LEU   3  91.810   5.211  16.330
   16    HA   LEU   3           HA       LEU   3  91.536   3.359  18.444
   17    HG   LEU   3           HG       LEU   3  92.370   5.752  18.409
   18    HB2  LEU   3           HB2      LEU   3  89.479   5.490  17.839
   19    HB3  LEU   3           HB1      LEU   3  89.979   4.874  19.413
   20   HD11  LEU   3          HD11      LEU   3  90.937   6.695  16.462
   21   HD12  LEU   3          HD12      LEU   3  92.110   7.773  17.218
   22   HD13  LEU   3          HD13      LEU   3  90.400   7.900  17.633
   23   HD21  LEU   3          HD21      LEU   3  90.313   7.376  19.943
   24   HD22  LEU   3          HD22      LEU   3  92.047   7.696  19.907
   25   HD23  LEU   3          HD23      LEU   3  91.439   6.216  20.649
   26    H    GLU   4           HN       GLU   4  89.728   2.066  19.116
   27    HA   GLU   4           HA       GLU   4  88.500   0.509  17.094
   28    HB2  GLU   4           HB2      GLU   4  88.178   0.864  20.026
   29    HB3  GLU   4           HB1      GLU   4  86.787   0.175  19.194
   30    HG2  GLU   4           HG2      GLU   4  88.077  -1.642  18.334
   31    HG3  GLU   4           HG1      GLU   4  89.597  -0.868  18.785
   32    HA   PRO   5           HA       PRO   5  85.004   2.486  15.303
   33    HB2  PRO   5           HB2      PRO   5  83.335   0.696  17.054
   34    HB3  PRO   5           HB1      PRO   5  83.144   1.068  15.330
   35    HG2  PRO   5           HG2      PRO   5  84.283  -1.204  16.198
   36    HG3  PRO   5           HG1      PRO   5  84.765  -0.408  14.693
   37    HD2  PRO   5           HD2      PRO   5  86.284  -0.688  17.190
   38    HD3  PRO   5           HD1      PRO   5  86.855  -0.194  15.582
   39    HA   PRO   6           HA       PRO   6  83.784   5.651  18.152
   40    HB2  PRO   6           HB2      PRO   6  81.345   6.407  17.084
   41    HB3  PRO   6           HB1      PRO   6  82.919   6.899  16.432
   42    HG2  PRO   6           HG2      PRO   6  81.079   4.756  15.507
   43    HG3  PRO   6           HG1      PRO   6  82.082   5.872  14.564
   44    HD2  PRO   6           HD2      PRO   6  82.791   3.273  14.977
   45    HD3  PRO   6           HD1      PRO   6  83.993   4.572  14.803
   46    H    LYS   7           HN       LYS   7  82.292   6.127  19.890
   47    HA   LYS   7           HA       LYS   7  80.798   3.739  20.803
   48    HB2  LYS   7           HB2      LYS   7  81.540   6.343  22.168
   49    HB3  LYS   7           HB1      LYS   7  80.606   5.062  22.940
   50    HG2  LYS   7           HG2      LYS   7  82.412   3.607  23.030
   51    HG3  LYS   7           HG1      LYS   7  83.210   4.348  21.641
   52    HD2  LYS   7           HD2      LYS   7  84.396   4.877  23.749
   53    HD3  LYS   7           HD1      LYS   7  83.748   6.333  22.991
   54    HE2  LYS   7           HE2      LYS   7  83.323   6.223  25.463
   55    HE3  LYS   7           HE1      LYS   7  81.850   6.344  24.501
   56    HZ1  LYS   7           HZ1      LYS   7  82.066   4.563  26.371
   57    HZ2  LYS   7           HZ2      LYS   7  82.891   3.685  25.173
   58    HZ3  LYS   7           HZ3      LYS   7  81.288   4.183  24.912
   59    H    ALA   8           HN       ALA   8  78.979   3.917  19.347
   60    HA   ALA   8           HA       ALA   8  76.717   5.259  20.358
   61    HB1  ALA   8           HB1      ALA   8  76.577   6.952  18.320
   62    HB2  ALA   8           HB2      ALA   8  78.336   6.841  18.388
   63    HB3  ALA   8           HB3      ALA   8  77.433   7.401  19.795
   64    H    GLU   9           HN       GLU   9  76.073   3.067  19.726
   65    HA   GLU   9           HA       GLU   9  75.142   2.987  16.903
   66    HB2  GLU   9           HB2      GLU   9  76.870   0.915  18.264
   67    HB3  GLU   9           HB1      GLU   9  75.820   0.493  16.912
   68    HG2  GLU   9           HG2      GLU   9  77.845   2.742  16.797
   69    HG3  GLU   9           HG1      GLU   9  78.194   1.098  16.260
   70    H1U  RCY  10           H1U      RCY  10  77.516   0.929  17.987
   71    H1S  RCY  10           H1S      RCY  10  74.907   3.408  20.223
   72    HB1  RCY  10           HB1      RCY  10  71.388   1.247  21.276
   73    HB2  RCY  10           HB2      RCY  10  71.628   2.051  19.725
   74    HA   RCY  10           HA       RCY  10  73.403  -0.012  21.044
   75    HN1  RCY  10           HN1      RCY  10  75.168   1.065  19.933
   76    H    ARG  11           HN       ARG  11  73.198  -2.000  20.028
   77    HA   ARG  11           HA       ARG  11  72.025  -2.264  17.376
   78    HE   ARG  11           HE       ARG  11  71.768  -6.513  15.405
   79    HB2  ARG  11           HB2      ARG  11  73.713  -3.862  18.346
   80    HB3  ARG  11           HB1      ARG  11  72.468  -4.420  19.462
   81    HG2  ARG  11           HG2      ARG  11  71.776  -5.857  17.868
   82    HG3  ARG  11           HG1      ARG  11  71.265  -4.465  16.912
   83    HD2  ARG  11           HD2      ARG  11  73.564  -4.306  15.969
   84    HD3  ARG  11           HD1      ARG  11  74.009  -5.757  16.868
   85   HH11  ARG  11          HH21      ARG  11  74.848  -5.102  14.770
   86   HH12  ARG  11          HH22      ARG  11  74.990  -5.797  13.190
   87   HH21  ARG  11          HH11      ARG  11  71.935  -7.430  13.345
   88   HH22  ARG  11          HH12      ARG  11  73.340  -7.115  12.384
   89    H    SER  12           HN       SER  12  70.304  -0.853  19.178
   90    HA   SER  12           HA       SER  12  68.224  -2.724  20.064
   91    HG   SER  12           HG       SER  12  68.416   0.595  18.958
   92    HB2  SER  12           HB2      SER  12  67.188  -0.867  21.037
   93    HB3  SER  12           HB1      SER  12  68.883  -0.389  21.076
   94    H    ALA  13           HN       ALA  13  65.972  -1.056  19.272
   95    HA   ALA  13           HA       ALA  13  65.494  -2.201  16.649
   96    HB1  ALA  13           HB1      ALA  13  63.870  -0.093  18.102
   97    HB2  ALA  13           HB2      ALA  13  63.708  -1.827  18.377
   98    HB3  ALA  13           HB3      ALA  13  63.314  -1.144  16.799
   99    H    THR  14           HN       THR  14  64.296  -0.375  15.095
  100    HA   THR  14           HA       THR  14  65.869   2.099  14.944
  101    HB   THR  14           HB       THR  14  66.048   0.084  12.683
  102    HG1  THR  14           HG1      THR  14  68.400   0.539  13.668
  103   HG21  THR  14          HG21      THR  14  67.187   2.831  13.195
  104   HG22  THR  14          HG22      THR  14  66.275   2.266  11.795
  105   HG23  THR  14          HG23      THR  14  67.934   1.722  12.044
  106    H    ARG  15           HN       ARG  15  63.357   2.380  15.311
  107    HA   ARG  15           HA       ARG  15  61.720   2.081  12.911
  108    HE   ARG  15           HE       ARG  15  58.367  -0.663  14.083
  109    HB2  ARG  15           HB2      ARG  15  61.269   2.601  15.689
  110    HB3  ARG  15           HB1      ARG  15  60.559   3.934  14.783
  111    HG2  ARG  15           HG2      ARG  15  58.842   2.292  14.899
  112    HG3  ARG  15           HG1      ARG  15  59.510   2.136  13.274
  113    HD2  ARG  15           HD2      ARG  15  61.111   0.384  14.387
  114    HD3  ARG  15           HD1      ARG  15  59.879   0.330  15.648
  115   HH11  ARG  15          HH21      ARG  15  61.353   0.359  12.695
  116   HH12  ARG  15          HH22      ARG  15  61.108  -0.495  11.208
  117   HH21  ARG  15          HH11      ARG  15  58.030  -1.784  12.149
  118   HH22  ARG  15          HH12      ARG  15  59.226  -1.708  10.899
  119    H    VAL  16           HN       VAL  16  61.359   3.628  11.358
  120    HA   VAL  16           HA       VAL  16  63.129   5.769  10.950
  121    HB   VAL  16           HB       VAL  16  61.578   4.826   9.228
  122   HG11  VAL  16          HG11      VAL  16  59.266   5.422   9.199
  123   HG12  VAL  16          HG12      VAL  16  59.480   6.599  10.495
  124   HG13  VAL  16          HG13      VAL  16  59.593   4.874  10.844
  125   HG21  VAL  16          HG21      VAL  16  62.713   7.053   8.967
  126   HG22  VAL  16          HG22      VAL  16  61.265   7.819   9.621
  127   HG23  VAL  16          HG23      VAL  16  61.185   6.942   8.093
  128    H    MET  17           HN       MET  17  62.862   8.073  11.229
  129    HA   MET  17           HA       MET  17  60.730   8.944  13.109
  130    HB2  MET  17           HB2      MET  17  63.704   9.065  13.604
  131    HB3  MET  17           HB1      MET  17  62.621  10.246  14.340
  132    HG2  MET  17           HG2      MET  17  62.207   7.256  14.570
  133    HG3  MET  17           HG1      MET  17  63.092   8.202  15.766
  134    HE1  MET  17           HE1      MET  17  61.708   7.428  17.561
  135    HE2  MET  17           HE2      MET  17  60.355   8.402  18.129
  136    HE3  MET  17           HE3      MET  17  61.917   9.162  17.834
  137    H    GLY  18           HN       GLY  18  62.647   9.461  10.388
  138    HA2  GLY  18           HA2      GLY  18  62.975  11.323   8.991
  139    HA3  GLY  18           HA1      GLY  18  61.362  11.792   9.529
  140    H    GLY  19           HN       GLY  19  61.602  13.965   9.948
  141    HA2  GLY  19           HA2      GLY  19  62.137  15.762  11.411
  142    HA3  GLY  19           HA1      GLY  19  63.280  14.708  12.243
  143    HA   PRO  20           HA       PRO  20  65.534  18.038   9.726
  144    HB2  PRO  20           HB2      PRO  20  67.341  17.396  12.035
  145    HB3  PRO  20           HB1      PRO  20  66.997  18.963  11.276
  146    HG2  PRO  20           HG2      PRO  20  65.893  18.270  13.596
  147    HG3  PRO  20           HG1      PRO  20  65.003  19.215  12.391
  148    HD2  PRO  20           HD2      PRO  20  64.647  16.368  13.176
  149    HD3  PRO  20           HD1      PRO  20  63.467  17.507  12.492
  150    H1U  RCY  21           H1U      RCY  21  62.494   9.197   6.889
  151    H1S  RCY  21           H1S      RCY  21  67.043  10.527   5.857
  152    HB1  RCY  21           HB1      RCY  21  65.776  13.716   7.650
  153    HB2  RCY  21           HB2      RCY  21  67.036  13.149   8.745
  154    HA   RCY  21           HA       RCY  21  68.434  14.989   8.287
  155    HN1  RCY  21           HN1      RCY  21  65.774  16.322   8.089
  156    H    THR  22           HN       THR  22  69.365  16.413   6.791
  157    HA   THR  22           HA       THR  22  67.993  16.884   4.220
  158    HB   THR  22           HB       THR  22  70.085  18.279   3.769
  159    HG1  THR  22           HG1      THR  22  71.592  18.311   5.237
  160   HG21  THR  22          HG21      THR  22  69.418  20.000   5.544
  161   HG22  THR  22          HG22      THR  22  68.265  18.798   6.125
  162   HG23  THR  22          HG23      THR  22  68.128  19.431   4.484
  163    HA   PRO  23           HA       PRO  23  69.761  13.566   1.874
  164    HB2  PRO  23           HB2      PRO  23  70.723  15.767   0.075
  165    HB3  PRO  23           HB1      PRO  23  69.885  14.259  -0.342
  166    HG2  PRO  23           HG2      PRO  23  68.617  16.621  -0.239
  167    HG3  PRO  23           HG1      PRO  23  67.825  15.098   0.190
  168    HD2  PRO  23           HD2      PRO  23  68.630  17.329   1.947
  169    HD3  PRO  23           HD1      PRO  23  67.468  16.021   2.252
  170    H    ARG  24           HN       ARG  24  71.708  16.389   2.689
  171    HA   ARG  24           HA       ARG  24  73.980  16.581   3.223
  172    HE   ARG  24           HE       ARG  24  75.087  17.702   4.761
  173    HB2  ARG  24           HB2      ARG  24  73.104  14.076   4.229
  174    HB3  ARG  24           HB1      ARG  24  74.665  13.775   3.469
  175    HG2  ARG  24           HG2      ARG  24  74.105  15.956   5.504
  176    HG3  ARG  24           HG1      ARG  24  74.923  14.431   5.846
  177    HD2  ARG  24           HD2      ARG  24  76.817  15.604   5.380
  178    HD3  ARG  24           HD1      ARG  24  76.360  15.329   3.699
  179   HH11  ARG  24          HH21      ARG  24  78.014  16.355   3.534
  180   HH12  ARG  24          HH22      ARG  24  78.618  17.867   2.942
  181   HH21  ARG  24          HH11      ARG  24  75.858  19.684   3.995
  182   HH22  ARG  24          HH12      ARG  24  77.397  19.752   3.202
  183    H    LYS  25           HN       LYS  25  74.839  17.257   1.256
  184    HA   LYS  25           HA       LYS  25  75.267  15.370  -0.933
  185    HB2  LYS  25           HB2      LYS  25  76.714  17.508  -1.702
  186    HB3  LYS  25           HB1      LYS  25  74.959  17.459  -1.853
  187    HG2  LYS  25           HG2      LYS  25  76.147  18.405   0.731
  188    HG3  LYS  25           HG1      LYS  25  76.142  19.502  -0.650
  189    HD2  LYS  25           HD2      LYS  25  73.620  18.033   0.031
  190    HD3  LYS  25           HD1      LYS  25  74.077  19.432   1.003
  191    HE2  LYS  25           HE2      LYS  25  74.251  20.797  -1.053
  192    HE3  LYS  25           HE1      LYS  25  73.763  19.401  -2.013
  193    HZ1  LYS  25           HZ1      LYS  25  72.175  21.093  -0.251
  194    HZ2  LYS  25           HZ2      LYS  25  71.801  19.436  -0.255
  195    HZ3  LYS  25           HZ3      LYS  25  71.741  20.327  -1.701
  196    H    GLY  26           HN       GLY  26  77.483  17.305   1.116
  197    HA2  GLY  26           HA2      GLY  26  79.854  17.024   1.305
  198    HA3  GLY  26           HA1      GLY  26  79.271  15.546   2.067
  199    HA   PRO  27           HA       PRO  27  81.495  12.841  -0.610
  200    HB2  PRO  27           HB2      PRO  27  78.753  11.840  -1.332
  201    HB3  PRO  27           HB1      PRO  27  80.209  10.916  -0.915
  202    HG2  PRO  27           HG2      PRO  27  78.218  11.372   0.840
  203    HG3  PRO  27           HG1      PRO  27  79.910  11.196   1.325
  204    HD2  PRO  27           HD2      PRO  27  78.224  13.592   1.402
  205    HD3  PRO  27           HD1      PRO  27  79.814  13.320   2.147
  206    HA   PRO  28           HA       PRO  28  81.805  14.417  -4.732
  207    HB2  PRO  28           HB2      PRO  28  80.990  11.661  -5.616
  208    HB3  PRO  28           HB1      PRO  28  82.300  12.694  -6.224
  209    HG2  PRO  28           HG2      PRO  28  82.753  10.680  -4.519
  210    HG3  PRO  28           HG1      PRO  28  83.694  12.178  -4.479
  211    HD2  PRO  28           HD2      PRO  28  81.716  11.183  -2.531
  212    HD3  PRO  28           HD1      PRO  28  82.962  12.433  -2.328
  213    H    LYS  29           HN       LYS  29  80.477  14.850  -6.698
  214    HA   LYS  29           HA       LYS  29  77.717  15.335  -6.020
  215    HB2  LYS  29           HB2      LYS  29  79.054  16.764  -7.572
  216    HB3  LYS  29           HB1      LYS  29  79.046  15.449  -8.744
  217    HG2  LYS  29           HG2      LYS  29  77.120  16.362  -9.519
  218    HG3  LYS  29           HG1      LYS  29  76.367  15.687  -8.073
  219    HD2  LYS  29           HD2      LYS  29  77.662  18.425  -8.173
  220    HD3  LYS  29           HD1      LYS  29  75.934  18.148  -8.393
  221    HE2  LYS  29           HE2      LYS  29  76.029  16.893  -6.144
  222    HE3  LYS  29           HE1      LYS  29  77.606  17.653  -5.928
  223    HZ1  LYS  29           HZ1      LYS  29  75.149  18.763  -5.382
  224    HZ2  LYS  29           HZ2      LYS  29  75.676  19.543  -6.797
  225    HZ3  LYS  29           HZ3      LYS  29  76.645  19.562  -5.401
  226    H1U  RCY  30           H1U      RCY  30  80.279  11.345 -10.699
  227    H1S  RCY  30           H1S      RCY  30  76.291   9.503  -9.403
  228    HB1  RCY  30           HB1      RCY  30  75.158  13.303  -9.531
  229    HB2  RCY  30           HB2      RCY  30  75.195  12.407  -8.015
  230    HA   RCY  30           HA       RCY  30  77.304  11.352  -8.643
  231    HN1  RCY  30           HN1      RCY  30  78.074  14.086  -9.213
  232    H    LYS  31           HN       LYS  31  78.110  10.267 -10.372
  233    HA   LYS  31           HA       LYS  31  78.857  11.651 -12.807
  234    HB2  LYS  31           HB2      LYS  31  78.726   8.676 -12.225
  235    HB3  LYS  31           HB1      LYS  31  79.554   9.422 -13.592
  236    HG2  LYS  31           HG2      LYS  31  81.162  10.465 -12.190
  237    HG3  LYS  31           HG1      LYS  31  80.201  10.178 -10.739
  238    HD2  LYS  31           HD2      LYS  31  80.525   7.730 -11.039
  239    HD3  LYS  31           HD1      LYS  31  81.555   8.058 -12.433
  240    HE2  LYS  31           HE2      LYS  31  83.254   8.990 -11.128
  241    HE3  LYS  31           HE1      LYS  31  82.159   9.374  -9.800
  242    HZ1  LYS  31           HZ1      LYS  31  82.880   7.502  -8.876
  243    HZ2  LYS  31           HZ2      LYS  31  83.635   6.978 -10.305
  244    HZ3  LYS  31           HZ3      LYS  31  81.984   6.666 -10.049
  245    H    GLN  32           HN       GLN  32  78.179  10.185 -14.930
  246    HA   GLN  32           HA       GLN  32  75.242  10.553 -15.090
  247    HB2  GLN  32           HB2      GLN  32  75.742  10.052 -17.583
  248    HB3  GLN  32           HB1      GLN  32  76.333  11.576 -16.922
  249    HG2  GLN  32           HG2      GLN  32  78.114   9.177 -16.746
  250    HG3  GLN  32           HG1      GLN  32  77.945   9.976 -18.309
  251   HE21  GLN  32          HE21      GLN  32  79.045  11.961 -18.608
  252   HE22  GLN  32          HE22      GLN  32  79.922  12.746 -17.385
  253    H    ARG  33           HN       ARG  33  74.557   8.659 -13.948
  254    HA   ARG  33           HA       ARG  33  75.456   6.039 -14.225
  255    HE   ARG  33           HE       ARG  33  71.412   8.918 -12.346
  256    HB2  ARG  33           HB2      ARG  33  73.112   5.337 -13.719
  257    HB3  ARG  33           HB1      ARG  33  73.683   6.623 -12.654
  258    HG2  ARG  33           HG2      ARG  33  72.533   8.302 -14.024
  259    HG3  ARG  33           HG1      ARG  33  72.000   7.046 -15.142
  260    HD2  ARG  33           HD2      ARG  33  70.161   6.828 -13.853
  261    HD3  ARG  33           HD1      ARG  33  71.209   6.113 -12.628
  262   HH11  ARG  33          HH21      ARG  33  69.076   6.389 -12.146
  263   HH12  ARG  33          HH22      ARG  33  68.116   7.190 -10.947
  264   HH21  ARG  33          HH11      ARG  33  70.172   9.978 -10.782
  265   HH22  ARG  33          HH12      ARG  33  68.736   9.222 -10.174
  266    H    GLN  34           HN       GLN  34  74.507   4.232 -15.523
  267    HA   GLN  34           HA       GLN  34  73.117   4.897 -18.003
  268    HB2  GLN  34           HB2      GLN  34  75.544   5.514 -18.435
  269    HB3  GLN  34           HB1      GLN  34  75.931   3.805 -18.227
  270    HG2  GLN  34           HG2      GLN  34  74.124   3.353 -20.001
  271    HG3  GLN  34           HG1      GLN  34  74.201   5.081 -20.349
  272   HE21  GLN  34          HE21      GLN  34  75.228   2.456 -21.790
  273   HE22  GLN  34          HE22      GLN  34  76.808   2.883 -22.241
  274    H    THR  35           HN       THR  35  75.407   2.380 -16.927
  275    HA   THR  35           HA       THR  35  73.207   0.443 -16.673
  276    HB   THR  35           HB       THR  35  73.568   0.183 -19.022
  277    HG1  THR  35           HG1      THR  35  75.122  -1.701 -17.583
  278   HG21  THR  35          HG21      THR  35  75.589   1.415 -19.350
  279   HG22  THR  35          HG22      THR  35  75.936  -0.234 -19.871
  280   HG23  THR  35          HG23      THR  35  76.500   0.332 -18.298
  281    H    ARG  36           HN       ARG  36  74.211  -1.777 -16.047
  282    HA   ARG  36           HA       ARG  36  76.182  -1.255 -13.936
  283    HE   ARG  36           HE       ARG  36  73.048  -4.505 -12.564
  284    HB2  ARG  36           HB2      ARG  36  75.802  -3.638 -13.351
  285    HB3  ARG  36           HB1      ARG  36  74.287  -2.745 -13.482
  286    HG2  ARG  36           HG2      ARG  36  74.555  -3.587 -16.048
  287    HG3  ARG  36           HG1      ARG  36  75.358  -4.912 -15.206
  288    HD2  ARG  36           HD2      ARG  36  72.529  -3.915 -14.814
  289    HD3  ARG  36           HD1      ARG  36  73.048  -5.520 -15.327
  290   HH11  ARG  36          HH21      ARG  36  74.119  -6.826 -14.878
  291   HH12  ARG  36          HH22      ARG  36  74.482  -8.036 -13.693
  292   HH21  ARG  36          HH11      ARG  36  73.516  -6.072 -11.004
  293   HH22  ARG  36          HH12      ARG  36  74.141  -7.609 -11.500
  294    H    GLN  37           HN       GLN  37  77.733  -0.654 -15.857
  295    HA   GLN  37           HA       GLN  37  78.870  -2.754 -17.449
  296    HB2  GLN  37           HB2      GLN  37  79.130  -0.284 -17.876
  297    HB3  GLN  37           HB1      GLN  37  80.243  -0.219 -16.509
  298    HG2  GLN  37           HG2      GLN  37  81.608  -0.477 -18.458
  299    HG3  GLN  37           HG1      GLN  37  81.577  -2.056 -17.672
  300   HE21  GLN  37          HE21      GLN  37  80.340  -0.222 -20.452
  301   HE22  GLN  37          HE22      GLN  37  79.785  -1.574 -21.315
  302    H1U  RCY  38           H1U      RCY  38  81.918   1.573  -7.348
  303    H1S  RCY  38           H1S      RCY  38  81.719  -2.110 -10.500
  304    HB1  RCY  38           HB1      RCY  38  81.671  -3.708 -12.111
  305    HB2  RCY  38           HB2      RCY  38  80.333  -4.012 -13.218
  306    HA   RCY  38           HA       RCY  38  82.420  -1.834 -13.541
  307    HN1  RCY  38           HN1      RCY  38  80.751  -1.011 -14.981
  308    H    LYS  39           HN       LYS  39  83.352  -4.327 -12.936
  309    HA   LYS  39           HA       LYS  39  83.620  -6.029 -15.269
  310    HB2  LYS  39           HB2      LYS  39  85.990  -5.605 -15.720
  311    HB3  LYS  39           HB1      LYS  39  85.064  -4.123 -15.949
  312    HG2  LYS  39           HG2      LYS  39  86.593  -3.175 -14.561
  313    HG3  LYS  39           HG1      LYS  39  85.707  -3.991 -13.272
  314    HD2  LYS  39           HD2      LYS  39  87.195  -5.924 -13.427
  315    HD3  LYS  39           HD1      LYS  39  88.046  -5.189 -14.785
  316    HE2  LYS  39           HE2      LYS  39  88.862  -3.393 -13.398
  317    HE3  LYS  39           HE1      LYS  39  87.844  -3.903 -12.051
  318    HZ1  LYS  39           HZ1      LYS  39  89.606  -5.944 -13.098
  319    HZ2  LYS  39           HZ2      LYS  39  89.253  -5.531 -11.488
  320    HZ3  LYS  39           HZ3      LYS  39  90.397  -4.634 -12.367
  321    H    SER  40           HN       SER  40  84.633  -5.041 -12.065
  322    HA   SER  40           HA       SER  40  85.945  -7.634 -11.539
  323    HG   SER  40           HG       SER  40  87.509  -6.631  -8.976
  324    HB2  SER  40           HB2      SER  40  86.816  -5.481 -10.576
  325    HB3  SER  40           HB1      SER  40  85.341  -5.363  -9.621
  326    H    LYS  41           HN       LYS  41  83.378  -8.166 -12.245
  327    HA   LYS  41           HA       LYS  41  82.220  -9.102  -9.685
  328    HB2  LYS  41           HB2      LYS  41  79.961  -8.314 -10.331
  329    HB3  LYS  41           HB1      LYS  41  81.083  -6.976 -10.098
  330    HG2  LYS  41           HG2      LYS  41  80.528  -6.275 -12.173
  331    HG3  LYS  41           HG1      LYS  41  81.387  -7.686 -12.793
  332    HD2  LYS  41           HD2      LYS  41  79.175  -8.966 -12.321
  333    HD3  LYS  41           HD1      LYS  41  78.438  -7.365 -12.260
  334    HE2  LYS  41           HE2      LYS  41  78.206  -7.979 -14.522
  335    HE3  LYS  41           HE1      LYS  41  79.646  -6.961 -14.523
  336    HZ1  LYS  41           HZ1      LYS  41  80.932  -9.092 -14.223
  337    HZ2  LYS  41           HZ2      LYS  41  80.207  -8.866 -15.742
  338    HZ3  LYS  41           HZ3      LYS  41  79.500  -9.916 -14.609
  339    HA   PRO  42           HA       PRO  42  81.887 -12.410 -12.784
  340    HB2  PRO  42           HB2      PRO  42  81.945 -14.501 -11.058
  341    HB3  PRO  42           HB1      PRO  42  83.409 -13.599 -11.497
  342    HG2  PRO  42           HG2      PRO  42  81.765 -13.437  -9.028
  343    HG3  PRO  42           HG1      PRO  42  83.520 -13.315  -9.229
  344    HD2  PRO  42           HD2      PRO  42  81.801 -11.141  -8.916
  345    HD3  PRO  42           HD1      PRO  42  83.435 -11.053  -9.609
  346    HA   PRO  43           HA       PRO  43  77.499 -13.096 -12.470
  347    HB2  PRO  43           HB2      PRO  43  77.200 -15.272 -14.090
  348    HB3  PRO  43           HB1      PRO  43  77.569 -13.653 -14.716
  349    HG2  PRO  43           HG2      PRO  43  79.396 -15.960 -14.268
  350    HG3  PRO  43           HG1      PRO  43  79.350 -14.798 -15.605
  351    HD2  PRO  43           HD2      PRO  43  81.146 -14.631 -13.533
  352    HD3  PRO  43           HD1      PRO  43  80.581 -13.217 -14.450
  353    H    LYS  44           HN       LYS  44  76.491 -13.930 -10.709
  354    HA   LYS  44           HA       LYS  44  75.856 -16.524 -10.111
  355    HB2  LYS  44           HB2      LYS  44  77.589 -17.092  -8.289
  356    HB3  LYS  44           HB1      LYS  44  78.096 -17.319  -9.958
  357    HG2  LYS  44           HG2      LYS  44  79.616 -15.615  -9.869
  358    HG3  LYS  44           HG1      LYS  44  78.574 -14.610  -8.861
  359    HD2  LYS  44           HD2      LYS  44  80.360 -15.179  -7.425
  360    HD3  LYS  44           HD1      LYS  44  79.087 -16.317  -6.981
  361    HE2  LYS  44           HE2      LYS  44  81.421 -16.863  -8.839
  362    HE3  LYS  44           HE1      LYS  44  81.191 -17.528  -7.221
  363    HZ1  LYS  44           HZ1      LYS  44  80.389 -19.197  -8.563
  364    HZ2  LYS  44           HZ2      LYS  44  79.722 -18.126  -9.700
  365    HZ3  LYS  44           HZ3      LYS  44  78.965 -18.352  -8.196
  366    H    LYS  45           HN       LYS  45  77.616 -15.249  -7.445
  367    HA   LYS  45           HA       LYS  45  76.807 -14.408  -5.402
  368    HB2  LYS  45           HB2      LYS  45  76.771 -12.471  -7.299
  369    HB3  LYS  45           HB1      LYS  45  75.066 -12.477  -6.854
  370    HG2  LYS  45           HG2      LYS  45  75.975 -10.951  -5.323
  371    HG3  LYS  45           HG1      LYS  45  75.965 -12.453  -4.397
  372    HD2  LYS  45           HD2      LYS  45  78.149 -11.771  -4.032
  373    HD3  LYS  45           HD1      LYS  45  78.369 -12.745  -5.486
  374    HE2  LYS  45           HE2      LYS  45  78.195 -10.715  -6.877
  375    HE3  LYS  45           HE1      LYS  45  77.970  -9.738  -5.427
  376    HZ1  LYS  45           HZ1      LYS  45  80.314  -9.961  -6.424
  377    HZ2  LYS  45           HZ2      LYS  45  80.321 -11.494  -5.691
  378    HZ3  LYS  45           HZ3      LYS  45  80.130 -10.097  -4.743
  379    H    GLY  46           HN       GLY  46  74.358 -13.243  -4.716
  380    HA2  GLY  46           HA2      GLY  46  72.734 -15.458  -4.130
  381    HA3  GLY  46           HA1      GLY  46  72.147 -13.795  -4.150
  382    H    VAL  47           HN       VAL  47  70.213 -15.267  -4.946
  383    HA   VAL  47           HA       VAL  47  70.268 -16.234  -7.655
  384    HB   VAL  47           HB       VAL  47  67.706 -15.998  -7.402
  385   HG11  VAL  47          HG11      VAL  47  68.747 -18.132  -7.043
  386   HG12  VAL  47          HG12      VAL  47  67.681 -17.857  -5.666
  387   HG13  VAL  47          HG13      VAL  47  69.419 -17.612  -5.497
  388   HG21  VAL  47          HG21      VAL  47  68.440 -15.527  -4.508
  389   HG22  VAL  47          HG22      VAL  47  66.845 -15.442  -5.256
  390   HG23  VAL  47          HG23      VAL  47  68.045 -14.194  -5.593
  391    H    GLN  48           HN       GLN  48  67.601 -14.214  -7.462
  392    HA   GLN  48           HA       GLN  48  68.978 -12.004  -8.936
  393    HB2  GLN  48           HB2      GLN  48  66.329 -13.257  -9.725
  394    HB3  GLN  48           HB1      GLN  48  67.176 -11.964 -10.574
  395    HG2  GLN  48           HG2      GLN  48  68.361 -14.713 -10.114
  396    HG3  GLN  48           HG1      GLN  48  67.500 -14.258 -11.585
  397   HE21  GLN  48          HE21      GLN  48  68.449 -12.398 -12.853
  398   HE22  GLN  48          HE22      GLN  48  70.119 -12.106 -12.757
  399    H    GLY  49           HN       GLY  49  68.764 -10.924  -6.814
  400    HA2  GLY  49           HA2      GLY  49  66.294 -10.491  -5.486
  401    HA3  GLY  49           HA1      GLY  49  67.680  -9.403  -5.397
  402    H1U  RCY  50           H1U      RCY  50  69.278  -1.962  -5.734
  403    H1S  RCY  50           H1S      RCY  50  68.273  -5.574  -8.698
  404    HB1  RCY  50           HB1      RCY  50  66.688  -6.427  -7.635
  405    HB2  RCY  50           HB2      RCY  50  64.961  -6.291  -7.949
  406    HA   RCY  50           HA       RCY  50  64.927  -8.160  -9.254
  407    HN1  RCY  50           HN1      RCY  50  67.342  -9.381  -8.540
  408    H    GLY  51           HN       GLY  51  68.066  -9.050  -9.803
  409    HA2  GLY  51           HA2      GLY  51  68.985  -7.497 -11.955
  410    HA3  GLY  51           HA1      GLY  51  69.304  -9.223 -11.790
  411    H    ASP  52           HN       ASP  52  66.025  -9.015 -11.817
  412    HA   ASP  52           HA       ASP  52  65.806  -8.962 -14.792
  413    HB2  ASP  52           HB2      ASP  52  64.299 -11.005 -14.584
  414    HB3  ASP  52           HB1      ASP  52  66.017 -11.304 -14.319
  415    H    ASP  53           HN       ASP  53  64.849  -7.486 -12.140
  416    HA   ASP  53           HA       ASP  53  61.928  -7.588 -12.548
  417    HB2  ASP  53           HB2      ASP  53  63.057  -7.344 -10.271
  418    HB3  ASP  53           HB1      ASP  53  63.464  -5.697 -10.753
  419    H    ILE  54           HN       ILE  54  62.043  -4.567 -11.760
  420    HA   ILE  54           HA       ILE  54  62.741  -3.455 -14.438
  421    HB   ILE  54           HB       ILE  54  60.142  -2.823 -13.013
  422   HG12  ILE  54          HG12      ILE  54  59.323  -4.133 -15.196
  423   HG13  ILE  54          HG11      ILE  54  60.870  -4.953 -14.980
  424   HG21  ILE  54          HG21      ILE  54  61.213  -2.232 -15.789
  425   HG22  ILE  54          HG22      ILE  54  60.949  -1.061 -14.497
  426   HG23  ILE  54          HG23      ILE  54  59.574  -1.867 -15.250
  427   HD11  ILE  54          HD11      ILE  54  58.440  -5.011 -13.267
  428   HD12  ILE  54          HD12      ILE  54  59.992  -5.001 -12.429
  429   HD13  ILE  54          HD13      ILE  54  59.622  -6.280 -13.586
  430    HA   PRO  55           HA       PRO  55  64.082  -0.662 -11.029
  431    HB2  PRO  55           HB2      PRO  55  66.737  -0.672 -11.557
  432    HB3  PRO  55           HB1      PRO  55  65.956  -1.971 -10.636
  433    HG2  PRO  55           HG2      PRO  55  66.925  -1.956 -13.427
  434    HG3  PRO  55           HG1      PRO  55  66.819  -3.291 -12.271
  435    HD2  PRO  55           HD2      PRO  55  64.993  -2.730 -14.369
  436    HD3  PRO  55           HD1      PRO  55  64.770  -3.907 -13.057
  437    H    GLY  56           HN       GLY  56  65.269   1.486 -11.230
  438    HA2  GLY  56           HA2      GLY  56  66.021   3.362 -12.510
  439    HA3  GLY  56           HA1      GLY  56  65.597   2.495 -13.985
  440    H    MET  57           HN       MET  57  62.907   1.887 -12.497
  441    HA   MET  57           HA       MET  57  61.430   4.002 -13.768
  442    HB2  MET  57           HB2      MET  57  59.459   3.035 -12.589
  443    HB3  MET  57           HB1      MET  57  60.408   1.812 -13.431
  444    HG2  MET  57           HG2      MET  57  61.663   1.640 -11.105
  445    HG3  MET  57           HG1      MET  57  60.157   2.318 -10.486
  446    HE1  MET  57           HE1      MET  57  57.993   1.627 -11.033
  447    HE2  MET  57           HE2      MET  57  57.443  -0.039 -11.200
  448    HE3  MET  57           HE3      MET  57  57.908   0.877 -12.632
  449    H    GLU  58           HN       GLU  58  61.533   3.239 -10.264
  450    HA   GLU  58           HA       GLU  58  62.425   5.563  -9.149
  451    HB2  GLU  58           HB2      GLU  58  61.047   7.082 -10.275
  452    HB3  GLU  58           HB1      GLU  58  59.674   5.976 -10.296
  453    HG2  GLU  58           HG2      GLU  58  59.138   6.399  -8.043
  454    HG3  GLU  58           HG1      GLU  58  60.742   7.041  -7.687
  455    H    GLY  59           HN       GLY  59  62.698   4.527  -7.219
  456    HA2  GLY  59           HA2      GLY  59  61.797   4.023  -5.018
  457    HA3  GLY  59           HA1      GLY  59  60.249   3.642  -5.774
  458    H1U  RCY  60           H1U      RCY  60  67.583   3.611  -3.394
  459    H1S  RCY  60           H1S      RCY  60  67.198   2.076  -7.973
  460    HB1  RCY  60           HB1      RCY  60  65.055  -0.689  -7.226
  461    HB2  RCY  60           HB2      RCY  60  65.388   0.643  -6.121
  462    HA   RCY  60           HA       RCY  60  62.720  -0.141  -7.315
  463    HN1  RCY  60           HN1      RCY  60  63.442   2.502  -6.806
  464    H    GLY  61           HN       GLY  61  63.041  -2.118  -6.060
  465    HA2  GLY  61           HA2      GLY  61  62.589  -3.395  -4.142
  466    HA3  GLY  61           HA1      GLY  61  63.708  -2.291  -3.341
  467    H    THR  62           HN       THR  62  60.401  -1.952  -4.690
  468    HA   THR  62           HA       THR  62  59.493   0.032  -2.953
  469    HB   THR  62           HB       THR  62  57.332  -0.502  -3.626
  470    HG1  THR  62           HG1      THR  62  56.613  -2.567  -3.840
  471   HG21  THR  62          HG21      THR  62  58.897  -2.100  -5.657
  472   HG22  THR  62          HG22      THR  62  58.998  -0.342  -5.562
  473   HG23  THR  62          HG23      THR  62  57.456  -1.119  -5.922
  474    H    ASP  63           HN       ASP  63  60.374  -3.178  -2.145
  475    HA   ASP  63           HA       ASP  63  58.671  -3.505   0.168
  476    HB2  ASP  63           HB2      ASP  63  61.444  -4.667  -0.242
  477    HB3  ASP  63           HB1      ASP  63  60.159  -5.309   0.782
  478    H    ILE  64           HN       ILE  64  59.573  -0.902   0.102
  479    HA   ILE  64           HA       ILE  64  60.307   0.685   1.668
  480    HB   ILE  64           HB       ILE  64  61.552  -1.610   3.186
  481   HG12  ILE  64          HG12      ILE  64  58.924  -0.190   3.709
  482   HG13  ILE  64          HG11      ILE  64  59.044  -1.753   2.900
  483   HG21  ILE  64          HG21      ILE  64  62.455   0.678   3.641
  484   HG22  ILE  64          HG22      ILE  64  61.625  -0.019   5.033
  485   HG23  ILE  64          HG23      ILE  64  60.822   1.205   4.049
  486   HD11  ILE  64          HD11      ILE  64  60.027  -2.774   4.846
  487   HD12  ILE  64          HD12      ILE  64  58.604  -1.886   5.391
  488   HD13  ILE  64          HD13      ILE  64  60.214  -1.210   5.640
  489    H    THR  65           HN       THR  65  61.557   1.425  -0.051
  490    HA   THR  65           HA       THR  65  64.088   0.402  -0.787
  491    HB   THR  65           HB       THR  65  63.315   1.940  -2.326
  492    HG1  THR  65           HG1      THR  65  64.520   4.019  -1.059
  493   HG21  THR  65          HG21      THR  65  62.489   4.268  -1.386
  494   HG22  THR  65          HG22      THR  65  62.286   3.353   0.108
  495   HG23  THR  65          HG23      THR  65  61.422   2.864  -1.350
  496    H    VAL  66           HN       VAL  66  63.871   3.597   0.723
  497    HA   VAL  66           HA       VAL  66  66.328   3.957   1.730
  498    HB   VAL  66           HB       VAL  66  65.343   4.936   3.821
  499   HG11  VAL  66          HG11      VAL  66  65.370   6.360   1.900
  500   HG12  VAL  66          HG12      VAL  66  63.746   6.495   2.575
  501   HG13  VAL  66          HG13      VAL  66  64.029   5.492   1.152
  502   HG21  VAL  66          HG21      VAL  66  62.863   3.590   2.717
  503   HG22  VAL  66          HG22      VAL  66  62.799   4.887   3.911
  504   HG23  VAL  66          HG23      VAL  66  63.592   3.362   4.307
  505    H    ILE  67           HN       ILE  67  63.987   1.663   3.090
  506    HA   ILE  67           HA       ILE  67  66.301   0.206   4.285
  507    HB   ILE  67           HB       ILE  67  63.762   0.859   5.806
  508   HG12  ILE  67          HG12      ILE  67  66.638   1.670   6.335
  509   HG13  ILE  67          HG11      ILE  67  65.431   2.724   5.596
  510   HG21  ILE  67          HG21      ILE  67  65.066  -0.264   7.682
  511   HG22  ILE  67          HG22      ILE  67  66.176  -0.852   6.445
  512   HG23  ILE  67          HG23      ILE  67  64.483  -1.345   6.418
  513   HD11  ILE  67          HD11      ILE  67  65.408   1.557   8.387
  514   HD12  ILE  67          HD12      ILE  67  63.983   2.292   7.651
  515   HD13  ILE  67          HD13      ILE  67  65.432   3.260   7.928
  516    H1U  RCY  68           H1U      RCY  68  71.371  -1.286   0.703
  517    H1S  RCY  68           H1S      RCY  68  67.775  -2.820  -0.707
  518    HB1  RCY  68           HB1      RCY  68  64.723  -2.105   0.435
  519    HB2  RCY  68           HB2      RCY  68  64.010  -3.714   0.512
  520    HA   RCY  68           HA       RCY  68  63.349  -2.755   2.558
  521    HN1  RCY  68           HN1      RCY  68  65.927  -1.307   2.532
  522    HA   PRO  69           HA       PRO  69  64.622  -5.954   5.311
  523    HB2  PRO  69           HB2      PRO  69  63.878  -8.191   3.711
  524    HB3  PRO  69           HB1      PRO  69  62.902  -7.403   4.961
  525    HG2  PRO  69           HG2      PRO  69  62.796  -7.114   2.032
  526    HG3  PRO  69           HG1      PRO  69  61.521  -6.899   3.240
  527    HD2  PRO  69           HD2      PRO  69  62.683  -4.792   1.964
  528    HD3  PRO  69           HD1      PRO  69  62.080  -4.676   3.634
  529    H    TRP  70           HN       TRP  70  65.573  -6.156   1.930
  530    HA   TRP  70           HA       TRP  70  67.754  -8.032   2.454
  531    HD1  TRP  70           HD1      TRP  70  69.620  -8.597   1.678
  532    HE1  TRP  70           HE1      TRP  70  71.554  -9.091   0.049
  533    HE3  TRP  70           HE3      TRP  70  67.672  -6.644  -2.619
  534    HZ2  TRP  70           HZ2      TRP  70  72.193  -8.708  -2.718
  535    HZ3  TRP  70           HZ3      TRP  70  68.960  -6.721  -4.731
  536    HH2  TRP  70           HH2      TRP  70  71.214  -7.748  -4.789
  537    HB2  TRP  70           HB2      TRP  70  66.622  -8.003   0.266
  538    HB3  TRP  70           HB1      TRP  70  67.116  -6.330   0.023
  539    H    GLU  71           HN       GLU  71  67.295  -4.733   2.987
  540    HA   GLU  71           HA       GLU  71  70.010  -3.856   2.348
  541    HB2  GLU  71           HB2      GLU  71  67.731  -2.476   2.607
  542    HB3  GLU  71           HB1      GLU  71  68.288  -2.338   4.272
  543    HG2  GLU  71           HG2      GLU  71  70.546  -1.610   3.283
  544    HG3  GLU  71           HG1      GLU  71  69.684  -1.414   1.756
  545    H    ALA  72           HN       ALA  72  68.279  -4.994   5.205
  546    HA   ALA  72           HA       ALA  72  70.349  -4.304   7.094
  547    HB1  ALA  72           HB1      ALA  72  68.264  -6.494   7.313
  548    HB2  ALA  72           HB2      ALA  72  67.973  -4.802   7.714
  549    HB3  ALA  72           HB3      ALA  72  69.142  -5.740   8.644
  550    H1U  RCY  73           H1U      RCY  73  73.735  -4.642  -1.214
  551    H1S  RCY  73           H1S      RCY  73  75.335  -8.280   1.546
  552    HB1  RCY  73           HB1      RCY  73  74.514  -6.197   4.711
  553    HB2  RCY  73           HB2      RCY  73  73.187  -6.340   3.559
  554    HA   RCY  73           HA       RCY  73  72.274  -8.147   5.214
  555    HN1  RCY  73           HN1      RCY  73  71.898  -5.294   5.201
  556    H    ASN  74           HN       ASN  74  72.454  -6.158   7.748
  557    HA   ASN  74           HA       ASN  74  73.429  -6.359   9.867
  558    HB2  ASN  74           HB2      ASN  74  74.733  -8.915   8.914
  559    HB3  ASN  74           HB1      ASN  74  74.234  -8.483  10.548
  560   HD21  ASN  74          HD21      ASN  74  71.637  -7.662  10.304
  561   HD22  ASN  74          HD22      ASN  74  70.671  -8.874   9.612
  562    H    HIS  75           HN       HIS  75  76.183  -8.177   9.135
  563    HA   HIS  75           HA       HIS  75  78.067  -6.251   9.783
  564    HD1  HIS  75           HD1      HIS  75  80.556  -6.596  10.212
  565    HD2  HIS  75           HD2      HIS  75  78.718 -10.335  10.417
  566    HE1  HIS  75           HE1      HIS  75  81.449  -7.718  12.299
  567    HE2  HIS  75           HE2      HIS  75  80.338  -9.995  12.436
  568    HB2  HIS  75           HB2      HIS  75  78.104  -8.769   8.234
  569    HB3  HIS  75           HB1      HIS  75  79.426  -7.667   7.850
  570    H1U  RCY  76           H1U      RCY  76  80.969  -3.669   0.349
  571    H1S  RCY  76           H1S      RCY  76  79.241  -3.533   4.843
  572    HB1  RCY  76           HB1      RCY  76  77.359  -2.027   6.937
  573    HB2  RCY  76           HB2      RCY  76  76.595  -3.614   7.018
  574    HA   RCY  76           HA       RCY  76  79.079  -4.160   5.891
  575    HN1  RCY  76           HN1      RCY  76  79.091  -4.568   8.721
  576    H    GLU  77           HN       GLU  77  78.529  -1.924   8.634
  577    HA   GLU  77           HA       GLU  77  80.708  -0.209   7.800
  578    HB2  GLU  77           HB2      GLU  77  80.314   0.786  10.161
  579    HB3  GLU  77           HB1      GLU  77  78.998   0.900   8.993
  580    HG2  GLU  77           HG2      GLU  77  79.152  -1.505  10.782
  581    HG3  GLU  77           HG1      GLU  77  78.519   0.008  11.432
  582    H    LEU  78           HN       LEU  78  82.837  -0.456   8.263
  583    HA   LEU  78           HA       LEU  78  84.783  -1.477   9.110
  584    HG   LEU  78           HG       LEU  78  85.660   0.282  10.425
  585    HB2  LEU  78           HB2      LEU  78  83.094  -0.892  11.543
  586    HB3  LEU  78           HB1      LEU  78  84.698  -1.609  11.698
  587   HD11  LEU  78          HD11      LEU  78  82.763   1.123  10.347
  588   HD12  LEU  78          HD12      LEU  78  83.903   0.994   9.009
  589   HD13  LEU  78          HD13      LEU  78  84.063   2.303  10.180
  590   HD21  LEU  78          HD21      LEU  78  85.715   0.569  12.790
  591   HD22  LEU  78          HD22      LEU  78  83.984   0.898  12.865
  592   HD23  LEU  78          HD23      LEU  78  85.077   2.088  12.160
  593    H    HIS  79           HN       HIS  79  83.192  -3.396   7.973
  594    HA   HIS  79           HA       HIS  79  82.677  -5.556   9.894
  595    HD1  HIS  79           HD1      HIS  79  81.301  -7.643   5.909
  596    HD2  HIS  79           HD2      HIS  79  82.671  -7.961   9.836
  597    HE1  HIS  79           HE1      HIS  79  81.249 -10.108   6.488
  598    HE2  HIS  79           HE2      HIS  79  82.081 -10.315   8.876
  599    HB2  HIS  79           HB2      HIS  79  81.210  -5.321   7.952
  600    HB3  HIS  79           HB1      HIS  79  82.587  -5.484   6.863
  601    H    GLU  80           HN       GLU  80  84.023  -6.669   6.969
  602    HA   GLU  80           HA       GLU  80  86.706  -7.073   8.218
  603    HB2  GLU  80           HB2      GLU  80  84.814  -9.168   7.153
  604    HB3  GLU  80           HB1      GLU  80  86.557  -9.440   7.131
  605    HG2  GLU  80           HG2      GLU  80  85.107  -8.572   9.635
  606    HG3  GLU  80           HG1      GLU  80  85.295 -10.273   9.207
  607    H    LEU  81           HN       LEU  81  84.703  -7.150   5.289
  608    HA   LEU  81           HA       LEU  81  87.142  -6.998   3.601
  609    HG   LEU  81           HG       LEU  81  84.978  -9.481   2.046
  610    HB2  LEU  81           HB2      LEU  81  84.204  -7.401   3.030
  611    HB3  LEU  81           HB1      LEU  81  85.339  -7.009   1.740
  612   HD11  LEU  81          HD11      LEU  81  87.229  -8.171   1.378
  613   HD12  LEU  81          HD12      LEU  81  87.161  -9.930   1.477
  614   HD13  LEU  81          HD13      LEU  81  87.814  -8.995   2.823
  615   HD21  LEU  81          HD21      LEU  81  85.708 -10.583   4.013
  616   HD22  LEU  81          HD22      LEU  81  84.832  -9.174   4.612
  617   HD23  LEU  81          HD23      LEU  81  86.595  -9.168   4.578
  618    H    ALA  82           HN       ALA  82  84.859  -4.956   5.096
  619    HA   ALA  82           HA       ALA  82  84.730  -2.827   3.175
  620    HB1  ALA  82           HB1      ALA  82  83.225  -3.038   5.164
  621    HB2  ALA  82           HB2      ALA  82  83.974  -1.447   5.037
  622    HB3  ALA  82           HB3      ALA  82  84.591  -2.622   6.198
  623    H    GLN  83           HN       GLN  83  85.795  -1.143   5.744
  624    HA   GLN  83           HA       GLN  83  87.764   0.045   6.208
  625    HB2  GLN  83           HB2      GLN  83  89.178  -2.328   4.952
  626    HB3  GLN  83           HB1      GLN  83  89.872  -1.145   6.056
  627    HG2  GLN  83           HG2      GLN  83  88.794  -2.027   7.906
  628    HG3  GLN  83           HG1      GLN  83  87.444  -2.646   6.954
  629   HE21  GLN  83          HE21      GLN  83  90.823  -3.301   7.879
  630   HE22  GLN  83          HE22      GLN  83  90.805  -4.936   7.422
  631    H    TYR  84           HN       TYR  84  88.479  -1.688   3.170
  632    HA   TYR  84           HA       TYR  84  88.333   0.792   1.625
  633    HD1  TYR  84           HD2      TYR  84  89.627   2.714   0.971
  634    HD2  TYR  84           HD1      TYR  84  91.663   0.682   4.161
  635    HE1  TYR  84           HE2      TYR  84  89.979   4.880   2.126
  636    HE2  TYR  84           HE1      TYR  84  92.014   2.848   5.316
  637    HH   TYR  84           HH       TYR  84  92.064   5.559   4.160
  638    HB2  TYR  84           HB2      TYR  84  90.956  -0.538   2.301
  639    HB3  TYR  84           HB1      TYR  84  90.758   0.313   0.769
  640    H    GLY  85           HN       GLY  85  87.522  -2.239   1.905
  641    HA2  GLY  85           HA2      GLY  85  88.319  -3.228  -0.768
  642    HA3  GLY  85           HA1      GLY  85  87.377  -4.124   0.429
  643    H    ILE  86           HN       ILE  86  87.216  -1.500  -1.917
  644    HA   ILE  86           HA       ILE  86  85.416  -0.473  -2.973
  645    HB   ILE  86           HB       ILE  86  85.425  -2.781  -3.999
  646   HG12  ILE  86          HG12      ILE  86  82.638  -1.627  -3.737
  647   HG13  ILE  86          HG11      ILE  86  83.904  -0.844  -4.684
  648   HG21  ILE  86          HG21      ILE  86  84.774  -4.209  -2.233
  649   HG22  ILE  86          HG22      ILE  86  83.349  -4.149  -3.270
  650   HG23  ILE  86          HG23      ILE  86  83.406  -3.186  -1.794
  651   HD11  ILE  86          HD11      ILE  86  82.527  -3.469  -5.171
  652   HD12  ILE  86          HD12      ILE  86  84.165  -3.221  -5.776
  653   HD13  ILE  86          HD13      ILE  86  82.860  -2.159  -6.305
  654    H1U  RCY  87           H1U      RCY  87  76.308  -0.886   0.569
  655    H1S  RCY  87           H1S      RCY  87  78.518   0.928  -2.568
  656    HB1  RCY  87           HB1      RCY  87  81.943   2.456  -1.649
  657    HB2  RCY  87           HB2      RCY  87  80.507   1.826  -0.843
  658    HA   RCY  87           HA       RCY  87  82.640   0.899   0.091
  659    HN1  RCY  87           HN1      RCY  87  83.407   0.513  -2.589
  Start of MODEL   94
    1    HA   MET   1           HA       MET   1  91.834  -2.484  17.182
    2    HB2  MET   1           HB2      MET   1  93.359  -3.001  19.742
    3    HB3  MET   1           HB1      MET   1  91.620  -2.781  19.539
    4    HG2  MET   1           HG2      MET   1  91.864  -5.120  19.767
    5    HG3  MET   1           HG1      MET   1  91.735  -4.879  18.024
    6    HE1  MET   1           HE1      MET   1  95.412  -5.796  20.554
    7    HE2  MET   1           HE2      MET   1  93.878  -6.639  20.758
    8    HE3  MET   1           HE3      MET   1  93.957  -4.895  20.999
    9    H    ASN   2           HN       ASN   2  94.957  -1.476  16.965
   10    HA   ASN   2           HA       ASN   2  95.117   0.777  18.692
   11    HB2  ASN   2           HB2      ASN   2  97.053  -0.040  17.423
   12    HB3  ASN   2           HB1      ASN   2  96.269   0.413  15.909
   13   HD21  ASN   2          HD21      ASN   2  98.091   1.932  15.493
   14   HD22  ASN   2          HD22      ASN   2  98.153   3.423  16.303
   15    H    LEU   3           HN       LEU   3  92.899   1.617  18.626
   16    HA   LEU   3           HA       LEU   3  92.614   3.717  16.600
   17    HG   LEU   3           HG       LEU   3  89.641   3.867  16.443
   18    HB2  LEU   3           HB2      LEU   3  91.585   1.737  15.496
   19    HB3  LEU   3           HB1      LEU   3  90.494   1.563  16.870
   20   HD11  LEU   3          HD11      LEU   3  90.246   4.620  13.977
   21   HD12  LEU   3          HD12      LEU   3  91.711   3.686  14.282
   22   HD13  LEU   3          HD13      LEU   3  91.300   5.048  15.324
   23   HD21  LEU   3          HD21      LEU   3  88.250   3.258  14.591
   24   HD22  LEU   3          HD22      LEU   3  88.635   1.752  15.424
   25   HD23  LEU   3          HD23      LEU   3  89.481   2.178  13.936
   26    H    GLU   4           HN       GLU   4  92.340   5.366  18.053
   27    HA   GLU   4           HA       GLU   4  90.895   4.969  20.553
   28    HB2  GLU   4           HB2      GLU   4  91.794   7.577  19.301
   29    HB3  GLU   4           HB1      GLU   4  91.409   7.292  20.998
   30    HG2  GLU   4           HG2      GLU   4  93.777   7.200  20.907
   31    HG3  GLU   4           HG1      GLU   4  93.271   5.511  20.938
   32    HA   PRO   5           HA       PRO   5  86.715   5.581  19.149
   33    HB2  PRO   5           HB2      PRO   5  86.629   7.447  21.497
   34    HB3  PRO   5           HB1      PRO   5  85.475   6.186  21.021
   35    HG2  PRO   5           HG2      PRO   5  87.256   5.814  22.986
   36    HG3  PRO   5           HG1      PRO   5  86.742   4.500  21.917
   37    HD2  PRO   5           HD2      PRO   5  89.354   5.881  22.042
   38    HD3  PRO   5           HD1      PRO   5  88.951   4.294  21.353
   39    HA   PRO   6           HA       PRO   6  87.541   9.567  17.116
   40    HB2  PRO   6           HB2      PRO   6  85.901   9.218  14.983
   41    HB3  PRO   6           HB1      PRO   6  87.471   8.402  15.113
   42    HG2  PRO   6           HG2      PRO   6  84.743   7.328  15.602
   43    HG3  PRO   6           HG1      PRO   6  86.149   6.548  14.861
   44    HD2  PRO   6           HD2      PRO   6  85.341   6.151  17.490
   45    HD3  PRO   6           HD1      PRO   6  86.986   5.856  16.887
   46    H    LYS   7           HN       LYS   7  86.545  11.485  17.604
   47    HA   LYS   7           HA       LYS   7  83.802  11.445  18.656
   48    HB2  LYS   7           HB2      LYS   7  84.428  14.074  18.669
   49    HB3  LYS   7           HB1      LYS   7  84.972  12.967  19.925
   50    HG2  LYS   7           HG2      LYS   7  86.649  13.204  17.461
   51    HG3  LYS   7           HG1      LYS   7  86.696  14.532  18.621
   52    HD2  LYS   7           HD2      LYS   7  87.478  13.135  20.365
   53    HD3  LYS   7           HD1      LYS   7  87.024  11.665  19.503
   54    HE2  LYS   7           HE2      LYS   7  89.011  13.522  18.242
   55    HE3  LYS   7           HE1      LYS   7  89.547  12.458  19.542
   56    HZ1  LYS   7           HZ1      LYS   7  88.438  10.619  18.242
   57    HZ2  LYS   7           HZ2      LYS   7  89.862  11.259  17.572
   58    HZ3  LYS   7           HZ3      LYS   7  88.348  11.706  16.943
   59    H    ALA   8           HN       ALA   8  83.776  10.682  16.006
   60    HA   ALA   8           HA       ALA   8  83.519  12.609  14.004
   61    HB1  ALA   8           HB1      ALA   8  81.443  10.957  13.377
   62    HB2  ALA   8           HB2      ALA   8  82.309   9.952  14.537
   63    HB3  ALA   8           HB3      ALA   8  83.134  10.541  13.095
   64    H    GLU   9           HN       GLU   9  80.438  11.295  15.068
   65    HA   GLU   9           HA       GLU   9  78.403  12.381  15.499
   66    HB2  GLU   9           HB2      GLU   9  80.264  14.334  16.888
   67    HB3  GLU   9           HB1      GLU   9  78.524  14.212  17.144
   68    HG2  GLU   9           HG2      GLU   9  80.389  11.866  17.547
   69    HG3  GLU   9           HG1      GLU   9  79.983  12.989  18.846
   70    H1U  RCY  10           H1U      RCY  10  78.388   9.529  11.660
   71    H1S  RCY  10           H1S      RCY  10  80.078  13.154  12.140
   72    HB1  RCY  10           HB1      RCY  10  81.184  15.629  12.692
   73    HB2  RCY  10           HB2      RCY  10  80.507  17.076  11.945
   74    HA   RCY  10           HA       RCY  10  79.813  17.335  14.157
   75    HN1  RCY  10           HN1      RCY  10  80.214  15.410  15.452
   76    H    ARG  11           HN       ARG  11  78.385  17.451  11.625
   77    HA   ARG  11           HA       ARG  11  75.690  16.419  12.120
   78    HE   ARG  11           HE       ARG  11  75.716  21.302  10.948
   79    HB2  ARG  11           HB2      ARG  11  74.810  18.894  11.993
   80    HB3  ARG  11           HB1      ARG  11  75.351  18.245  13.541
   81    HG2  ARG  11           HG2      ARG  11  77.466  19.341  13.374
   82    HG3  ARG  11           HG1      ARG  11  77.205  19.736  11.675
   83    HD2  ARG  11           HD2      ARG  11  75.320  20.751  13.795
   84    HD3  ARG  11           HD1      ARG  11  76.820  21.607  13.438
   85   HH11  ARG  11          HH21      ARG  11  74.542  22.384  14.003
   86   HH12  ARG  11          HH22      ARG  11  73.393  23.486  13.321
   87   HH21  ARG  11          HH11      ARG  11  74.223  22.735  10.039
   88   HH22  ARG  11          HH12      ARG  11  73.212  23.685  11.077
   89    H    SER  12           HN       SER  12  77.700  18.723  10.285
   90    HA   SER  12           HA       SER  12  77.678  19.262   7.999
   91    HG   SER  12           HG       SER  12  76.093  16.012   6.579
   92    HB2  SER  12           HB2      SER  12  77.649  17.419   6.555
   93    HB3  SER  12           HB1      SER  12  78.058  16.669   8.095
   94    H    ALA  13           HN       ALA  13  75.826  18.413   5.991
   95    HA   ALA  13           HA       ALA  13  73.353  19.801   6.954
   96    HB1  ALA  13           HB1      ALA  13  74.667  20.924   5.130
   97    HB2  ALA  13           HB2      ALA  13  73.015  20.519   4.661
   98    HB3  ALA  13           HB3      ALA  13  74.359  19.520   4.108
   99    H    THR  14           HN       THR  14  72.803  18.563   3.942
  100    HA   THR  14           HA       THR  14  71.469  16.795   3.175
  101    HB   THR  14           HB       THR  14  72.163  14.631   3.777
  102    HG1  THR  14           HG1      THR  14  72.086  15.697   6.244
  103   HG21  THR  14          HG21      THR  14  74.530  14.729   3.794
  104   HG22  THR  14          HG22      THR  14  74.542  16.233   4.716
  105   HG23  THR  14          HG23      THR  14  74.031  16.237   3.028
  106    H    ARG  15           HN       ARG  15  69.320  16.997   3.539
  107    HA   ARG  15           HA       ARG  15  68.164  17.440   6.130
  108    HE   ARG  15           HE       ARG  15  67.476  20.316   1.871
  109    HB2  ARG  15           HB2      ARG  15  66.760  16.396   3.655
  110    HB3  ARG  15           HB1      ARG  15  66.025  17.251   5.010
  111    HG2  ARG  15           HG2      ARG  15  67.123  19.293   4.450
  112    HG3  ARG  15           HG1      ARG  15  68.215  18.481   3.327
  113    HD2  ARG  15           HD2      ARG  15  65.991  17.781   2.112
  114    HD3  ARG  15           HD1      ARG  15  65.306  19.151   2.987
  115   HH11  ARG  15          HH21      ARG  15  65.145  18.096   0.637
  116   HH12  ARG  15          HH22      ARG  15  65.257  18.678  -0.991
  117   HH21  ARG  15          HH11      ARG  15  67.636  21.089  -0.247
  118   HH22  ARG  15          HH12      ARG  15  66.667  20.372  -1.491
  119    H    VAL  16           HN       VAL  16  69.389  15.494   7.096
  120    HA   VAL  16           HA       VAL  16  68.016  12.907   6.579
  121    HB   VAL  16           HB       VAL  16  70.458  13.600   8.239
  122   HG11  VAL  16          HG11      VAL  16  70.704  11.050   8.229
  123   HG12  VAL  16          HG12      VAL  16  69.017  10.992   7.718
  124   HG13  VAL  16          HG13      VAL  16  69.443  11.704   9.274
  125   HG21  VAL  16          HG21      VAL  16  70.275  11.939   5.716
  126   HG22  VAL  16          HG22      VAL  16  71.722  12.602   6.476
  127   HG23  VAL  16          HG23      VAL  16  70.575  13.677   5.678
  128    H    MET  17           HN       MET  17  66.886  11.815   8.232
  129    HA   MET  17           HA       MET  17  66.712  12.961  10.921
  130    HB2  MET  17           HB2      MET  17  64.288  13.403  10.820
  131    HB3  MET  17           HB1      MET  17  65.156  14.419   9.670
  132    HG2  MET  17           HG2      MET  17  63.499  13.625   8.273
  133    HG3  MET  17           HG1      MET  17  64.687  12.340   8.055
  134    HE1  MET  17           HE1      MET  17  60.718  12.269  10.296
  135    HE2  MET  17           HE2      MET  17  61.257  13.366   9.026
  136    HE3  MET  17           HE3      MET  17  61.955  13.484  10.640
  137    H    GLY  18           HN       GLY  18  65.549  10.644   8.518
  138    HA2  GLY  18           HA2      GLY  18  65.410   8.282   8.866
  139    HA3  GLY  18           HA1      GLY  18  65.557   8.553  10.603
  140    H    GLY  19           HN       GLY  19  63.712   8.373  11.778
  141    HA2  GLY  19           HA2      GLY  19  61.378   8.745  12.235
  142    HA3  GLY  19           HA1      GLY  19  61.105   8.996  10.509
  143    HA   PRO  20           HA       PRO  20  59.813   4.636  12.208
  144    HB2  PRO  20           HB2      PRO  20  57.490   5.554  10.547
  145    HB3  PRO  20           HB1      PRO  20  57.497   4.594  12.039
  146    HG2  PRO  20           HG2      PRO  20  56.878   7.192  12.039
  147    HG3  PRO  20           HG1      PRO  20  57.748   6.434  13.382
  148    HD2  PRO  20           HD2      PRO  20  58.758   8.325  11.332
  149    HD3  PRO  20           HD1      PRO  20  59.385   7.985  12.959
  150    H1U  RCY  21           H1U      RCY  21  64.884   3.555   2.307
  151    H1S  RCY  21           H1S      RCY  21  62.277   3.104   6.365
  152    HB1  RCY  21           HB1      RCY  21  62.815   1.895   8.116
  153    HB2  RCY  21           HB2      RCY  21  62.952   2.585   9.733
  154    HA   RCY  21           HA       RCY  21  60.699   3.469   7.956
  155    HN1  RCY  21           HN1      RCY  21  61.077   3.321  10.916
  156    H    THR  22           HN       THR  22  59.074   2.073   7.397
  157    HA   THR  22           HA       THR  22  59.364  -0.767   8.243
  158    HB   THR  22           HB       THR  22  56.807   0.853   8.428
  159    HG1  THR  22           HG1      THR  22  57.572  -0.592  10.578
  160   HG21  THR  22          HG21      THR  22  55.930  -1.363   9.356
  161   HG22  THR  22          HG22      THR  22  57.366  -2.108   8.655
  162   HG23  THR  22          HG23      THR  22  56.194  -1.301   7.613
  163    HA   PRO  23           HA       PRO  23  58.946  -0.498   3.669
  164    HB2  PRO  23           HB2      PRO  23  59.590  -3.390   4.024
  165    HB3  PRO  23           HB1      PRO  23  60.312  -2.198   2.926
  166    HG2  PRO  23           HG2      PRO  23  61.588  -3.046   5.109
  167    HG3  PRO  23           HG1      PRO  23  61.726  -1.374   4.538
  168    HD2  PRO  23           HD2      PRO  23  60.184  -2.448   6.867
  169    HD3  PRO  23           HD1      PRO  23  60.990  -0.875   6.675
  170    H    ARG  24           HN       ARG  24  57.951  -2.657   2.281
  171    HA   ARG  24           HA       ARG  24  55.415  -3.446   3.633
  172    HE   ARG  24           HE       ARG  24  53.048  -1.397   0.520
  173    HB2  ARG  24           HB2      ARG  24  55.704  -1.923   1.041
  174    HB3  ARG  24           HB1      ARG  24  54.286  -2.924   1.356
  175    HG2  ARG  24           HG2      ARG  24  53.573  -1.588   3.136
  176    HG3  ARG  24           HG1      ARG  24  55.185  -0.933   3.420
  177    HD2  ARG  24           HD2      ARG  24  53.713   0.753   2.372
  178    HD3  ARG  24           HD1      ARG  24  55.054   0.329   1.307
  179   HH11  ARG  24          HH21      ARG  24  53.335   2.001   1.028
  180   HH12  ARG  24          HH22      ARG  24  52.171   2.415  -0.186
  181   HH21  ARG  24          HH11      ARG  24  51.526  -0.876  -1.068
  182   HH22  ARG  24          HH12      ARG  24  51.147   0.786  -1.372
  183    H    LYS  25           HN       LYS  25  57.574  -5.124   3.277
  184    HA   LYS  25           HA       LYS  25  58.141  -7.213   2.389
  185    HB2  LYS  25           HB2      LYS  25  55.623  -7.515   2.817
  186    HB3  LYS  25           HB1      LYS  25  55.411  -7.224   1.091
  187    HG2  LYS  25           HG2      LYS  25  55.613  -9.548   1.142
  188    HG3  LYS  25           HG1      LYS  25  57.281  -9.060   0.842
  189    HD2  LYS  25           HD2      LYS  25  57.643 -10.477   2.623
  190    HD3  LYS  25           HD1      LYS  25  57.334  -8.989   3.518
  191    HE2  LYS  25           HE2      LYS  25  54.979  -9.608   3.788
  192    HE3  LYS  25           HE1      LYS  25  55.234 -11.066   2.829
  193    HZ1  LYS  25           HZ1      LYS  25  57.105 -10.822   4.980
  194    HZ2  LYS  25           HZ2      LYS  25  56.096 -12.124   4.564
  195    HZ3  LYS  25           HZ3      LYS  25  55.501 -10.861   5.531
  196    H    GLY  26           HN       GLY  26  55.977  -6.098  -0.224
  197    HA2  GLY  26           HA2      GLY  26  56.474  -5.542  -2.454
  198    HA3  GLY  26           HA1      GLY  26  58.139  -5.259  -1.945
  199    HA   PRO  27           HA       PRO  27  58.255  -8.847  -4.906
  200    HB2  PRO  27           HB2      PRO  27  61.121  -8.011  -4.628
  201    HB3  PRO  27           HB1      PRO  27  60.217  -8.458  -6.088
  202    HG2  PRO  27           HG2      PRO  27  60.768  -5.919  -5.519
  203    HG3  PRO  27           HG1      PRO  27  59.237  -6.388  -6.276
  204    HD2  PRO  27           HD2      PRO  27  59.753  -5.493  -3.481
  205    HD3  PRO  27           HD1      PRO  27  58.280  -5.338  -4.464
  206    HA   PRO  28           HA       PRO  28  59.269 -12.265  -2.295
  207    HB2  PRO  28           HB2      PRO  28  61.577 -12.754  -4.157
  208    HB3  PRO  28           HB1      PRO  28  60.393 -13.907  -3.509
  209    HG2  PRO  28           HG2      PRO  28  60.212 -12.918  -5.994
  210    HG3  PRO  28           HG1      PRO  28  58.784 -13.311  -5.023
  211    HD2  PRO  28           HD2      PRO  28  59.803 -10.663  -5.832
  212    HD3  PRO  28           HD1      PRO  28  58.189 -11.114  -5.239
  213    H    LYS  29           HN       LYS  29  60.975 -13.029  -0.786
  214    HA   LYS  29           HA       LYS  29  62.378 -10.954   0.502
  215    HB2  LYS  29           HB2      LYS  29  63.776 -12.911   1.468
  216    HB3  LYS  29           HB1      LYS  29  62.037 -12.920   1.767
  217    HG2  LYS  29           HG2      LYS  29  61.655 -14.521   0.025
  218    HG3  LYS  29           HG1      LYS  29  63.303 -14.350  -0.581
  219    HD2  LYS  29           HD2      LYS  29  64.228 -15.458   1.301
  220    HD3  LYS  29           HD1      LYS  29  62.741 -15.288   2.234
  221    HE2  LYS  29           HE2      LYS  29  61.595 -16.889   0.867
  222    HE3  LYS  29           HE1      LYS  29  62.896 -16.897  -0.324
  223    HZ1  LYS  29           HZ1      LYS  29  62.629 -18.505   1.940
  224    HZ2  LYS  29           HZ2      LYS  29  63.971 -17.495   2.196
  225    HZ3  LYS  29           HZ3      LYS  29  63.901 -18.485   0.817
  226    H1U  RCY  30           H1U      RCY  30  69.937  -4.005   0.281
  227    H1S  RCY  30           H1S      RCY  30  67.507  -7.782  -0.510
  228    HB1  RCY  30           HB1      RCY  30  66.167  -9.321  -0.417
  229    HB2  RCY  30           HB2      RCY  30  65.862  -9.748  -2.100
  230    HA   RCY  30           HA       RCY  30  66.342 -12.039  -1.722
  231    HN1  RCY  30           HN1      RCY  30  65.009 -11.669   0.851
  232    H    LYS  31           HN       LYS  31  68.691 -12.168  -1.441
  233    HA   LYS  31           HA       LYS  31  69.695 -12.090   1.344
  234    HB2  LYS  31           HB2      LYS  31  70.701 -14.433   0.917
  235    HB3  LYS  31           HB1      LYS  31  68.983 -14.350   1.303
  236    HG2  LYS  31           HG2      LYS  31  68.334 -14.947  -0.816
  237    HG3  LYS  31           HG1      LYS  31  69.703 -14.135  -1.576
  238    HD2  LYS  31           HD2      LYS  31  71.196 -15.922  -0.999
  239    HD3  LYS  31           HD1      LYS  31  69.995 -16.667   0.056
  240    HE2  LYS  31           HE2      LYS  31  69.807 -16.385  -2.957
  241    HE3  LYS  31           HE1      LYS  31  70.073 -17.881  -2.062
  242    HZ1  LYS  31           HZ1      LYS  31  67.636 -16.274  -2.319
  243    HZ2  LYS  31           HZ2      LYS  31  67.885 -17.136  -0.876
  244    HZ3  LYS  31           HZ3      LYS  31  67.828 -17.959  -2.361
  245    H    GLN  32           HN       GLN  32  71.765 -14.017  -0.314
  246    HA   GLN  32           HA       GLN  32  73.049 -11.980  -1.989
  247    HB2  GLN  32           HB2      GLN  32  74.274 -12.896   0.629
  248    HB3  GLN  32           HB1      GLN  32  75.205 -12.130  -0.658
  249    HG2  GLN  32           HG2      GLN  32  73.461 -10.237  -0.557
  250    HG3  GLN  32           HG1      GLN  32  72.957 -10.948   0.977
  251   HE21  GLN  32          HE21      GLN  32  75.250  -8.843  -0.479
  252   HE22  GLN  32          HE22      GLN  32  76.292  -8.688   0.852
  253    H    ARG  33           HN       ARG  33  75.225 -12.936  -2.824
  254    HA   ARG  33           HA       ARG  33  74.677 -15.644  -3.757
  255    HE   ARG  33           HE       ARG  33  74.616 -11.477  -6.792
  256    HB2  ARG  33           HB2      ARG  33  76.818 -13.593  -4.239
  257    HB3  ARG  33           HB1      ARG  33  77.134 -15.269  -4.687
  258    HG2  ARG  33           HG2      ARG  33  76.177 -14.094  -6.601
  259    HG3  ARG  33           HG1      ARG  33  75.013 -15.277  -6.004
  260    HD2  ARG  33           HD2      ARG  33  73.542 -13.677  -5.324
  261    HD3  ARG  33           HD1      ARG  33  74.822 -12.610  -4.747
  262   HH11  ARG  33          HH21      ARG  33  73.735 -14.796  -7.094
  263   HH12  ARG  33          HH22      ARG  33  73.337 -14.676  -8.775
  264   HH21  ARG  33          HH11      ARG  33  74.101 -11.300  -8.986
  265   HH22  ARG  33          HH12      ARG  33  73.544 -12.696  -9.846
  266    H    GLN  34           HN       GLN  34  75.341 -14.970  -0.814
  267    HA   GLN  34           HA       GLN  34  76.537 -15.979   0.934
  268    HB2  GLN  34           HB2      GLN  34  77.052 -18.258  -0.981
  269    HB3  GLN  34           HB1      GLN  34  76.826 -18.325   0.767
  270    HG2  GLN  34           HG2      GLN  34  74.710 -18.972   0.122
  271    HG3  GLN  34           HG1      GLN  34  74.469 -17.224   0.107
  272   HE21  GLN  34          HE21      GLN  34  73.155 -16.851  -1.705
  273   HE22  GLN  34          HE22      GLN  34  73.486 -17.429  -3.266
  274    H    THR  35           HN       THR  35  77.999 -14.292  -1.004
  275    HA   THR  35           HA       THR  35  80.598 -15.557  -1.416
  276    HB   THR  35           HB       THR  35  81.284 -13.195  -2.037
  277    HG1  THR  35           HG1      THR  35  79.223 -11.908  -2.351
  278   HG21  THR  35          HG21      THR  35  79.691 -13.120  -4.033
  279   HG22  THR  35          HG22      THR  35  78.890 -14.520  -3.321
  280   HG23  THR  35          HG23      THR  35  80.580 -14.626  -3.811
  281    H    ARG  36           HN       ARG  36  80.624 -12.360  -0.074
  282    HA   ARG  36           HA       ARG  36  81.022 -13.028   2.677
  283    HE   ARG  36           HE       ARG  36  86.175 -12.634   2.794
  284    HB2  ARG  36           HB2      ARG  36  83.183 -13.803   1.101
  285    HB3  ARG  36           HB1      ARG  36  83.687 -12.235   1.730
  286    HG2  ARG  36           HG2      ARG  36  83.168 -12.984   4.024
  287    HG3  ARG  36           HG1      ARG  36  82.662 -14.554   3.398
  288    HD2  ARG  36           HD2      ARG  36  84.892 -14.931   4.058
  289    HD3  ARG  36           HD1      ARG  36  85.024 -14.645   2.322
  290   HH11  ARG  36          HH21      ARG  36  84.534 -13.891   5.553
  291   HH12  ARG  36          HH22      ARG  36  85.238 -12.755   6.655
  292   HH21  ARG  36          HH11      ARG  36  87.104 -11.144   4.217
  293   HH22  ARG  36          HH12      ARG  36  86.693 -11.200   5.898
  294    H    GLN  37           HN       GLN  37  81.887 -10.870   0.014
  295    HA   GLN  37           HA       GLN  37  80.729  -8.572   1.270
  296    HB2  GLN  37           HB2      GLN  37  82.808  -7.294   1.735
  297    HB3  GLN  37           HB1      GLN  37  82.672  -8.714   2.770
  298    HG2  GLN  37           HG2      GLN  37  84.135  -9.970   1.199
  299    HG3  GLN  37           HG1      GLN  37  84.321  -8.505   0.234
  300   HE21  GLN  37          HE21      GLN  37  84.131  -8.392   3.772
  301   HE22  GLN  37          HE22      GLN  37  85.747  -7.933   4.019
  302    H1U  RCY  38           H1U      RCY  38  79.832  -1.854  -4.222
  303    H1S  RCY  38           H1S      RCY  38  81.542  -5.734  -5.417
  304    HB1  RCY  38           HB1      RCY  38  81.550  -6.761  -3.019
  305    HB2  RCY  38           HB2      RCY  38  80.278  -7.936  -2.688
  306    HA   RCY  38           HA       RCY  38  82.126  -9.646  -3.570
  307    HN1  RCY  38           HN1      RCY  38  82.089 -10.199  -1.281
  308    H    LYS  39           HN       LYS  39  84.270  -9.793  -4.077
  309    HA   LYS  39           HA       LYS  39  85.871  -7.316  -4.032
  310    HB2  LYS  39           HB2      LYS  39  87.801  -8.510  -2.944
  311    HB3  LYS  39           HB1      LYS  39  86.441  -8.229  -1.859
  312    HG2  LYS  39           HG2      LYS  39  86.393 -10.779  -3.387
  313    HG3  LYS  39           HG1      LYS  39  87.619 -10.649  -2.125
  314    HD2  LYS  39           HD2      LYS  39  85.895 -10.060  -0.481
  315    HD3  LYS  39           HD1      LYS  39  84.656 -10.129  -1.734
  316    HE2  LYS  39           HE2      LYS  39  84.679 -12.226  -0.457
  317    HE3  LYS  39           HE1      LYS  39  85.198 -12.519  -2.117
  318    HZ1  LYS  39           HZ1      LYS  39  87.242 -13.077  -1.459
  319    HZ2  LYS  39           HZ2      LYS  39  86.557 -13.274   0.083
  320    HZ3  LYS  39           HZ3      LYS  39  87.340 -11.822  -0.322
  321    H    SER  40           HN       SER  40  84.708  -9.042  -6.081
  322    HA   SER  40           HA       SER  40  86.337 -10.913  -7.296
  323    HG   SER  40           HG       SER  40  83.401 -10.065  -7.664
  324    HB2  SER  40           HB2      SER  40  84.761  -8.665  -8.565
  325    HB3  SER  40           HB1      SER  40  85.523  -9.947  -9.502
  326    H    LYS  41           HN       LYS  41  86.477  -7.601  -8.606
  327    HA   LYS  41           HA       LYS  41  89.146  -7.969  -9.576
  328    HB2  LYS  41           HB2      LYS  41  87.619  -5.397  -9.080
  329    HB3  LYS  41           HB1      LYS  41  89.076  -5.546 -10.062
  330    HG2  LYS  41           HG2      LYS  41  87.974  -6.880 -11.691
  331    HG3  LYS  41           HG1      LYS  41  86.604  -7.190 -10.623
  332    HD2  LYS  41           HD2      LYS  41  85.924  -4.852 -10.744
  333    HD3  LYS  41           HD1      LYS  41  87.348  -4.458 -11.708
  334    HE2  LYS  41           HE2      LYS  41  86.568  -5.728 -13.567
  335    HE3  LYS  41           HE1      LYS  41  85.330  -6.526 -12.597
  336    HZ1  LYS  41           HZ1      LYS  41  83.937  -4.821 -12.846
  337    HZ2  LYS  41           HZ2      LYS  41  84.946  -4.327 -14.121
  338    HZ3  LYS  41           HZ3      LYS  41  85.142  -3.658 -12.571
  339    HA   PRO  42           HA       PRO  42  91.612  -7.043  -6.012
  340    HB2  PRO  42           HB2      PRO  42  93.417  -5.356  -7.627
  341    HB3  PRO  42           HB1      PRO  42  93.747  -6.903  -6.827
  342    HG2  PRO  42           HG2      PRO  42  93.558  -6.640  -9.504
  343    HG3  PRO  42           HG1      PRO  42  93.131  -8.126  -8.641
  344    HD2  PRO  42           HD2      PRO  42  91.327  -6.050  -9.825
  345    HD3  PRO  42           HD1      PRO  42  91.092  -7.808  -9.692
  346    HA   PRO  43           HA       PRO  43  90.596  -2.996  -4.525
  347    HB2  PRO  43           HB2      PRO  43  92.658  -2.428  -2.821
  348    HB3  PRO  43           HB1      PRO  43  91.414  -3.642  -2.463
  349    HG2  PRO  43           HG2      PRO  43  94.190  -4.021  -3.461
  350    HG3  PRO  43           HG1      PRO  43  93.268  -4.980  -2.291
  351    HD2  PRO  43           HD2      PRO  43  93.619  -5.728  -4.915
  352    HD3  PRO  43           HD1      PRO  43  92.224  -6.224  -3.932
  353    H    LYS  44           HN       LYS  44  90.711  -1.100  -5.646
  354    HA   LYS  44           HA       LYS  44  93.404  -0.048  -6.411
  355    HB2  LYS  44           HB2      LYS  44  91.059  -0.667  -8.145
  356    HB3  LYS  44           HB1      LYS  44  91.898   0.848  -8.478
  357    HG2  LYS  44           HG2      LYS  44  93.500  -1.664  -8.090
  358    HG3  LYS  44           HG1      LYS  44  92.710  -1.373  -9.640
  359    HD2  LYS  44           HD2      LYS  44  93.811   0.881  -9.710
  360    HD3  LYS  44           HD1      LYS  44  94.703   0.441  -8.254
  361    HE2  LYS  44           HE2      LYS  44  94.782  -1.075 -10.880
  362    HE3  LYS  44           HE1      LYS  44  96.041   0.011 -10.291
  363    HZ1  LYS  44           HZ1      LYS  44  95.152  -2.552  -9.100
  364    HZ2  LYS  44           HZ2      LYS  44  96.131  -1.441  -8.268
  365    HZ3  LYS  44           HZ3      LYS  44  96.690  -2.162  -9.701
  366    H    LYS  45           HN       LYS  45  89.949   0.874  -6.509
  367    HA   LYS  45           HA       LYS  45  88.869   2.662  -5.434
  368    HB2  LYS  45           HB2      LYS  45  89.842   3.694  -3.650
  369    HB3  LYS  45           HB1      LYS  45  91.055   2.440  -3.838
  370    HG2  LYS  45           HG2      LYS  45  92.481   4.246  -3.920
  371    HG3  LYS  45           HG1      LYS  45  92.010   4.245  -5.620
  372    HD2  LYS  45           HD2      LYS  45  90.394   5.962  -5.279
  373    HD3  LYS  45           HD1      LYS  45  90.467   5.785  -3.526
  374    HE2  LYS  45           HE2      LYS  45  92.829   6.655  -5.210
  375    HE3  LYS  45           HE1      LYS  45  91.724   7.787  -4.430
  376    HZ1  LYS  45           HZ1      LYS  45  92.502   5.866  -2.549
  377    HZ2  LYS  45           HZ2      LYS  45  92.833   7.532  -2.552
  378    HZ3  LYS  45           HZ3      LYS  45  93.904   6.449  -3.304
  379    H    GLY  46           HN       GLY  46  88.243   4.650  -6.271
  380    HA2  GLY  46           HA2      GLY  46  89.103   6.767  -7.437
  381    HA3  GLY  46           HA1      GLY  46  89.915   5.655  -8.541
  382    H    VAL  47           HN       VAL  47  87.423   7.649  -8.579
  383    HA   VAL  47           HA       VAL  47  85.279   5.904  -9.512
  384    HB   VAL  47           HB       VAL  47  85.445   8.859 -10.084
  385   HG11  VAL  47          HG11      VAL  47  83.019   8.708  -9.755
  386   HG12  VAL  47          HG12      VAL  47  83.170   7.012  -9.295
  387   HG13  VAL  47          HG13      VAL  47  83.539   7.515 -10.945
  388   HG21  VAL  47          HG21      VAL  47  84.881   7.499  -7.434
  389   HG22  VAL  47          HG22      VAL  47  84.401   9.158  -7.790
  390   HG23  VAL  47          HG23      VAL  47  86.109   8.719  -7.771
  391    H    GLN  48           HN       GLN  48  87.831   5.606 -10.894
  392    HA   GLN  48           HA       GLN  48  88.112   6.877 -13.349
  393    HB2  GLN  48           HB2      GLN  48  89.650   5.122 -12.614
  394    HB3  GLN  48           HB1      GLN  48  88.379   3.910 -12.779
  395    HG2  GLN  48           HG2      GLN  48  88.296   4.189 -15.157
  396    HG3  GLN  48           HG1      GLN  48  89.306   5.633 -15.086
  397   HE21  GLN  48          HE21      GLN  48  90.751   4.369 -16.635
  398   HE22  GLN  48          HE22      GLN  48  91.853   3.258 -15.978
  399    H    GLY  49           HN       GLY  49  86.064   3.997 -12.750
  400    HA2  GLY  49           HA2      GLY  49  84.087   5.009 -14.677
  401    HA3  GLY  49           HA1      GLY  49  84.904   3.523 -15.166
  402    H1U  RCY  50           H1U      RCY  50  81.519  -4.114  -9.888
  403    H1S  RCY  50           H1S      RCY  50  82.148   0.435 -10.717
  404    HB1  RCY  50           HB1      RCY  50  80.837   3.160 -13.320
  405    HB2  RCY  50           HB2      RCY  50  80.032   2.659 -11.835
  406    HA   RCY  50           HA       RCY  50  81.685   3.907 -10.856
  407    HN1  RCY  50           HN1      RCY  50  83.178   4.903 -12.358
  408    H    GLY  51           HN       GLY  51  82.107   2.665  -9.087
  409    HA2  GLY  51           HA2      GLY  51  82.868   0.048  -8.838
  410    HA3  GLY  51           HA1      GLY  51  84.405   0.849  -9.168
  411    H    ASP  52           HN       ASP  52  84.672  -0.132  -6.848
  412    HA   ASP  52           HA       ASP  52  84.781   2.024  -4.984
  413    HB2  ASP  52           HB2      ASP  52  82.308   0.374  -4.974
  414    HB3  ASP  52           HB1      ASP  52  83.047   0.642  -3.396
  415    H    ASP  53           HN       ASP  53  86.754   1.338  -4.238
  416    HA   ASP  53           HA       ASP  53  87.606  -1.354  -4.003
  417    HB2  ASP  53           HB2      ASP  53  88.508   1.267  -2.906
  418    HB3  ASP  53           HB1      ASP  53  89.096  -0.173  -2.075
  419    H    ILE  54           HN       ILE  54  86.514   0.809  -1.355
  420    HA   ILE  54           HA       ILE  54  86.452  -1.013   0.734
  421    HB   ILE  54           HB       ILE  54  84.475   0.295   1.604
  422   HG12  ILE  54          HG12      ILE  54  84.501   2.400  -0.303
  423   HG13  ILE  54          HG11      ILE  54  84.262   0.901  -1.202
  424   HG21  ILE  54          HG21      ILE  54  86.829   1.819   0.452
  425   HG22  ILE  54          HG22      ILE  54  86.729   1.085   2.053
  426   HG23  ILE  54          HG23      ILE  54  85.718   2.474   1.655
  427   HD11  ILE  54          HD11      ILE  54  82.611   1.932   1.118
  428   HD12  ILE  54          HD12      ILE  54  82.463   0.296   0.475
  429   HD13  ILE  54          HD13      ILE  54  82.081   1.683  -0.546
  430    HA   PRO  55           HA       PRO  55  83.460  -3.845  -1.182
  431    HB2  PRO  55           HB2      PRO  55  84.096  -6.048   0.259
  432    HB3  PRO  55           HB1      PRO  55  85.124  -5.457  -1.060
  433    HG2  PRO  55           HG2      PRO  55  85.470  -5.153   1.877
  434    HG3  PRO  55           HG1      PRO  55  86.684  -5.436   0.619
  435    HD2  PRO  55           HD2      PRO  55  86.143  -2.954   1.754
  436    HD3  PRO  55           HD1      PRO  55  86.920  -3.194   0.174
  437    H    GLY  56           HN       GLY  56  82.342  -2.038   0.561
  438    HA2  GLY  56           HA2      GLY  56  80.433  -1.866   1.926
  439    HA3  GLY  56           HA1      GLY  56  80.298  -3.624   1.863
  440    H    MET  57           HN       MET  57  83.266  -2.106   2.885
  441    HA   MET  57           HA       MET  57  84.384  -2.092   4.935
  442    HB2  MET  57           HB2      MET  57  81.510  -1.927   5.840
  443    HB3  MET  57           HB1      MET  57  82.817  -2.062   7.011
  444    HG2  MET  57           HG2      MET  57  83.871  -0.052   6.151
  445    HG3  MET  57           HG1      MET  57  82.696   0.048   4.839
  446    HE1  MET  57           HE1      MET  57  80.421   0.566   4.935
  447    HE2  MET  57           HE2      MET  57  81.190   2.142   5.110
  448    HE3  MET  57           HE3      MET  57  79.766   1.752   6.072
  449    H    GLU  58           HN       GLU  58  81.667  -4.417   4.915
  450    HA   GLU  58           HA       GLU  58  83.387  -6.680   5.204
  451    HB2  GLU  58           HB2      GLU  58  82.580  -7.267   7.582
  452    HB3  GLU  58           HB1      GLU  58  83.839  -6.040   7.446
  453    HG2  GLU  58           HG2      GLU  58  82.287  -4.263   7.785
  454    HG3  GLU  58           HG1      GLU  58  80.903  -5.328   7.539
  455    H    GLY  59           HN       GLY  59  80.902  -5.649   3.870
  456    HA2  GLY  59           HA2      GLY  59  78.875  -6.557   3.118
  457    HA3  GLY  59           HA1      GLY  59  79.457  -8.104   3.734
  458    H1U  RCY  60           H1U      RCY  60  75.536   2.357   5.503
  459    H1S  RCY  60           H1S      RCY  60  76.471  -1.263   7.079
  460    HB1  RCY  60           HB1      RCY  60  77.923  -3.708   6.797
  461    HB2  RCY  60           HB2      RCY  60  77.173  -4.235   8.300
  462    HA   RCY  60           HA       RCY  60  77.255  -6.337   7.468
  463    HN1  RCY  60           HN1      RCY  60  78.323  -4.995   5.119
  464    H    GLY  61           HN       GLY  61  76.289  -6.819   4.549
  465    HA2  GLY  61           HA2      GLY  61  73.810  -6.122   3.821
  466    HA3  GLY  61           HA1      GLY  61  74.228  -7.832   3.882
  467    H    THR  62           HN       THR  62  74.438  -8.029   6.754
  468    HA   THR  62           HA       THR  62  71.927  -8.828   7.552
  469    HB   THR  62           HB       THR  62  72.705  -8.811   9.756
  470    HG1  THR  62           HG1      THR  62  74.591  -7.051   9.947
  471   HG21  THR  62          HG21      THR  62  75.314  -8.377   8.295
  472   HG22  THR  62          HG22      THR  62  74.350  -9.838   8.083
  473   HG23  THR  62          HG23      THR  62  75.001  -9.434   9.671
  474    H    ASP  63           HN       ASP  63  73.133  -5.508   7.492
  475    HA   ASP  63           HA       ASP  63  70.873  -4.353   8.873
  476    HB2  ASP  63           HB2      ASP  63  73.105  -3.234   8.595
  477    HB3  ASP  63           HB1      ASP  63  72.731  -3.017   6.884
  478    H    ILE  64           HN       ILE  64  70.693  -6.094   6.207
  479    HA   ILE  64           HA       ILE  64  69.096  -4.229   4.554
  480    HB   ILE  64           HB       ILE  64  70.613  -5.821   3.426
  481   HG12  ILE  64          HG12      ILE  64  67.714  -6.587   2.972
  482   HG13  ILE  64          HG11      ILE  64  68.432  -5.088   2.381
  483   HG21  ILE  64          HG21      ILE  64  70.693  -8.027   3.943
  484   HG22  ILE  64          HG22      ILE  64  68.936  -8.172   3.962
  485   HG23  ILE  64          HG23      ILE  64  69.787  -7.581   5.389
  486   HD11  ILE  64          HD11      ILE  64  70.220  -6.576   1.283
  487   HD12  ILE  64          HD12      ILE  64  68.612  -6.602   0.560
  488   HD13  ILE  64          HD13      ILE  64  69.129  -7.923   1.607
  489    H    THR  65           HN       THR  65  68.644  -6.658   6.973
  490    HA   THR  65           HA       THR  65  66.693  -7.756   7.735
  491    HB   THR  65           HB       THR  65  65.062  -6.247   8.410
  492    HG1  THR  65           HG1      THR  65  64.474  -5.928   6.123
  493   HG21  THR  65          HG21      THR  65  67.106  -4.238   7.451
  494   HG22  THR  65          HG22      THR  65  67.403  -5.310   8.820
  495   HG23  THR  65          HG23      THR  65  66.081  -4.144   8.884
  496    H    VAL  66           HN       VAL  66  67.482  -7.908   4.875
  497    HA   VAL  66           HA       VAL  66  66.662  -9.010   2.980
  498    HB   VAL  66           HB       VAL  66  63.914  -9.049   4.237
  499   HG11  VAL  66          HG11      VAL  66  65.362 -11.062   2.494
  500   HG12  VAL  66          HG12      VAL  66  64.310  -9.798   1.856
  501   HG13  VAL  66          HG13      VAL  66  63.647 -11.049   2.908
  502   HG21  VAL  66          HG21      VAL  66  66.377 -10.601   4.974
  503   HG22  VAL  66          HG22      VAL  66  64.809 -11.406   5.033
  504   HG23  VAL  66          HG23      VAL  66  65.102  -9.973   6.018
  505    H    ILE  67           HN       ILE  67  64.735  -6.458   4.436
  506    HA   ILE  67           HA       ILE  67  64.508  -5.173   1.762
  507    HB   ILE  67           HB       ILE  67  62.209  -5.308   3.740
  508   HG12  ILE  67          HG12      ILE  67  62.753  -7.511   2.635
  509   HG13  ILE  67          HG11      ILE  67  61.158  -6.879   2.224
  510   HG21  ILE  67          HG21      ILE  67  60.932  -4.351   1.847
  511   HG22  ILE  67          HG22      ILE  67  62.409  -4.298   0.885
  512   HG23  ILE  67          HG23      ILE  67  62.258  -3.292   2.326
  513   HD11  ILE  67          HD11      ILE  67  61.713  -6.925   0.046
  514   HD12  ILE  67          HD12      ILE  67  63.325  -7.510   0.457
  515   HD13  ILE  67          HD13      ILE  67  63.013  -5.776   0.365
  516    H1U  RCY  68           H1U      RCY  68  73.030   0.332   2.362
  517    H1S  RCY  68           H1S      RCY  68  69.093  -1.365   0.531
  518    HB1  RCY  68           HB1      RCY  68  67.791  -2.385   4.549
  519    HB2  RCY  68           HB2      RCY  68  67.645  -0.789   3.816
  520    HA   RCY  68           HA       RCY  68  65.505  -2.004   4.776
  521    HN1  RCY  68           HN1      RCY  68  65.886  -3.464   2.205
  522    HA   PRO  69           HA       PRO  69  63.297   1.495   3.288
  523    HB2  PRO  69           HB2      PRO  69  65.832   3.022   3.809
  524    HB3  PRO  69           HB1      PRO  69  64.162   3.435   4.247
  525    HG2  PRO  69           HG2      PRO  69  65.907   2.381   6.005
  526    HG3  PRO  69           HG1      PRO  69  64.165   2.076   6.080
  527    HD2  PRO  69           HD2      PRO  69  66.329   0.210   5.403
  528    HD3  PRO  69           HD1      PRO  69  64.634  -0.140   5.802
  529    H    TRP  70           HN       TRP  70  66.607   1.045   2.090
  530    HA   TRP  70           HA       TRP  70  66.118   2.666  -0.299
  531    HD1  TRP  70           HD1      TRP  70  67.443   3.322  -2.272
  532    HE1  TRP  70           HE1      TRP  70  68.679   5.583  -2.330
  533    HE3  TRP  70           HE3      TRP  70  70.078   2.998   2.089
  534    HZ2  TRP  70           HZ2      TRP  70  70.542   7.062  -0.735
  535    HZ3  TRP  70           HZ3      TRP  70  71.572   4.841   2.795
  536    HH2  TRP  70           HH2      TRP  70  71.809   6.870   1.393
  537    HB2  TRP  70           HB2      TRP  70  68.402   1.515   1.020
  538    HB3  TRP  70           HB1      TRP  70  68.398   0.978  -0.659
  539    H    GLU  71           HN       GLU  71  66.188  -0.786   0.526
  540    HA   GLU  71           HA       GLU  71  66.131  -1.945  -2.014
  541    HB2  GLU  71           HB2      GLU  71  64.864  -2.664   0.606
  542    HB3  GLU  71           HB1      GLU  71  64.372  -3.565  -0.825
  543    HG2  GLU  71           HG2      GLU  71  67.298  -3.135  -0.329
  544    HG3  GLU  71           HG1      GLU  71  66.450  -4.367   0.605
  545    H    ALA  72           HN       ALA  72  63.381  -0.546  -0.218
  546    HA   ALA  72           HA       ALA  72  61.387  -1.108  -2.172
  547    HB1  ALA  72           HB1      ALA  72  60.789  -0.338   0.069
  548    HB2  ALA  72           HB2      ALA  72  60.144   0.790  -1.123
  549    HB3  ALA  72           HB3      ALA  72  61.599   1.203  -0.215
  550    H1U  RCY  73           H1U      RCY  73  65.863  -2.740  -2.860
  551    H1S  RCY  73           H1S      RCY  73  65.898   0.192  -6.480
  552    HB1  RCY  73           HB1      RCY  73  61.632   1.140  -7.190
  553    HB2  RCY  73           HB2      RCY  73  61.740  -0.413  -6.368
  554    HA   RCY  73           HA       RCY  73  63.534   1.569  -5.188
  555    HN1  RCY  73           HN1      RCY  73  62.103  -0.649  -4.275
  556    H    ASN  74           HN       ASN  74  62.927   3.471  -4.075
  557    HA   ASN  74           HA       ASN  74  60.179   4.502  -4.663
  558    HB2  ASN  74           HB2      ASN  74  60.939   4.206  -2.234
  559    HB3  ASN  74           HB1      ASN  74  62.056   5.538  -2.532
  560   HD21  ASN  74          HD21      ASN  74  60.556   7.282  -4.090
  561   HD22  ASN  74          HD22      ASN  74  59.177   7.792  -3.242
  562    H    HIS  75           HN       HIS  75  63.145   6.234  -3.724
  563    HA   HIS  75           HA       HIS  75  63.786   7.289  -6.291
  564    HD1  HIS  75           HD1      HIS  75  59.699   8.564  -6.438
  565    HD2  HIS  75           HD2      HIS  75  63.391   8.503  -8.378
  566    HE1  HIS  75           HE1      HIS  75  59.204   8.317  -8.909
  567    HE2  HIS  75           HE2      HIS  75  61.443   8.278 -10.102
  568    HB2  HIS  75           HB2      HIS  75  61.586   8.639  -4.812
  569    HB3  HIS  75           HB1      HIS  75  62.825   9.706  -5.470
  570    H1U  RCY  76           H1U      RCY  76  72.280   2.327  -3.984
  571    H1S  RCY  76           H1S      RCY  76  68.513   5.031  -4.786
  572    HB1  RCY  76           HB1      RCY  76  67.647   6.500  -3.639
  573    HB2  RCY  76           HB2      RCY  76  68.846   7.773  -3.419
  574    HA   RCY  76           HA       RCY  76  66.632   8.726  -3.134
  575    HN1  RCY  76           HN1      RCY  76  65.945   7.397  -5.709
  576    H    GLU  77           HN       GLU  77  69.356   9.310  -4.243
  577    HA   GLU  77           HA       GLU  77  68.798  12.014  -5.109
  578    HB2  GLU  77           HB2      GLU  77  70.904  10.891  -3.867
  579    HB3  GLU  77           HB1      GLU  77  71.515  10.851  -5.519
  580    HG2  GLU  77           HG2      GLU  77  72.215  12.958  -4.687
  581    HG3  GLU  77           HG1      GLU  77  70.788  13.323  -5.658
  582    H    LEU  78           HN       LEU  78  70.947  12.236  -7.069
  583    HA   LEU  78           HA       LEU  78  71.113  12.288  -9.403
  584    HG   LEU  78           HG       LEU  78  72.641   9.039  -9.662
  585    HB2  LEU  78           HB2      LEU  78  70.404   9.442  -8.753
  586    HB3  LEU  78           HB1      LEU  78  70.450   9.942 -10.442
  587   HD11  LEU  78          HD11      LEU  78  73.789  10.533 -10.957
  588   HD12  LEU  78          HD12      LEU  78  73.222  11.923 -10.032
  589   HD13  LEU  78          HD13      LEU  78  72.180  11.193 -11.253
  590   HD21  LEU  78          HD21      LEU  78  72.634  11.488  -7.869
  591   HD22  LEU  78          HD22      LEU  78  73.946  10.321  -8.034
  592   HD23  LEU  78          HD23      LEU  78  72.416   9.831  -7.307
  593    H    HIS  79           HN       HIS  79  69.703  11.774 -11.493
  594    HA   HIS  79           HA       HIS  79  66.806  11.858 -10.957
  595    HD1  HIS  79           HD1      HIS  79  64.676  13.570 -12.060
  596    HD2  HIS  79           HD2      HIS  79  67.831  14.916 -14.434
  597    HE1  HIS  79           HE1      HIS  79  63.656  14.295 -14.262
  598    HE2  HIS  79           HE2      HIS  79  65.565  15.116 -15.716
  599    HB2  HIS  79           HB2      HIS  79  67.007  14.163 -10.758
  600    HB3  HIS  79           HB1      HIS  79  68.422  14.233 -11.806
  601    H    GLU  80           HN       GLU  80  69.512  11.384 -13.033
  602    HA   GLU  80           HA       GLU  80  67.931  11.168 -15.488
  603    HB2  GLU  80           HB2      GLU  80  70.037  10.307 -16.477
  604    HB3  GLU  80           HB1      GLU  80  70.288  11.827 -15.621
  605    HG2  GLU  80           HG2      GLU  80  70.823  10.269 -13.574
  606    HG3  GLU  80           HG1      GLU  80  71.105   9.049 -14.817
  607    H    LEU  81           HN       LEU  81  69.745   8.805 -13.490
  608    HA   LEU  81           HA       LEU  81  68.040   6.651 -14.642
  609    HG   LEU  81           HG       LEU  81  69.951   5.725 -11.700
  610    HB2  LEU  81           HB2      LEU  81  69.737   5.128 -14.061
  611    HB3  LEU  81           HB1      LEU  81  70.643   6.561 -14.535
  612   HD11  LEU  81          HD11      LEU  81  71.834   4.520 -12.886
  613   HD12  LEU  81          HD12      LEU  81  72.324   5.392 -11.434
  614   HD13  LEU  81          HD13      LEU  81  72.652   6.076 -13.026
  615   HD21  LEU  81          HD21      LEU  81  71.364   7.716 -11.088
  616   HD22  LEU  81          HD22      LEU  81  69.843   8.145 -11.870
  617   HD23  LEU  81          HD23      LEU  81  71.348   8.188 -12.787
  618    H    ALA  82           HN       ALA  82  67.402   8.700 -12.424
  619    HA   ALA  82           HA       ALA  82  67.226   7.321  -9.932
  620    HB1  ALA  82           HB1      ALA  82  66.956   9.674  -9.884
  621    HB2  ALA  82           HB2      ALA  82  65.363   9.030  -9.488
  622    HB3  ALA  82           HB3      ALA  82  65.691   9.636 -11.113
  623    H    GLN  83           HN       GLN  83  64.700   7.789 -12.439
  624    HA   GLN  83           HA       GLN  83  62.502   6.582 -11.403
  625    HB2  GLN  83           HB2      GLN  83  63.714   6.598 -14.091
  626    HB3  GLN  83           HB1      GLN  83  62.587   5.270 -13.829
  627    HG2  GLN  83           HG2      GLN  83  61.921   8.140 -13.138
  628    HG3  GLN  83           HG1      GLN  83  61.547   7.423 -14.706
  629   HE21  GLN  83          HE21      GLN  83  61.385   4.963 -12.420
  630   HE22  GLN  83          HE22      GLN  83  59.718   5.009 -12.104
  631    H    TYR  84           HN       TYR  84  62.703   4.991  -9.865
  632    HA   TYR  84           HA       TYR  84  62.955   2.843  -8.991
  633    HD1  TYR  84           HD2      TYR  84  60.986   2.301  -8.950
  634    HD2  TYR  84           HD1      TYR  84  61.354   2.119 -13.225
  635    HE1  TYR  84           HE2      TYR  84  58.549   2.701  -9.176
  636    HE2  TYR  84           HE1      TYR  84  58.917   2.518 -13.452
  637    HH   TYR  84           HH       TYR  84  56.759   2.155 -10.990
  638    HB2  TYR  84           HB2      TYR  84  63.286   2.036 -11.898
  639    HB3  TYR  84           HB1      TYR  84  62.980   0.946 -10.553
  640    H    GLY  85           HN       GLY  85  65.329   3.638 -11.521
  641    HA2  GLY  85           HA2      GLY  85  67.692   3.728 -11.152
  642    HA3  GLY  85           HA1      GLY  85  67.462   2.867  -9.630
  643    H    ILE  86           HN       ILE  86  67.941   2.516 -13.067
  644    HA   ILE  86           HA       ILE  86  67.380  -0.187 -13.507
  645    HB   ILE  86           HB       ILE  86  68.199   1.217 -15.317
  646   HG12  ILE  86          HG12      ILE  86  70.383  -0.811 -14.807
  647   HG13  ILE  86          HG11      ILE  86  68.745  -1.297 -15.244
  648   HG21  ILE  86          HG21      ILE  86  71.020   1.243 -14.577
  649   HG22  ILE  86          HG22      ILE  86  70.028   2.109 -13.404
  650   HG23  ILE  86          HG23      ILE  86  69.992   2.575 -15.105
  651   HD11  ILE  86          HD11      ILE  86  70.223   0.747 -16.889
  652   HD12  ILE  86          HD12      ILE  86  68.874  -0.285 -17.363
  653   HD13  ILE  86          HD13      ILE  86  70.483  -0.977 -17.155
  654    H1U  RCY  87           H1U      RCY  87  72.124   0.054  -4.960
  655    H1S  RCY  87           H1S      RCY  87  73.083   0.721  -9.254
  656    HB1  RCY  87           HB1      RCY  87  72.951   0.552 -12.450
  657    HB2  RCY  87           HB2      RCY  87  73.111  -1.152 -12.872
  658    HA   RCY  87           HA       RCY  87  71.260  -1.779 -11.581
  659    HN1  RCY  87           HN1      RCY  87  70.773   0.770 -12.946
  Start of MODEL   95
    1    HA   MET   1           HA       MET   1  67.509 -18.553   3.471
    2    HB2  MET   1           HB2      MET   1  66.960 -16.312   4.475
    3    HB3  MET   1           HB1      MET   1  68.484 -16.335   3.588
    4    HG2  MET   1           HG2      MET   1  67.279 -15.440   1.586
    5    HG3  MET   1           HG1      MET   1  65.821 -15.305   2.569
    6    HE1  MET   1           HE1      MET   1  67.111 -11.654   2.008
    7    HE2  MET   1           HE2      MET   1  65.993 -12.915   1.495
    8    HE3  MET   1           HE3      MET   1  67.666 -12.952   0.944
    9    H    ASN   2           HN       ASN   2  65.434 -17.456   4.857
   10    HA   ASN   2           HA       ASN   2  62.977 -17.563   3.245
   11    HB2  ASN   2           HB2      ASN   2  62.024 -19.461   4.513
   12    HB3  ASN   2           HB1      ASN   2  63.458 -19.954   3.611
   13   HD21  ASN   2          HD21      ASN   2  65.540 -19.077   5.242
   14   HD22  ASN   2          HD22      ASN   2  65.459 -19.843   6.754
   15    H    LEU   3           HN       LEU   3  61.327 -16.449   4.270
   16    HA   LEU   3           HA       LEU   3  61.128 -16.108   7.113
   17    HG   LEU   3           HG       LEU   3  62.647 -13.004   8.085
   18    HB2  LEU   3           HB2      LEU   3  63.181 -14.621   6.230
   19    HB3  LEU   3           HB1      LEU   3  61.879 -13.503   5.839
   20   HD11  LEU   3          HD11      LEU   3  60.574 -13.062   9.205
   21   HD12  LEU   3          HD12      LEU   3  60.137 -14.621   8.505
   22   HD13  LEU   3          HD13      LEU   3  60.117 -13.168   7.505
   23   HD21  LEU   3          HD21      LEU   3  63.155 -14.586   9.671
   24   HD22  LEU   3          HD22      LEU   3  63.372 -15.602   8.246
   25   HD23  LEU   3          HD23      LEU   3  61.862 -15.668   9.154
   26    H    GLU   4           HN       GLU   4  59.010 -15.603   7.482
   27    HA   GLU   4           HA       GLU   4  57.135 -15.241   5.407
   28    HB2  GLU   4           HB2      GLU   4  56.774 -14.174   8.213
   29    HB3  GLU   4           HB1      GLU   4  55.530 -14.776   7.116
   30    HG2  GLU   4           HG2      GLU   4  56.694 -17.025   7.188
   31    HG3  GLU   4           HG1      GLU   4  57.704 -16.381   8.483
   32    HA   PRO   5           HA       PRO   5  58.137 -11.091   3.991
   33    HB2  PRO   5           HB2      PRO   5  55.178 -11.109   3.489
   34    HB3  PRO   5           HB1      PRO   5  56.496 -10.585   2.421
   35    HG2  PRO   5           HG2      PRO   5  55.291 -12.947   2.109
   36    HG3  PRO   5           HG1      PRO   5  57.022 -12.733   1.798
   37    HD2  PRO   5           HD2      PRO   5  55.686 -14.160   4.033
   38    HD3  PRO   5           HD1      PRO   5  57.321 -14.378   3.372
   39    HA   PRO   6           HA       PRO   6  56.846  -8.667   7.515
   40    HB2  PRO   6           HB2      PRO   6  57.523  -6.179   6.650
   41    HB3  PRO   6           HB1      PRO   6  58.738  -7.395   7.093
   42    HG2  PRO   6           HG2      PRO   6  57.786  -6.586   4.390
   43    HG3  PRO   6           HG1      PRO   6  59.428  -6.952   4.946
   44    HD2  PRO   6           HD2      PRO   6  57.875  -8.743   3.552
   45    HD3  PRO   6           HD1      PRO   6  59.150  -9.232   4.690
   46    H    LYS   7           HN       LYS   7  55.303  -6.915   8.119
   47    HA   LYS   7           HA       LYS   7  52.836  -7.090   6.672
   48    HB2  LYS   7           HB2      LYS   7  53.860  -5.609   9.035
   49    HB3  LYS   7           HB1      LYS   7  52.500  -4.851   8.208
   50    HG2  LYS   7           HG2      LYS   7  51.576  -6.324   9.873
   51    HG3  LYS   7           HG1      LYS   7  51.320  -7.093   8.307
   52    HD2  LYS   7           HD2      LYS   7  53.721  -8.140   8.873
   53    HD3  LYS   7           HD1      LYS   7  53.158  -7.870  10.522
   54    HE2  LYS   7           HE2      LYS   7  52.391 -10.048   9.997
   55    HE3  LYS   7           HE1      LYS   7  50.975  -9.022   9.770
   56    HZ1  LYS   7           HZ1      LYS   7  50.934  -9.456   7.603
   57    HZ2  LYS   7           HZ2      LYS   7  52.021 -10.721   7.925
   58    HZ3  LYS   7           HZ3      LYS   7  52.603  -9.207   7.421
   59    H    ALA   8           HN       ALA   8  51.847  -4.516   6.446
   60    HA   ALA   8           HA       ALA   8  53.677  -3.241   4.442
   61    HB1  ALA   8           HB1      ALA   8  50.660  -3.280   4.236
   62    HB2  ALA   8           HB2      ALA   8  51.670  -4.518   3.490
   63    HB3  ALA   8           HB3      ALA   8  51.828  -2.834   2.993
   64    H    GLU   9           HN       GLU   9  54.210  -1.230   5.100
   65    HA   GLU   9           HA       GLU   9  52.148   0.578   6.153
   66    HB2  GLU   9           HB2      GLU   9  53.681   1.139   8.149
   67    HB3  GLU   9           HB1      GLU   9  52.746  -0.353   8.257
   68    HG2  GLU   9           HG2      GLU   9  55.541  -0.340   7.119
   69    HG3  GLU   9           HG1      GLU   9  55.260  -0.478   8.855
   70    H1U  RCY  10           H1U      RCY  10  54.453   2.287  -2.721
   71    H1S  RCY  10           H1S      RCY  10  55.118   4.211   0.941
   72    HB1  RCY  10           HB1      RCY  10  53.943   3.648   2.616
   73    HB2  RCY  10           HB2      RCY  10  54.573   2.088   3.145
   74    HA   RCY  10           HA       RCY  10  55.361   3.626   5.230
   75    HN1  RCY  10           HN1      RCY  10  52.657   2.697   5.619
   76    H    ARG  11           HN       ARG  11  54.560   5.504   3.097
   77    HA   ARG  11           HA       ARG  11  53.956   7.807   3.351
   78    HE   ARG  11           HE       ARG  11  49.833   3.559   2.507
   79    HB2  ARG  11           HB2      ARG  11  51.604   8.025   2.785
   80    HB3  ARG  11           HB1      ARG  11  52.279   6.648   1.920
   81    HG2  ARG  11           HG2      ARG  11  51.459   5.226   3.917
   82    HG3  ARG  11           HG1      ARG  11  50.484   6.632   4.348
   83    HD2  ARG  11           HD2      ARG  11  48.942   5.751   2.934
   84    HD3  ARG  11           HD1      ARG  11  49.974   6.393   1.656
   85   HH11  ARG  11          HH21      ARG  11  51.245   6.082   0.628
   86   HH12  ARG  11          HH22      ARG  11  51.993   5.004  -0.502
   87   HH21  ARG  11          HH11      ARG  11  50.803   2.136   1.042
   88   HH22  ARG  11          HH12      ARG  11  51.743   2.770  -0.268
   89    H    SER  12           HN       SER  12  54.590   6.849   5.948
   90    HA   SER  12           HA       SER  12  53.241   8.795   7.560
   91    HG   SER  12           HG       SER  12  52.858   7.674   9.755
   92    HB2  SER  12           HB2      SER  12  51.335   7.335   7.562
   93    HB3  SER  12           HB1      SER  12  52.340   5.918   7.848
   94    H    ALA  13           HN       ALA  13  55.881   7.344   6.890
   95    HA   ALA  13           HA       ALA  13  56.745   6.305   9.492
   96    HB1  ALA  13           HB1      ALA  13  58.168   6.858   6.880
   97    HB2  ALA  13           HB2      ALA  13  57.783   5.292   7.595
   98    HB3  ALA  13           HB3      ALA  13  59.023   6.313   8.324
   99    H    THR  14           HN       THR  14  56.501   8.088  10.928
  100    HA   THR  14           HA       THR  14  57.660  10.687  10.322
  101    HB   THR  14           HB       THR  14  56.868  11.355  12.427
  102    HG1  THR  14           HG1      THR  14  57.840  10.051  13.834
  103   HG21  THR  14          HG21      THR  14  54.654  10.509  12.580
  104   HG22  THR  14          HG22      THR  14  55.132   8.929  11.960
  105   HG23  THR  14          HG23      THR  14  55.095  10.324  10.882
  106    H    ARG  15           HN       ARG  15  59.392   8.190  10.288
  107    HA   ARG  15           HA       ARG  15  61.579   7.618  10.918
  108    HE   ARG  15           HE       ARG  15  61.867  12.567  10.962
  109    HB2  ARG  15           HB2      ARG  15  61.841  10.449  11.941
  110    HB3  ARG  15           HB1      ARG  15  63.088   9.421  11.234
  111    HG2  ARG  15           HG2      ARG  15  61.759   9.458   9.078
  112    HG3  ARG  15           HG1      ARG  15  60.736  10.693   9.812
  113    HD2  ARG  15           HD2      ARG  15  63.741  10.901   9.456
  114    HD3  ARG  15           HD1      ARG  15  62.539  11.704   8.446
  115   HH11  ARG  15          HH21      ARG  15  64.803  12.360   9.167
  116   HH12  ARG  15          HH22      ARG  15  65.522  13.740   9.928
  117   HH21  ARG  15          HH11      ARG  15  62.789  14.371  11.966
  118   HH22  ARG  15          HH12      ARG  15  64.381  14.878  11.513
  119    H    VAL  16           HN       VAL  16  61.433   6.211  12.633
  120    HA   VAL  16           HA       VAL  16  61.284   7.421  15.372
  121    HB   VAL  16           HB       VAL  16  59.213   6.173  14.791
  122   HG11  VAL  16          HG11      VAL  16  59.273   3.826  14.299
  123   HG12  VAL  16          HG12      VAL  16  60.996   3.730  14.664
  124   HG13  VAL  16          HG13      VAL  16  60.447   4.588  13.224
  125   HG21  VAL  16          HG21      VAL  16  59.116   4.918  16.816
  126   HG22  VAL  16          HG22      VAL  16  60.278   6.208  17.128
  127   HG23  VAL  16          HG23      VAL  16  60.846   4.576  16.774
  128    H    MET  17           HN       MET  17  62.949   5.361  13.169
  129    HA   MET  17           HA       MET  17  64.291   3.537  14.798
  130    HB2  MET  17           HB2      MET  17  66.330   4.211  13.188
  131    HB3  MET  17           HB1      MET  17  64.941   3.301  12.595
  132    HG2  MET  17           HG2      MET  17  63.976   5.187  11.580
  133    HG3  MET  17           HG1      MET  17  64.910   6.312  12.567
  134    HE1  MET  17           HE1      MET  17  65.237   3.304  10.283
  135    HE2  MET  17           HE2      MET  17  66.756   3.145  11.162
  136    HE3  MET  17           HE3      MET  17  66.776   3.518   9.440
  137    H    GLY  18           HN       GLY  18  65.186   6.951  14.225
  138    HA2  GLY  18           HA2      GLY  18  66.347   7.085  16.920
  139    HA3  GLY  18           HA1      GLY  18  67.514   7.262  15.609
  140    H    GLY  19           HN       GLY  19  65.267   8.912  17.544
  141    HA2  GLY  19           HA2      GLY  19  64.223  10.950  15.967
  142    HA3  GLY  19           HA1      GLY  19  64.777  11.216  17.621
  143    HA   PRO  20           HA       PRO  20  68.336  13.575  16.555
  144    HB2  PRO  20           HB2      PRO  20  70.181  11.283  17.099
  145    HB3  PRO  20           HB1      PRO  20  70.205  12.930  17.756
  146    HG2  PRO  20           HG2      PRO  20  69.359  10.855  19.202
  147    HG3  PRO  20           HG1      PRO  20  68.626  12.461  19.353
  148    HD2  PRO  20           HD2      PRO  20  67.534  10.010  18.047
  149    HD3  PRO  20           HD1      PRO  20  66.672  11.351  18.833
  150    H1U  RCY  21           H1U      RCY  21  66.996  11.709   5.726
  151    H1S  RCY  21           H1S      RCY  21  68.693  12.174   9.753
  152    HB1  RCY  21           HB1      RCY  21  67.251  12.642  11.180
  153    HB2  RCY  21           HB2      RCY  21  66.843  11.706  12.616
  154    HA   RCY  21           HA       RCY  21  69.643  11.840  12.642
  155    HN1  RCY  21           HN1      RCY  21  67.758  13.526  14.245
  156    H    THR  22           HN       THR  22  71.171  13.479  12.349
  157    HA   THR  22           HA       THR  22  70.325  15.665  10.531
  158    HB   THR  22           HB       THR  22  71.787  17.257  11.887
  159    HG1  THR  22           HG1      THR  22  71.920  14.957  13.370
  160   HG21  THR  22          HG21      THR  22  69.999  17.732  13.513
  161   HG22  THR  22          HG22      THR  22  69.303  16.138  13.217
  162   HG23  THR  22          HG23      THR  22  69.322  17.345  11.931
  163    HA   PRO  23           HA       PRO  23  73.862  14.496   8.123
  164    HB2  PRO  23           HB2      PRO  23  74.552  17.411   8.325
  165    HB3  PRO  23           HB1      PRO  23  74.526  16.359   6.896
  166    HG2  PRO  23           HG2      PRO  23  72.546  18.089   7.449
  167    HG3  PRO  23           HG1      PRO  23  72.264  16.543   6.634
  168    HD2  PRO  23           HD2      PRO  23  71.484  17.370   9.353
  169    HD3  PRO  23           HD1      PRO  23  70.883  16.014   8.376
  170    H    ARG  24           HN       ARG  24  76.046  13.974   8.537
  171    HA   ARG  24           HA       ARG  24  77.417  15.305  10.807
  172    HE   ARG  24           HE       ARG  24  76.784  12.551  15.345
  173    HB2  ARG  24           HB2      ARG  24  76.537  12.432  10.722
  174    HB3  ARG  24           HB1      ARG  24  78.044  12.843  11.541
  175    HG2  ARG  24           HG2      ARG  24  76.880  14.427  12.984
  176    HG3  ARG  24           HG1      ARG  24  75.370  14.155  12.112
  177    HD2  ARG  24           HD2      ARG  24  74.978  12.160  13.148
  178    HD3  ARG  24           HD1      ARG  24  76.684  11.715  13.153
  179   HH11  ARG  24          HH21      ARG  24  74.250  14.033  13.537
  180   HH12  ARG  24          HH22      ARG  24  73.680  14.987  14.866
  181   HH21  ARG  24          HH11      ARG  24  76.054  13.788  17.090
  182   HH22  ARG  24          HH12      ARG  24  74.701  14.849  16.877
  183    H    LYS  25           HN       LYS  25  79.680  15.203  10.622
  184    HA   LYS  25           HA       LYS  25  80.670  14.329   7.975
  185    HB2  LYS  25           HB2      LYS  25  82.048  15.804  10.243
  186    HB3  LYS  25           HB1      LYS  25  82.763  15.479   8.665
  187    HG2  LYS  25           HG2      LYS  25  81.915  17.572   8.218
  188    HG3  LYS  25           HG1      LYS  25  80.472  16.627   7.848
  189    HD2  LYS  25           HD2      LYS  25  79.537  18.126   9.325
  190    HD3  LYS  25           HD1      LYS  25  80.085  16.913  10.483
  191    HE2  LYS  25           HE2      LYS  25  81.505  19.473   9.704
  192    HE3  LYS  25           HE1      LYS  25  80.840  19.059  11.284
  193    HZ1  LYS  25           HZ1      LYS  25  83.126  17.758   9.912
  194    HZ2  LYS  25           HZ2      LYS  25  82.418  17.173  11.341
  195    HZ3  LYS  25           HZ3      LYS  25  83.181  18.691  11.327
  196    H    GLY  26           HN       GLY  26  82.000  14.040  11.289
  197    HA2  GLY  26           HA2      GLY  26  83.425  12.354  12.146
  198    HA3  GLY  26           HA1      GLY  26  82.077  11.324  11.663
  199    HA   PRO  27           HA       PRO  27  84.745   8.910   9.068
  200    HB2  PRO  27           HB2      PRO  27  82.501   9.326   7.112
  201    HB3  PRO  27           HB1      PRO  27  83.361   7.831   7.528
  202    HG2  PRO  27           HG2      PRO  27  80.941   8.409   8.522
  203    HG3  PRO  27           HG1      PRO  27  82.157   7.515   9.448
  204    HD2  PRO  27           HD2      PRO  27  81.152  10.256   9.873
  205    HD3  PRO  27           HD1      PRO  27  82.024   9.192  10.997
  206    HA   PRO  28           HA       PRO  28  87.222  11.486   6.464
  207    HB2  PRO  28           HB2      PRO  28  86.405   9.661   4.221
  208    HB3  PRO  28           HB1      PRO  28  88.019  10.265   4.648
  209    HG2  PRO  28           HG2      PRO  28  87.210   7.798   5.297
  210    HG3  PRO  28           HG1      PRO  28  88.290   8.739   6.336
  211    HD2  PRO  28           HD2      PRO  28  85.467   7.997   6.784
  212    HD3  PRO  28           HD1      PRO  28  86.690   8.531   7.957
  213    H    LYS  29           HN       LYS  29  87.076  12.936   4.530
  214    HA   LYS  29           HA       LYS  29  84.680  14.404   4.410
  215    HB2  LYS  29           HB2      LYS  29  85.801  14.865   1.920
  216    HB3  LYS  29           HB1      LYS  29  86.251  15.708   3.399
  217    HG2  LYS  29           HG2      LYS  29  87.527  13.060   2.803
  218    HG3  LYS  29           HG1      LYS  29  88.101  14.494   1.950
  219    HD2  LYS  29           HD2      LYS  29  87.814  14.389   4.960
  220    HD3  LYS  29           HD1      LYS  29  89.310  13.961   4.129
  221    HE2  LYS  29           HE2      LYS  29  89.779  16.181   4.342
  222    HE3  LYS  29           HE1      LYS  29  88.728  16.343   2.934
  223    HZ1  LYS  29           HZ1      LYS  29  87.562  17.700   4.250
  224    HZ2  LYS  29           HZ2      LYS  29  88.266  17.105   5.677
  225    HZ3  LYS  29           HZ3      LYS  29  86.964  16.282   4.962
  226    H1U  RCY  30           H1U      RCY  30  75.252  10.648   3.079
  227    H1S  RCY  30           H1S      RCY  30  79.340  11.909   0.758
  228    HB1  RCY  30           HB1      RCY  30  80.684  13.226   1.026
  229    HB2  RCY  30           HB2      RCY  30  81.496  13.181   2.589
  230    HA   RCY  30           HA       RCY  30  83.265  12.065   0.628
  231    HN1  RCY  30           HN1      RCY  30  83.873  14.687   1.771
  232    H    LYS  31           HN       LYS  31  81.183  14.917   0.518
  233    HA   LYS  31           HA       LYS  31  80.561  16.231  -1.333
  234    HB2  LYS  31           HB2      LYS  31  83.550  16.025  -1.812
  235    HB3  LYS  31           HB1      LYS  31  82.479  17.189  -2.587
  236    HG2  LYS  31           HG2      LYS  31  83.028  18.530  -0.828
  237    HG3  LYS  31           HG1      LYS  31  81.844  17.562   0.051
  238    HD2  LYS  31           HD2      LYS  31  83.705  17.372   1.441
  239    HD3  LYS  31           HD1      LYS  31  83.885  15.939   0.427
  240    HE2  LYS  31           HE2      LYS  31  85.360  17.289  -1.099
  241    HE3  LYS  31           HE1      LYS  31  85.288  18.602   0.076
  242    HZ1  LYS  31           HZ1      LYS  31  87.182  17.477   0.695
  243    HZ2  LYS  31           HZ2      LYS  31  86.535  15.948   0.333
  244    HZ3  LYS  31           HZ3      LYS  31  86.025  16.782   1.723
  245    H    GLN  32           HN       GLN  32  83.066  15.295  -3.434
  246    HA   GLN  32           HA       GLN  32  81.481  13.095  -4.643
  247    HB2  GLN  32           HB2      GLN  32  80.876  15.444  -5.615
  248    HB3  GLN  32           HB1      GLN  32  82.449  15.343  -6.405
  249    HG2  GLN  32           HG2      GLN  32  80.977  14.403  -7.991
  250    HG3  GLN  32           HG1      GLN  32  81.671  12.994  -7.188
  251   HE21  GLN  32          HE21      GLN  32  79.238  12.538  -8.368
  252   HE22  GLN  32          HE22      GLN  32  78.001  12.454  -7.208
  253    H    ARG  33           HN       ARG  33  84.361  14.134  -3.536
  254    HA   ARG  33           HA       ARG  33  85.817  12.112  -5.085
  255    HE   ARG  33           HE       ARG  33  84.910  15.580  -7.659
  256    HB2  ARG  33           HB2      ARG  33  87.636  13.717  -5.722
  257    HB3  ARG  33           HB1      ARG  33  86.117  14.008  -6.567
  258    HG2  ARG  33           HG2      ARG  33  86.479  15.435  -3.982
  259    HG3  ARG  33           HG1      ARG  33  87.487  15.978  -5.323
  260    HD2  ARG  33           HD2      ARG  33  84.464  15.736  -5.345
  261    HD3  ARG  33           HD1      ARG  33  85.388  17.238  -5.310
  262   HH11  ARG  33          HH21      ARG  33  86.998  17.815  -6.069
  263   HH12  ARG  33          HH22      ARG  33  87.701  18.408  -7.538
  264   HH21  ARG  33          HH11      ARG  33  85.815  16.341  -9.586
  265   HH22  ARG  33          HH12      ARG  33  87.031  17.573  -9.528
  266    H    GLN  34           HN       GLN  34  88.293  12.307  -4.290
  267    HA   GLN  34           HA       GLN  34  89.766  12.176  -2.473
  268    HB2  GLN  34           HB2      GLN  34  88.572  14.575  -2.143
  269    HB3  GLN  34           HB1      GLN  34  87.982  13.771  -0.689
  270    HG2  GLN  34           HG2      GLN  34  90.898  13.928  -1.516
  271    HG3  GLN  34           HG1      GLN  34  90.139  14.955  -0.298
  272   HE21  GLN  34          HE21      GLN  34  90.593  11.453  -1.050
  273   HE22  GLN  34          HE22      GLN  34  90.710  10.971   0.574
  274    H    THR  35           HN       THR  35  87.805  10.160  -2.845
  275    HA   THR  35           HA       THR  35  86.607   9.547  -0.239
  276    HB   THR  35           HB       THR  35  85.292   8.660  -1.941
  277    HG1  THR  35           HG1      THR  35  86.172   6.333  -2.156
  278   HG21  THR  35          HG21      THR  35  87.916   8.144  -3.337
  279   HG22  THR  35          HG22      THR  35  86.580   9.170  -3.858
  280   HG23  THR  35          HG23      THR  35  86.413   7.415  -3.903
  281    H    ARG  36           HN       ARG  36  88.247   7.029  -2.013
  282    HA   ARG  36           HA       ARG  36  90.376   6.903   0.077
  283    HE   ARG  36           HE       ARG  36  90.996   2.058   2.714
  284    HB2  ARG  36           HB2      ARG  36  88.338   5.288   0.414
  285    HB3  ARG  36           HB1      ARG  36  89.047   4.392  -0.930
  286    HG2  ARG  36           HG2      ARG  36  91.242   4.427   0.356
  287    HG3  ARG  36           HG1      ARG  36  90.328   5.036   1.736
  288    HD2  ARG  36           HD2      ARG  36  89.030   3.057   1.893
  289    HD3  ARG  36           HD1      ARG  36  89.503   2.523   0.280
  290   HH11  ARG  36          HH21      ARG  36  91.209   2.724  -0.662
  291   HH12  ARG  36          HH22      ARG  36  92.750   1.955  -0.852
  292   HH21  ARG  36          HH11      ARG  36  93.006   1.050   2.486
  293   HH22  ARG  36          HH12      ARG  36  93.767   1.007   0.931
  294    H    GLN  37           HN       GLN  37  90.142   7.687  -2.855
  295    HA   GLN  37           HA       GLN  37  91.351   7.362  -4.840
  296    HB2  GLN  37           HB2      GLN  37  93.265   6.354  -2.725
  297    HB3  GLN  37           HB1      GLN  37  93.714   6.474  -4.427
  298    HG2  GLN  37           HG2      GLN  37  94.369   8.503  -3.152
  299    HG3  GLN  37           HG1      GLN  37  93.200   8.871  -4.421
  300   HE21  GLN  37          HE21      GLN  37  93.126   7.844  -0.950
  301   HE22  GLN  37          HE22      GLN  37  91.856   8.887  -0.524
  302    H1U  RCY  38           H1U      RCY  38  87.775  -0.207   0.406
  303    H1S  RCY  38           H1S      RCY  38  89.855   2.711  -1.486
  304    HB1  RCY  38           HB1      RCY  38  91.178   1.987  -2.682
  305    HB2  RCY  38           HB2      RCY  38  90.556   1.308  -4.185
  306    HA   RCY  38           HA       RCY  38  92.917   2.344  -4.252
  307    HN1  RCY  38           HN1      RCY  38  92.796   4.530  -3.330
  308    H    LYS  39           HN       LYS  39  89.821   2.300  -5.633
  309    HA   LYS  39           HA       LYS  39  89.188   1.856  -7.836
  310    HB2  LYS  39           HB2      LYS  39  89.120   3.798  -9.070
  311    HB3  LYS  39           HB1      LYS  39  89.557   4.475  -7.508
  312    HG2  LYS  39           HG2      LYS  39  91.424   5.328  -8.455
  313    HG3  LYS  39           HG1      LYS  39  91.993   3.679  -8.716
  314    HD2  LYS  39           HD2      LYS  39  91.999   4.653 -10.878
  315    HD3  LYS  39           HD1      LYS  39  90.518   3.696 -10.830
  316    HE2  LYS  39           HE2      LYS  39  89.829   5.783 -11.711
  317    HE3  LYS  39           HE1      LYS  39  89.369   5.857 -10.010
  318    HZ1  LYS  39           HZ1      LYS  39  91.880   6.776  -9.930
  319    HZ2  LYS  39           HZ2      LYS  39  90.506   7.768 -10.051
  320    HZ3  LYS  39           HZ3      LYS  39  91.384   7.354 -11.446
  321    H    SER  40           HN       SER  40  90.282   2.047 -10.253
  322    HA   SER  40           HA       SER  40  91.777   0.972 -11.708
  323    HG   SER  40           HG       SER  40  94.424   0.192  -9.580
  324    HB2  SER  40           HB2      SER  40  94.043   1.413 -11.361
  325    HB3  SER  40           HB1      SER  40  93.291   2.661 -10.371
  326    H    LYS  41           HN       LYS  41  90.194  -0.763 -10.277
  327    HA   LYS  41           HA       LYS  41  92.077  -3.018  -9.741
  328    HB2  LYS  41           HB2      LYS  41  90.361  -3.792  -8.020
  329    HB3  LYS  41           HB1      LYS  41  91.311  -2.377  -7.571
  330    HG2  LYS  41           HG2      LYS  41  89.446  -0.931  -8.436
  331    HG3  LYS  41           HG1      LYS  41  88.487  -2.393  -8.673
  332    HD2  LYS  41           HD2      LYS  41  89.744  -2.003  -5.996
  333    HD3  LYS  41           HD1      LYS  41  88.364  -0.980  -6.400
  334    HE2  LYS  41           HE2      LYS  41  87.555  -3.006  -5.313
  335    HE3  LYS  41           HE1      LYS  41  87.077  -3.035  -7.011
  336    HZ1  LYS  41           HZ1      LYS  41  88.066  -5.143  -6.128
  337    HZ2  LYS  41           HZ2      LYS  41  89.550  -4.324  -6.009
  338    HZ3  LYS  41           HZ3      LYS  41  88.808  -4.529  -7.524
  339    HA   PRO  42           HA       PRO  42  89.348  -4.816 -12.812
  340    HB2  PRO  42           HB2      PRO  42  90.435  -7.308 -12.904
  341    HB3  PRO  42           HB1      PRO  42  91.245  -5.891 -13.603
  342    HG2  PRO  42           HG2      PRO  42  91.756  -7.262 -11.011
  343    HG3  PRO  42           HG1      PRO  42  92.906  -6.584 -12.176
  344    HD2  PRO  42           HD2      PRO  42  92.140  -5.293  -9.861
  345    HD3  PRO  42           HD1      PRO  42  92.721  -4.451 -11.315
  346    HA   PRO  43           HA       PRO  43  86.297  -7.059 -10.491
  347    HB2  PRO  43           HB2      PRO  43  85.106  -8.564 -12.433
  348    HB3  PRO  43           HB1      PRO  43  84.906  -6.803 -12.327
  349    HG2  PRO  43           HG2      PRO  43  86.681  -8.394 -14.111
  350    HG3  PRO  43           HG1      PRO  43  85.722  -6.947 -14.469
  351    HD2  PRO  43           HD2      PRO  43  88.425  -6.874 -13.988
  352    HD3  PRO  43           HD1      PRO  43  87.336  -5.510 -13.647
  353    H    LYS  44           HN       LYS  44  86.691  -8.746  -9.101
  354    HA   LYS  44           HA       LYS  44  87.478 -11.375 -10.226
  355    HB2  LYS  44           HB2      LYS  44  89.109  -9.783  -8.240
  356    HB3  LYS  44           HB1      LYS  44  89.241 -11.536  -8.352
  357    HG2  LYS  44           HG2      LYS  44  89.600  -9.670 -10.715
  358    HG3  LYS  44           HG1      LYS  44  90.937 -10.296  -9.749
  359    HD2  LYS  44           HD2      LYS  44  89.763 -12.625 -10.252
  360    HD3  LYS  44           HD1      LYS  44  89.123 -11.744 -11.639
  361    HE2  LYS  44           HE2      LYS  44  91.155 -12.675 -12.426
  362    HE3  LYS  44           HE1      LYS  44  91.555 -10.997 -12.059
  363    HZ1  LYS  44           HZ1      LYS  44  92.494 -13.412 -10.825
  364    HZ2  LYS  44           HZ2      LYS  44  91.946 -12.265  -9.698
  365    HZ3  LYS  44           HZ3      LYS  44  93.166 -11.854 -10.807
  366    H    LYS  45           HN       LYS  45  87.358  -9.890  -6.974
  367    HA   LYS  45           HA       LYS  45  86.401 -12.026  -5.529
  368    HB2  LYS  45           HB2      LYS  45  86.914  -9.700  -4.662
  369    HB3  LYS  45           HB1      LYS  45  85.300  -9.225  -5.185
  370    HG2  LYS  45           HG2      LYS  45  84.916  -9.826  -2.958
  371    HG3  LYS  45           HG1      LYS  45  84.532 -11.325  -3.805
  372    HD2  LYS  45           HD2      LYS  45  86.811 -12.160  -3.377
  373    HD3  LYS  45           HD1      LYS  45  87.205 -10.660  -2.536
  374    HE2  LYS  45           HE2      LYS  45  86.618 -12.073  -0.764
  375    HE3  LYS  45           HE1      LYS  45  85.104 -11.226  -1.081
  376    HZ1  LYS  45           HZ1      LYS  45  85.160 -13.809  -0.911
  377    HZ2  LYS  45           HZ2      LYS  45  85.673 -13.715  -2.528
  378    HZ3  LYS  45           HZ3      LYS  45  84.178 -13.051  -2.068
  379    H    GLY  46           HN       GLY  46  83.857  -9.639  -5.977
  380    HA2  GLY  46           HA2      GLY  46  81.798 -11.581  -6.122
  381    HA3  GLY  46           HA1      GLY  46  81.627  -9.909  -6.658
  382    H    VAL  47           HN       VAL  47  81.109 -12.863  -7.780
  383    HA   VAL  47           HA       VAL  47  82.196 -12.298 -10.515
  384    HB   VAL  47           HB       VAL  47  81.656 -14.787 -10.865
  385   HG11  VAL  47          HG11      VAL  47  83.745 -15.472  -9.594
  386   HG12  VAL  47          HG12      VAL  47  83.780 -13.841  -8.924
  387   HG13  VAL  47          HG13      VAL  47  83.946 -14.084 -10.662
  388   HG21  VAL  47          HG21      VAL  47  80.217 -14.843  -8.754
  389   HG22  VAL  47          HG22      VAL  47  81.724 -14.806  -7.838
  390   HG23  VAL  47          HG23      VAL  47  81.381 -16.157  -8.919
  391    H    GLN  48           HN       GLN  48  79.348 -12.545  -8.609
  392    HA   GLN  48           HA       GLN  48  77.548 -13.115 -10.849
  393    HB2  GLN  48           HB2      GLN  48  75.758 -12.641  -9.195
  394    HB3  GLN  48           HB1      GLN  48  76.929 -13.802  -8.572
  395    HG2  GLN  48           HG2      GLN  48  76.830 -12.365  -6.763
  396    HG3  GLN  48           HG1      GLN  48  78.112 -11.579  -7.685
  397   HE21  GLN  48          HE21      GLN  48  76.595  -9.988  -5.946
  398   HE22  GLN  48          HE22      GLN  48  75.576  -8.969  -6.843
  399    H    GLY  49           HN       GLY  49  78.480 -10.269  -8.929
  400    HA2  GLY  49           HA2      GLY  49  77.820  -8.530 -11.204
  401    HA3  GLY  49           HA1      GLY  49  76.833  -8.272  -9.764
  402    H1U  RCY  50           H1U      RCY  50  80.374  -4.241  -4.322
  403    H1S  RCY  50           H1S      RCY  50  83.441  -4.609  -7.366
  404    HB1  RCY  50           HB1      RCY  50  82.316  -8.420  -9.512
  405    HB2  RCY  50           HB2      RCY  50  81.463  -7.985  -8.031
  406    HA   RCY  50           HA       RCY  50  80.658  -5.924  -9.049
  407    HN1  RCY  50           HN1      RCY  50  79.981  -7.828 -11.176
  408    H    GLY  51           HN       GLY  51  81.035  -4.263 -10.477
  409    HA2  GLY  51           HA2      GLY  51  82.461  -3.015 -11.903
  410    HA3  GLY  51           HA1      GLY  51  83.403  -4.476 -12.193
  411    H    ASP  52           HN       ASP  52  79.903  -3.942 -12.670
  412    HA   ASP  52           HA       ASP  52  79.852  -5.307 -15.174
  413    HB2  ASP  52           HB2      ASP  52  77.659  -4.030 -15.494
  414    HB3  ASP  52           HB1      ASP  52  77.771  -5.007 -14.030
  415    H    ASP  53           HN       ASP  53  81.388  -2.484 -14.430
  416    HA   ASP  53           HA       ASP  53  82.459  -0.913 -15.795
  417    HB2  ASP  53           HB2      ASP  53  82.969  -1.600 -17.900
  418    HB3  ASP  53           HB1      ASP  53  82.090  -3.067 -17.481
  419    H    ILE  54           HN       ILE  54  79.206  -1.262 -15.356
  420    HA   ILE  54           HA       ILE  54  78.675   1.428 -16.549
  421    HB   ILE  54           HB       ILE  54  76.565  -0.724 -16.310
  422   HG12  ILE  54          HG12      ILE  54  78.559  -1.404 -17.775
  423   HG13  ILE  54          HG11      ILE  54  76.980  -1.404 -18.561
  424   HG21  ILE  54          HG21      ILE  54  75.553   0.698 -18.149
  425   HG22  ILE  54          HG22      ILE  54  76.846   1.863 -17.861
  426   HG23  ILE  54          HG23      ILE  54  75.685   1.500 -16.584
  427   HD11  ILE  54          HD11      ILE  54  77.415   0.783 -19.539
  428   HD12  ILE  54          HD12      ILE  54  78.750  -0.297 -19.939
  429   HD13  ILE  54          HD13      ILE  54  78.941   0.906 -18.664
  430    HA   PRO  55           HA       PRO  55  77.590   2.095 -12.241
  431    HB2  PRO  55           HB2      PRO  55  76.826   4.703 -12.437
  432    HB3  PRO  55           HB1      PRO  55  78.526   4.198 -12.484
  433    HG2  PRO  55           HG2      PRO  55  76.722   4.953 -14.725
  434    HG3  PRO  55           HG1      PRO  55  78.440   5.311 -14.486
  435    HD2  PRO  55           HD2      PRO  55  77.510   3.311 -16.146
  436    HD3  PRO  55           HD1      PRO  55  79.117   3.300 -15.389
  437    H    GLY  56           HN       GLY  56  75.544   3.490 -11.220
  438    HA2  GLY  56           HA2      GLY  56  73.222   1.931 -11.844
  439    HA3  GLY  56           HA1      GLY  56  73.231   3.376 -10.831
  440    H    MET  57           HN       MET  57  74.621   4.136 -13.773
  441    HA   MET  57           HA       MET  57  73.861   5.585 -15.463
  442    HB2  MET  57           HB2      MET  57  72.480   3.088 -15.572
  443    HB3  MET  57           HB1      MET  57  71.312   4.343 -15.976
  444    HG2  MET  57           HG2      MET  57  74.029   3.960 -17.269
  445    HG3  MET  57           HG1      MET  57  72.470   3.587 -18.004
  446    HE1  MET  57           HE1      MET  57  74.681   7.126 -18.864
  447    HE2  MET  57           HE2      MET  57  74.880   5.381 -19.002
  448    HE3  MET  57           HE3      MET  57  75.190   6.178 -17.461
  449    H    GLU  58           HN       GLU  58  72.992   6.159 -12.640
  450    HA   GLU  58           HA       GLU  58  71.579   7.684 -11.556
  451    HB2  GLU  58           HB2      GLU  58  72.340   8.945 -13.749
  452    HB3  GLU  58           HB1      GLU  58  70.662   8.702 -14.233
  453    HG2  GLU  58           HG2      GLU  58  69.884   9.810 -12.189
  454    HG3  GLU  58           HG1      GLU  58  71.549  10.003 -11.640
  455    H    GLY  59           HN       GLY  59  70.416   5.362 -11.471
  456    HA2  GLY  59           HA2      GLY  59  67.651   5.773 -11.341
  457    HA3  GLY  59           HA1      GLY  59  67.947   5.080 -12.938
  458    H1U  RCY  60           H1U      RCY  60  62.933   6.221  -5.169
  459    H1S  RCY  60           H1S      RCY  60  65.592   3.497  -6.607
  460    HB1  RCY  60           HB1      RCY  60  68.131   1.759  -7.306
  461    HB2  RCY  60           HB2      RCY  60  66.565   2.055  -8.061
  462    HA   RCY  60           HA       RCY  60  69.286   2.051  -9.268
  463    HN1  RCY  60           HN1      RCY  60  67.891   4.441  -9.521
  464    H    GLY  61           HN       GLY  61  69.203   0.859 -11.249
  465    HA2  GLY  61           HA2      GLY  61  66.901  -0.953 -11.434
  466    HA3  GLY  61           HA1      GLY  61  67.116   0.097 -12.839
  467    H    THR  62           HN       THR  62  70.101   0.045 -12.149
  468    HA   THR  62           HA       THR  62  70.689  -2.544 -13.527
  469    HB   THR  62           HB       THR  62  72.178   0.096 -13.443
  470    HG1  THR  62           HG1      THR  62  71.445  -1.269 -15.759
  471   HG21  THR  62          HG21      THR  62  72.990  -2.622 -14.481
  472   HG22  THR  62          HG22      THR  62  73.880  -1.563 -13.388
  473   HG23  THR  62          HG23      THR  62  73.712  -1.133 -15.090
  474    H    ASP  63           HN       ASP  63  71.775  -0.341 -10.949
  475    HA   ASP  63           HA       ASP  63  73.963  -1.777  -9.964
  476    HB2  ASP  63           HB2      ASP  63  73.047  -0.913  -7.644
  477    HB3  ASP  63           HB1      ASP  63  73.607   0.243  -8.852
  478    H    ILE  64           HN       ILE  64  70.504  -2.418  -9.512
  479    HA   ILE  64           HA       ILE  64  71.015  -4.627  -7.661
  480    HB   ILE  64           HB       ILE  64  68.871  -3.331  -7.630
  481   HG12  ILE  64          HG12      ILE  64  69.215  -6.211  -7.641
  482   HG13  ILE  64          HG11      ILE  64  68.184  -5.222  -6.607
  483   HG21  ILE  64          HG21      ILE  64  68.325  -4.804 -10.225
  484   HG22  ILE  64          HG22      ILE  64  68.719  -3.089 -10.118
  485   HG23  ILE  64          HG23      ILE  64  67.232  -3.698  -9.394
  486   HD11  ILE  64          HD11      ILE  64  66.799  -6.776  -7.891
  487   HD12  ILE  64          HD12      ILE  64  67.509  -6.198  -9.398
  488   HD13  ILE  64          HD13      ILE  64  66.493  -5.126  -8.433
  489    H    THR  65           HN       THR  65  72.472  -4.740 -10.123
  490    HA   THR  65           HA       THR  65  71.592  -6.232 -12.243
  491    HB   THR  65           HB       THR  65  74.032  -7.102 -10.667
  492    HG1  THR  65           HG1      THR  65  73.445  -4.751 -11.967
  493   HG21  THR  65          HG21      THR  65  73.162  -8.358 -12.752
  494   HG22  THR  65          HG22      THR  65  74.859  -7.879 -12.737
  495   HG23  THR  65          HG23      THR  65  73.685  -6.938 -13.658
  496    H    VAL  66           HN       VAL  66  71.790  -7.258  -8.924
  497    HA   VAL  66           HA       VAL  66  70.168  -9.636  -9.566
  498    HB   VAL  66           HB       VAL  66  72.632  -9.959  -7.846
  499   HG11  VAL  66          HG11      VAL  66  71.235 -12.075  -9.461
  500   HG12  VAL  66          HG12      VAL  66  70.544 -11.549  -7.926
  501   HG13  VAL  66          HG13      VAL  66  72.163 -12.247  -7.971
  502   HG21  VAL  66          HG21      VAL  66  73.681 -11.031  -9.858
  503   HG22  VAL  66          HG22      VAL  66  73.445  -9.293 -10.044
  504   HG23  VAL  66          HG23      VAL  66  72.342 -10.422 -10.831
  505    H    ILE  67           HN       ILE  67  72.030  -8.384  -6.772
  506    HA   ILE  67           HA       ILE  67  69.462  -7.954  -5.331
  507    HB   ILE  67           HB       ILE  67  71.854  -9.476  -4.244
  508   HG12  ILE  67          HG12      ILE  67  69.492 -10.926  -3.882
  509   HG13  ILE  67          HG11      ILE  67  69.340 -10.251  -5.505
  510   HG21  ILE  67          HG21      ILE  67  71.012  -8.139  -2.456
  511   HG22  ILE  67          HG22      ILE  67  70.280  -9.729  -2.239
  512   HG23  ILE  67          HG23      ILE  67  69.339  -8.414  -2.943
  513   HD11  ILE  67          HD11      ILE  67  71.713 -11.079  -5.934
  514   HD12  ILE  67          HD12      ILE  67  70.487 -12.335  -5.765
  515   HD13  ILE  67          HD13      ILE  67  71.575 -11.979  -4.423
  516    H1U  RCY  68           H1U      RCY  68  67.200   0.150  -9.253
  517    H1S  RCY  68           H1S      RCY  68  70.001  -0.610  -5.571
  518    HB1  RCY  68           HB1      RCY  68  69.876  -2.777  -4.258
  519    HB2  RCY  68           HB2      RCY  68  69.858  -3.601  -5.812
  520    HA   RCY  68           HA       RCY  68  72.242  -4.455  -4.681
  521    HN1  RCY  68           HN1      RCY  68  69.680  -5.698  -5.285
  522    HA   PRO  69           HA       PRO  69  72.407  -4.882  -0.276
  523    HB2  PRO  69           HB2      PRO  69  72.959  -1.938  -0.374
  524    HB3  PRO  69           HB1      PRO  69  73.815  -3.217   0.509
  525    HG2  PRO  69           HG2      PRO  69  74.752  -2.187  -1.783
  526    HG3  PRO  69           HG1      PRO  69  75.001  -3.880  -1.330
  527    HD2  PRO  69           HD2      PRO  69  73.285  -2.760  -3.458
  528    HD3  PRO  69           HD1      PRO  69  73.909  -4.413  -3.268
  529    H    TRP  70           HN       TRP  70  70.227  -2.598  -1.801
  530    HA   TRP  70           HA       TRP  70  69.017  -1.716   0.686
  531    HD1  TRP  70           HD1      TRP  70  68.274  -3.841  -2.114
  532    HE1  TRP  70           HE1      TRP  70  67.113  -4.229  -4.381
  533    HE3  TRP  70           HE3      TRP  70  66.626   0.894  -3.083
  534    HZ2  TRP  70           HZ2      TRP  70  65.673  -2.728  -6.350
  535    HZ3  TRP  70           HZ3      TRP  70  65.366   1.387  -5.155
  536    HH2  TRP  70           HH2      TRP  70  64.886  -0.413  -6.789
  537    HB2  TRP  70           HB2      TRP  70  67.351  -0.635  -0.667
  538    HB3  TRP  70           HB1      TRP  70  68.908  -0.413  -1.451
  539    H    GLU  71           HN       GLU  71  69.256  -4.624   0.276
  540    HA   GLU  71           HA       GLU  71  66.446  -5.309   0.944
  541    HB2  GLU  71           HB2      GLU  71  68.079  -6.486  -1.300
  542    HB3  GLU  71           HB1      GLU  71  66.888  -7.484  -0.464
  543    HG2  GLU  71           HG2      GLU  71  65.091  -6.112  -1.128
  544    HG3  GLU  71           HG1      GLU  71  66.150  -4.754  -1.510
  545    H    ALA  72           HN       ALA  72  69.205  -7.429   0.246
  546    HA   ALA  72           HA       ALA  72  68.980  -8.645   2.891
  547    HB1  ALA  72           HB1      ALA  72  71.183  -9.036   0.845
  548    HB2  ALA  72           HB2      ALA  72  69.640  -9.888   0.781
  549    HB3  ALA  72           HB3      ALA  72  70.727 -10.135   2.148
  550    H1U  RCY  73           H1U      RCY  73  68.710   0.604   8.619
  551    H1S  RCY  73           H1S      RCY  73  70.302  -3.512   7.088
  552    HB1  RCY  73           HB1      RCY  73  70.036  -4.679   5.631
  553    HB2  RCY  73           HB2      RCY  73  69.977  -3.781   4.114
  554    HA   RCY  73           HA       RCY  73  72.062  -5.012   3.402
  555    HN1  RCY  73           HN1      RCY  73  69.447  -5.987   3.308
  556    H    ASN  74           HN       ASN  74  70.467  -6.615   6.189
  557    HA   ASN  74           HA       ASN  74  73.146  -7.263   7.273
  558    HB2  ASN  74           HB2      ASN  74  71.679  -8.217   9.181
  559    HB3  ASN  74           HB1      ASN  74  71.684  -6.467   8.956
  560   HD21  ASN  74          HD21      ASN  74  69.515  -6.095   9.709
  561   HD22  ASN  74          HD22      ASN  74  68.150  -6.680   8.887
  562    H    HIS  75           HN       HIS  75  73.993  -9.030   6.217
  563    HA   HIS  75           HA       HIS  75  72.843 -11.627   6.692
  564    HD1  HIS  75           HD1      HIS  75  74.449 -13.025   4.343
  565    HD2  HIS  75           HD2      HIS  75  70.321 -13.278   3.805
  566    HE1  HIS  75           HE1      HIS  75  73.970 -15.394   3.585
  567    HE2  HIS  75           HE2      HIS  75  71.460 -15.561   3.253
  568    HB2  HIS  75           HB2      HIS  75  71.318 -10.919   4.884
  569    HB3  HIS  75           HB1      HIS  75  72.701 -10.581   3.845
  570    H1U  RCY  76           H1U      RCY  76  76.959 -12.247  -2.453
  571    H1S  RCY  76           H1S      RCY  76  76.060  -8.892   0.356
  572    HB1  RCY  76           HB1      RCY  76  75.895 -11.565   1.864
  573    HB2  RCY  76           HB2      RCY  76  77.633 -11.651   2.153
  574    HA   RCY  76           HA       RCY  76  76.555 -12.734   4.014
  575    HN1  RCY  76           HN1      RCY  76  74.434 -10.935   3.649
  576    H    GLU  77           HN       GLU  77  76.158  -9.531   5.328
  577    HA   GLU  77           HA       GLU  77  78.809  -8.741   5.790
  578    HB2  GLU  77           HB2      GLU  77  76.225  -8.323   7.233
  579    HB3  GLU  77           HB1      GLU  77  77.706  -7.905   8.094
  580    HG2  GLU  77           HG2      GLU  77  77.114  -6.942   5.286
  581    HG3  GLU  77           HG1      GLU  77  76.676  -6.022   6.726
  582    H    LEU  78           HN       LEU  78  80.453  -9.650   6.912
  583    HA   LEU  78           HA       LEU  78  80.015 -12.110   8.411
  584    HG   LEU  78           HG       LEU  78  81.913 -13.420   7.545
  585    HB2  LEU  78           HB2      LEU  78  82.389 -10.429   7.670
  586    HB3  LEU  78           HB1      LEU  78  82.560 -11.595   8.982
  587   HD11  LEU  78          HD11      LEU  78  81.510 -12.793   5.044
  588   HD12  LEU  78          HD12      LEU  78  81.144 -11.188   5.675
  589   HD13  LEU  78          HD13      LEU  78  80.188 -12.577   6.191
  590   HD21  LEU  78          HD21      LEU  78  83.681 -13.314   5.828
  591   HD22  LEU  78          HD22      LEU  78  84.263 -12.660   7.359
  592   HD23  LEU  78          HD23      LEU  78  83.801 -11.569   6.053
  593    H    HIS  79           HN       HIS  79  79.650  -8.869   9.162
  594    HA   HIS  79           HA       HIS  79  79.127  -7.866  11.226
  595    HD1  HIS  79           HD1      HIS  79  76.503  -8.765  12.554
  596    HD2  HIS  79           HD2      HIS  79  79.878  -8.694  15.005
  597    HE1  HIS  79           HE1      HIS  79  75.825  -7.548  14.669
  598    HE2  HIS  79           HE2      HIS  79  77.871  -7.497  16.170
  599    HB2  HIS  79           HB2      HIS  79  78.401 -10.341  11.752
  600    HB3  HIS  79           HB1      HIS  79  79.888 -10.377  12.699
  601    H    GLU  80           HN       GLU  80  81.809  -7.838  10.042
  602    HA   GLU  80           HA       GLU  80  83.739  -8.177  12.189
  603    HB2  GLU  80           HB2      GLU  80  84.323  -8.241   9.738
  604    HB3  GLU  80           HB1      GLU  80  84.027  -6.504   9.675
  605    HG2  GLU  80           HG2      GLU  80  85.719  -6.237  11.533
  606    HG3  GLU  80           HG1      GLU  80  86.112  -7.945  11.331
  607    H    LEU  81           HN       LEU  81  83.719  -5.086  10.548
  608    HA   LEU  81           HA       LEU  81  83.501  -3.752  13.188
  609    HG   LEU  81           HG       LEU  81  83.243  -3.040   9.708
  610    HB2  LEU  81           HB2      LEU  81  84.160  -1.705  11.887
  611    HB3  LEU  81           HB1      LEU  81  85.348  -3.003  11.804
  612   HD11  LEU  81          HD11      LEU  81  83.699  -0.646   9.785
  613   HD12  LEU  81          HD12      LEU  81  84.486  -1.334   8.364
  614   HD13  LEU  81          HD13      LEU  81  85.437  -0.947   9.798
  615   HD21  LEU  81          HD21      LEU  81  86.251  -3.218   9.450
  616   HD22  LEU  81          HD22      LEU  81  85.024  -3.897   8.380
  617   HD23  LEU  81          HD23      LEU  81  85.278  -4.591   9.981
  618    H    ALA  82           HN       ALA  82  81.318  -4.915  11.203
  619    HA   ALA  82           HA       ALA  82  79.662  -2.671  10.502
  620    HB1  ALA  82           HB1      ALA  82  78.006  -4.284   9.938
  621    HB2  ALA  82           HB2      ALA  82  78.666  -5.467  11.069
  622    HB3  ALA  82           HB3      ALA  82  79.546  -5.070   9.593
  623    H    GLN  83           HN       GLN  83  77.350  -4.320  11.894
  624    HA   GLN  83           HA       GLN  83  76.012  -3.958  13.780
  625    HB2  GLN  83           HB2      GLN  83  77.940  -5.180  14.826
  626    HB3  GLN  83           HB1      GLN  83  78.680  -3.621  15.186
  627    HG2  GLN  83           HG2      GLN  83  75.850  -4.121  16.050
  628    HG3  GLN  83           HG1      GLN  83  77.170  -4.808  16.997
  629   HE21  GLN  83          HE21      GLN  83  75.309  -2.554  17.736
  630   HE22  GLN  83          HE22      GLN  83  76.319  -1.231  18.070
  631    H    TYR  84           HN       TYR  84  75.206  -1.914  12.965
  632    HA   TYR  84           HA       TYR  84  74.850   0.409  13.052
  633    HD1  TYR  84           HD2      TYR  84  73.613  -1.772  15.280
  634    HD2  TYR  84           HD1      TYR  84  73.668   2.522  15.405
  635    HE1  TYR  84           HE2      TYR  84  71.148  -1.748  15.553
  636    HE2  TYR  84           HE1      TYR  84  71.203   2.545  15.679
  637    HH   TYR  84           HH       TYR  84  69.439   0.048  16.649
  638    HB2  TYR  84           HB2      TYR  84  75.725  -0.409  15.786
  639    HB3  TYR  84           HB1      TYR  84  75.703   1.321  15.442
  640    H    GLY  85           HN       GLY  85  77.600  -0.777  12.302
  641    HA2  GLY  85           HA2      GLY  85  79.092   1.813  12.460
  642    HA3  GLY  85           HA1      GLY  85  79.917   0.257  12.620
  643    H    ILE  86           HN       ILE  86  77.234   0.984  10.468
  644    HA   ILE  86           HA       ILE  86  77.045   0.831   8.147
  645    HB   ILE  86           HB       ILE  86  79.985   1.594   8.196
  646   HG12  ILE  86          HG12      ILE  86  77.467   3.287   8.128
  647   HG13  ILE  86          HG11      ILE  86  78.656   3.230   9.429
  648   HG21  ILE  86          HG21      ILE  86  79.574   2.395   5.928
  649   HG22  ILE  86          HG22      ILE  86  77.871   1.952   6.050
  650   HG23  ILE  86          HG23      ILE  86  79.110   0.697   6.033
  651   HD11  ILE  86          HD11      ILE  86  79.155   5.184   8.122
  652   HD12  ILE  86          HD12      ILE  86  79.058   4.272   6.615
  653   HD13  ILE  86          HD13      ILE  86  80.389   3.985   7.736
  654    H1U  RCY  87           H1U      RCY  87  76.311   0.001   0.361
  655    H1S  RCY  87           H1S      RCY  87  79.201  -2.760   2.663
  656    HB1  RCY  87           HB1      RCY  87  77.179  -2.231   5.017
  657    HB2  RCY  87           HB2      RCY  87  76.688  -3.726   5.808
  658    HA   RCY  87           HA       RCY  87  78.093  -3.391   7.584
  659    HN1  RCY  87           HN1      RCY  87  77.136  -0.899   6.743
  Start of MODEL   96
    1    HA   MET   1           HA       MET   1  48.444  14.731   1.700
    2    HB2  MET   1           HB2      MET   1  47.039  15.786   4.157
    3    HB3  MET   1           HB1      MET   1  47.730  16.697   2.813
    4    HG2  MET   1           HG2      MET   1  45.257  14.949   2.756
    5    HG3  MET   1           HG1      MET   1  45.334  16.696   2.525
    6    HE1  MET   1           HE1      MET   1  44.578  13.701   0.850
    7    HE2  MET   1           HE2      MET   1  44.553  14.345  -0.790
    8    HE3  MET   1           HE3      MET   1  43.746  15.223   0.506
    9    H    ASN   2           HN       ASN   2  49.038  12.394   3.544
   10    HA   ASN   2           HA       ASN   2  51.389  13.605   4.806
   11    HB2  ASN   2           HB2      ASN   2  50.774  12.558   7.060
   12    HB3  ASN   2           HB1      ASN   2  49.888  14.018   6.617
   13   HD21  ASN   2          HD21      ASN   2  48.088  13.251   8.032
   14   HD22  ASN   2          HD22      ASN   2  47.034  12.043   7.474
   15    H    LEU   3           HN       LEU   3  52.479  11.671   6.185
   16    HA   LEU   3           HA       LEU   3  52.628   9.412   4.279
   17    HG   LEU   3           HG       LEU   3  54.123   7.683   5.132
   18    HB2  LEU   3           HB2      LEU   3  54.745  10.359   4.976
   19    HB3  LEU   3           HB1      LEU   3  54.314  10.187   6.676
   20   HD11  LEU   3          HD11      LEU   3  56.072   8.467   3.990
   21   HD12  LEU   3          HD12      LEU   3  56.659   7.397   5.263
   22   HD13  LEU   3          HD13      LEU   3  56.750   9.146   5.470
   23   HD21  LEU   3          HD21      LEU   3  53.986   8.101   7.679
   24   HD22  LEU   3          HD22      LEU   3  55.739   8.277   7.614
   25   HD23  LEU   3          HD23      LEU   3  54.987   6.755   7.137
   26    H    GLU   4           HN       GLU   4  51.750   7.436   4.711
   27    HA   GLU   4           HA       GLU   4  50.274   7.091   7.236
   28    HB2  GLU   4           HB2      GLU   4  49.335   6.455   4.972
   29    HB3  GLU   4           HB1      GLU   4  50.520   5.149   4.926
   30    HG2  GLU   4           HG2      GLU   4  48.492   4.201   5.796
   31    HG3  GLU   4           HG1      GLU   4  49.594   4.377   7.162
   32    HA   PRO   5           HA       PRO   5  53.630   5.070   9.402
   33    HB2  PRO   5           HB2      PRO   5  51.366   3.302  10.280
   34    HB3  PRO   5           HB1      PRO   5  52.653   4.042  11.252
   35    HG2  PRO   5           HG2      PRO   5  50.179   5.055  11.174
   36    HG3  PRO   5           HG1      PRO   5  51.612   6.085  11.317
   37    HD2  PRO   5           HD2      PRO   5  49.784   5.749   9.014
   38    HD3  PRO   5           HD1      PRO   5  50.898   7.084   9.383
   39    HA   PRO   6           HA       PRO   6  54.550   1.554   6.841
   40    HB2  PRO   6           HB2      PRO   6  56.328   0.203   8.413
   41    HB3  PRO   6           HB1      PRO   6  56.725   1.732   7.604
   42    HG2  PRO   6           HG2      PRO   6  55.957   1.245  10.438
   43    HG3  PRO   6           HG1      PRO   6  57.180   2.340   9.771
   44    HD2  PRO   6           HD2      PRO   6  54.705   3.190  10.593
   45    HD3  PRO   6           HD1      PRO   6  55.639   4.005   9.319
   46    H    LYS   7           HN       LYS   7  53.633  -0.450   6.463
   47    HA   LYS   7           HA       LYS   7  51.867  -1.573   8.501
   48    HB2  LYS   7           HB2      LYS   7  51.260  -3.191   6.768
   49    HB3  LYS   7           HB1      LYS   7  51.276  -1.566   6.086
   50    HG2  LYS   7           HG2      LYS   7  53.878  -2.345   5.695
   51    HG3  LYS   7           HG1      LYS   7  53.017  -3.870   5.484
   52    HD2  LYS   7           HD2      LYS   7  52.266  -1.290   4.081
   53    HD3  LYS   7           HD1      LYS   7  53.256  -2.557   3.356
   54    HE2  LYS   7           HE2      LYS   7  50.552  -3.192   4.527
   55    HE3  LYS   7           HE1      LYS   7  50.705  -2.589   2.877
   56    HZ1  LYS   7           HZ1      LYS   7  51.175  -4.651   2.267
   57    HZ2  LYS   7           HZ2      LYS   7  51.213  -5.187   3.879
   58    HZ3  LYS   7           HZ3      LYS   7  52.617  -4.561   3.156
   59    H    ALA   8           HN       ALA   8  52.419  -4.369   7.519
   60    HA   ALA   8           HA       ALA   8  54.461  -5.005   9.531
   61    HB1  ALA   8           HB1      ALA   8  53.079  -6.933   7.652
   62    HB2  ALA   8           HB2      ALA   8  52.324  -6.346   9.133
   63    HB3  ALA   8           HB3      ALA   8  53.813  -7.287   9.216
   64    H    GLU   9           HN       GLU   9  56.506  -4.493   8.786
   65    HA   GLU   9           HA       GLU   9  57.305  -4.974   6.025
   66    HB2  GLU   9           HB2      GLU   9  58.260  -3.167   7.528
   67    HB3  GLU   9           HB1      GLU   9  59.105  -4.444   8.403
   68    HG2  GLU   9           HG2      GLU   9  60.045  -5.172   6.134
   69    HG3  GLU   9           HG1      GLU   9  59.447  -3.634   5.511
   70    H1U  RCY  10           H1U      RCY  10  56.345  -3.498   8.132
   71    H1S  RCY  10           H1S      RCY  10  56.149  -7.879   9.971
   72    HB1  RCY  10           HB1      RCY  10  56.957 -10.892   7.245
   73    HB2  RCY  10           HB2      RCY  10  56.085  -9.908   6.069
   74    HA   RCY  10           HA       RCY  10  58.457  -9.072   7.761
   75    HN1  RCY  10           HN1      RCY  10  56.484  -7.356   6.400
   76    H    ARG  11           HN       ARG  11  59.146 -11.096   6.396
   77    HA   ARG  11           HA       ARG  11  60.645 -10.093   4.113
   78    HE   ARG  11           HE       ARG  11  64.155 -13.891   2.375
   79    HB2  ARG  11           HB2      ARG  11  61.563 -11.823   5.630
   80    HB3  ARG  11           HB1      ARG  11  60.291 -12.933   5.121
   81    HG2  ARG  11           HG2      ARG  11  61.151 -13.115   2.936
   82    HG3  ARG  11           HG1      ARG  11  62.103 -11.638   3.091
   83    HD2  ARG  11           HD2      ARG  11  63.748 -12.675   4.385
   84    HD3  ARG  11           HD1      ARG  11  62.663 -13.960   4.913
   85   HH11  ARG  11          HH21      ARG  11  61.619 -15.216   4.299
   86   HH12  ARG  11          HH22      ARG  11  61.530 -16.694   3.402
   87   HH21  ARG  11          HH11      ARG  11  64.053 -15.814   1.192
   88   HH22  ARG  11          HH12      ARG  11  62.908 -17.033   1.643
   89    H    SER  12           HN       SER  12  57.540 -11.485   4.547
   90    HA   SER  12           HA       SER  12  57.380 -12.498   1.775
   91    HG   SER  12           HG       SER  12  54.968 -12.598   1.421
   92    HB2  SER  12           HB2      SER  12  56.188 -13.845   3.331
   93    HB3  SER  12           HB1      SER  12  55.464 -12.442   4.111
   94    H    ALA  13           HN       ALA  13  56.795  -9.590   3.503
   95    HA   ALA  13           HA       ALA  13  54.620  -8.423   2.189
   96    HB1  ALA  13           HB1      ALA  13  55.837  -7.280   3.987
   97    HB2  ALA  13           HB2      ALA  13  55.759  -6.245   2.561
   98    HB3  ALA  13           HB3      ALA  13  57.249  -7.107   2.943
   99    H    THR  14           HN       THR  14  54.420  -7.196   0.241
  100    HA   THR  14           HA       THR  14  56.385  -7.982  -1.855
  101    HB   THR  14           HB       THR  14  54.257  -8.545  -2.634
  102    HG1  THR  14           HG1      THR  14  55.410  -6.466  -3.689
  103   HG21  THR  14          HG21      THR  14  52.869  -7.734  -0.891
  104   HG22  THR  14          HG22      THR  14  52.310  -6.889  -2.335
  105   HG23  THR  14          HG23      THR  14  53.351  -6.061  -1.177
  106    H    ARG  15           HN       ARG  15  54.382  -5.241  -2.450
  107    HA   ARG  15           HA       ARG  15  56.783  -3.543  -2.679
  108    HE   ARG  15           HE       ARG  15  52.835  -1.512  -4.589
  109    HB2  ARG  15           HB2      ARG  15  55.151  -3.474  -4.492
  110    HB3  ARG  15           HB1      ARG  15  53.869  -3.043  -3.362
  111    HG2  ARG  15           HG2      ARG  15  56.202  -1.265  -3.194
  112    HG3  ARG  15           HG1      ARG  15  55.415  -1.234  -4.773
  113    HD2  ARG  15           HD2      ARG  15  53.923  -0.943  -2.153
  114    HD3  ARG  15           HD1      ARG  15  54.477   0.425  -3.118
  115   HH11  ARG  15          HH21      ARG  15  53.012   1.342  -2.662
  116   HH12  ARG  15          HH22      ARG  15  51.508   1.982  -3.236
  117   HH21  ARG  15          HH11      ARG  15  50.870  -0.692  -5.349
  118   HH22  ARG  15          HH12      ARG  15  50.296   0.831  -4.756
  119    H    VAL  16           HN       VAL  16  57.200  -1.757  -1.381
  120    HA   VAL  16           HA       VAL  16  55.225  -1.112   0.764
  121    HB   VAL  16           HB       VAL  16  57.270  -0.877   2.305
  122   HG11  VAL  16          HG11      VAL  16  55.769  -2.661   2.747
  123   HG12  VAL  16          HG12      VAL  16  57.350  -3.433   2.629
  124   HG13  VAL  16          HG13      VAL  16  56.225  -3.517   1.274
  125   HG21  VAL  16          HG21      VAL  16  58.851  -1.072   0.283
  126   HG22  VAL  16          HG22      VAL  16  58.506  -2.801   0.326
  127   HG23  VAL  16          HG23      VAL  16  59.273  -2.020   1.709
  128    H    MET  17           HN       MET  17  58.123   0.386   1.412
  129    HA   MET  17           HA       MET  17  58.674   2.675   1.299
  130    HB2  MET  17           HB2      MET  17  58.148   1.935  -1.591
  131    HB3  MET  17           HB1      MET  17  58.846   3.480  -1.106
  132    HG2  MET  17           HG2      MET  17  60.024   0.857  -0.188
  133    HG3  MET  17           HG1      MET  17  60.493   1.597  -1.719
  134    HE1  MET  17           HE1      MET  17  62.713   1.035  -0.144
  135    HE2  MET  17           HE2      MET  17  63.601   2.514   0.215
  136    HE3  MET  17           HE3      MET  17  62.944   2.258  -1.400
  137    H    GLY  18           HN       GLY  18  57.308   4.132  -1.176
  138    HA2  GLY  18           HA2      GLY  18  54.888   4.921   0.387
  139    HA3  GLY  18           HA1      GLY  18  55.729   5.973  -0.754
  140    H    GLY  19           HN       GLY  19  55.474   5.560  -3.029
  141    HA2  GLY  19           HA2      GLY  19  53.612   3.461  -3.895
  142    HA3  GLY  19           HA1      GLY  19  52.993   5.106  -4.061
  143    HA   PRO  20           HA       PRO  20  54.882   5.700  -8.001
  144    HB2  PRO  20           HB2      PRO  20  56.257   8.095  -6.842
  145    HB3  PRO  20           HB1      PRO  20  55.262   7.965  -8.305
  146    HG2  PRO  20           HG2      PRO  20  54.321   9.061  -6.063
  147    HG3  PRO  20           HG1      PRO  20  53.291   8.102  -7.138
  148    HD2  PRO  20           HD2      PRO  20  54.401   7.384  -4.466
  149    HD3  PRO  20           HD1      PRO  20  52.911   6.825  -5.258
  150    H1U  RCY  21           H1U      RCY  21  62.662  -2.568  -7.858
  151    H1S  RCY  21           H1S      RCY  21  60.259   0.894  -7.317
  152    HB1  RCY  21           HB1      RCY  21  58.546   1.683  -7.538
  153    HB2  RCY  21           HB2      RCY  21  57.441   2.159  -6.250
  154    HA   RCY  21           HA       RCY  21  59.038   4.402  -6.533
  155    HN1  RCY  21           HN1      RCY  21  56.289   3.746  -7.368
  156    H    THR  22           HN       THR  22  60.525   5.035  -8.014
  157    HA   THR  22           HA       THR  22  60.051   5.058 -10.818
  158    HB   THR  22           HB       THR  22  62.586   5.424 -10.939
  159    HG1  THR  22           HG1      THR  22  63.563   5.735  -8.913
  160   HG21  THR  22          HG21      THR  22  61.161   7.342 -10.884
  161   HG22  THR  22          HG22      THR  22  62.399   7.621  -9.659
  162   HG23  THR  22          HG23      THR  22  60.785   7.097  -9.178
  163    HA   PRO  23           HA       PRO  23  60.888   0.944 -12.222
  164    HB2  PRO  23           HB2      PRO  23  62.826   2.103 -14.174
  165    HB3  PRO  23           HB1      PRO  23  61.418   1.064 -14.463
  166    HG2  PRO  23           HG2      PRO  23  61.385   3.676 -15.021
  167    HG3  PRO  23           HG1      PRO  23  59.947   2.820 -14.443
  168    HD2  PRO  23           HD2      PRO  23  61.712   4.732 -12.981
  169    HD3  PRO  23           HD1      PRO  23  59.977   4.409 -12.770
  170    H    ARG  24           HN       ARG  24  63.426   0.168 -13.465
  171    HA   ARG  24           HA       ARG  24  65.411   0.593 -11.295
  172    HE   ARG  24           HE       ARG  24  63.309  -5.083 -13.538
  173    HB2  ARG  24           HB2      ARG  24  65.851  -1.934 -11.366
  174    HB3  ARG  24           HB1      ARG  24  64.389  -1.415 -10.526
  175    HG2  ARG  24           HG2      ARG  24  63.007  -1.975 -12.411
  176    HG3  ARG  24           HG1      ARG  24  64.416  -2.236 -13.440
  177    HD2  ARG  24           HD2      ARG  24  65.060  -4.193 -12.207
  178    HD3  ARG  24           HD1      ARG  24  63.881  -3.855 -10.939
  179   HH11  ARG  24          HH21      ARG  24  62.158  -3.349 -10.790
  180   HH12  ARG  24          HH22      ARG  24  60.516  -3.865 -10.986
  181   HH21  ARG  24          HH11      ARG  24  61.172  -5.767 -13.810
  182   HH22  ARG  24          HH12      ARG  24  59.958  -5.234 -12.696
  183    H    LYS  25           HN       LYS  25  65.830   1.834 -13.574
  184    HA   LYS  25           HA       LYS  25  67.057   0.233 -15.648
  185    HB2  LYS  25           HB2      LYS  25  66.087   2.469 -16.072
  186    HB3  LYS  25           HB1      LYS  25  67.289   3.197 -15.012
  187    HG2  LYS  25           HG2      LYS  25  68.424   1.465 -17.117
  188    HG3  LYS  25           HG1      LYS  25  67.602   2.903 -17.725
  189    HD2  LYS  25           HD2      LYS  25  69.066   4.360 -16.656
  190    HD3  LYS  25           HD1      LYS  25  69.496   3.181 -15.416
  191    HE2  LYS  25           HE2      LYS  25  71.401   3.334 -16.850
  192    HE3  LYS  25           HE1      LYS  25  70.597   1.825 -17.281
  193    HZ1  LYS  25           HZ1      LYS  25  70.902   4.262 -18.813
  194    HZ2  LYS  25           HZ2      LYS  25  69.355   3.564 -18.884
  195    HZ3  LYS  25           HZ3      LYS  25  70.719   2.661 -19.343
  196    H    GLY  26           HN       GLY  26  69.532   1.113 -16.156
  197    HA2  GLY  26           HA2      GLY  26  71.293  -0.219 -14.525
  198    HA3  GLY  26           HA1      GLY  26  71.771   1.235 -15.400
  199    HA   PRO  27           HA       PRO  27  72.204   1.400 -10.555
  200    HB2  PRO  27           HB2      PRO  27  74.525   2.863 -11.789
  201    HB3  PRO  27           HB1      PRO  27  74.468   1.917 -10.288
  202    HG2  PRO  27           HG2      PRO  27  75.451   0.927 -12.585
  203    HG3  PRO  27           HG1      PRO  27  74.633  -0.079 -11.380
  204    HD2  PRO  27           HD2      PRO  27  73.727   0.663 -14.070
  205    HD3  PRO  27           HD1      PRO  27  73.082  -0.579 -12.976
  206    HA   PRO  28           HA       PRO  28  70.251   5.311  -9.891
  207    HB2  PRO  28           HB2      PRO  28  72.780   6.061  -8.451
  208    HB3  PRO  28           HB1      PRO  28  71.092   6.285  -7.949
  209    HG2  PRO  28           HG2      PRO  28  72.608   4.290  -7.000
  210    HG3  PRO  28           HG1      PRO  28  70.867   4.111  -7.266
  211    HD2  PRO  28           HD2      PRO  28  73.103   2.882  -8.747
  212    HD3  PRO  28           HD1      PRO  28  71.391   2.409  -8.701
  213    H    LYS  29           HN       LYS  29  70.521   7.667 -10.353
  214    HA   LYS  29           HA       LYS  29  71.475   8.274 -12.872
  215    HB2  LYS  29           HB2      LYS  29  70.116   9.765 -11.318
  216    HB3  LYS  29           HB1      LYS  29  71.643  10.234 -10.571
  217    HG2  LYS  29           HG2      LYS  29  72.452  11.211 -12.584
  218    HG3  LYS  29           HG1      LYS  29  71.197  10.437 -13.553
  219    HD2  LYS  29           HD2      LYS  29  69.481  11.782 -12.345
  220    HD3  LYS  29           HD1      LYS  29  70.775  12.608 -11.477
  221    HE2  LYS  29           HE2      LYS  29  70.216  14.021 -13.325
  222    HE3  LYS  29           HE1      LYS  29  71.733  13.231 -13.757
  223    HZ1  LYS  29           HZ1      LYS  29  69.225  13.095 -15.057
  224    HZ2  LYS  29           HZ2      LYS  29  69.710  11.538 -14.581
  225    HZ3  LYS  29           HZ3      LYS  29  70.724  12.483 -15.564
  226    H1U  RCY  30           H1U      RCY  30  82.824   8.869 -10.832
  227    H1S  RCY  30           H1S      RCY  30  78.815   9.260 -10.453
  228    HB1  RCY  30           HB1      RCY  30  76.198   8.697 -10.930
  229    HB2  RCY  30           HB2      RCY  30  75.154  10.102 -10.716
  230    HA   RCY  30           HA       RCY  30  75.648  10.348 -13.352
  231    HN1  RCY  30           HN1      RCY  30  73.355   9.796 -13.410
  232    H    LYS  31           HN       LYS  31  74.227   7.568 -13.979
  233    HA   LYS  31           HA       LYS  31  74.906   5.464 -14.791
  234    HB2  LYS  31           HB2      LYS  31  77.159   7.235 -15.780
  235    HB3  LYS  31           HB1      LYS  31  76.768   5.636 -16.415
  236    HG2  LYS  31           HG2      LYS  31  74.687   6.362 -17.281
  237    HG3  LYS  31           HG1      LYS  31  74.703   7.835 -16.309
  238    HD2  LYS  31           HD2      LYS  31  76.698   8.611 -17.600
  239    HD3  LYS  31           HD1      LYS  31  76.545   7.187 -18.629
  240    HE2  LYS  31           HE2      LYS  31  74.762   9.587 -18.437
  241    HE3  LYS  31           HE1      LYS  31  75.332   8.729 -19.869
  242    HZ1  LYS  31           HZ1      LYS  31  73.836   6.973 -19.477
  243    HZ2  LYS  31           HZ2      LYS  31  72.931   8.397 -19.275
  244    HZ3  LYS  31           HZ3      LYS  31  73.459   7.523 -17.917
  245    H    GLN  32           HN       GLN  32  77.261   4.193 -15.129
  246    HA   GLN  32           HA       GLN  32  78.290   3.984 -12.341
  247    HB2  GLN  32           HB2      GLN  32  77.402   1.923 -13.339
  248    HB3  GLN  32           HB1      GLN  32  78.513   2.084 -14.698
  249    HG2  GLN  32           HG2      GLN  32  79.707   2.134 -11.967
  250    HG3  GLN  32           HG1      GLN  32  79.103   0.582 -12.548
  251   HE21  GLN  32          HE21      GLN  32  79.742   0.474 -15.184
  252   HE22  GLN  32          HE22      GLN  32  81.405   0.694 -15.439
  253    H    ARG  33           HN       ARG  33  79.812   5.695 -12.375
  254    HA   ARG  33           HA       ARG  33  82.194   5.196 -14.119
  255    HE   ARG  33           HE       ARG  33  79.269   7.881 -17.308
  256    HB2  ARG  33           HB2      ARG  33  80.981   7.871 -13.353
  257    HB3  ARG  33           HB1      ARG  33  82.525   7.671 -14.183
  258    HG2  ARG  33           HG2      ARG  33  81.229   6.323 -15.939
  259    HG3  ARG  33           HG1      ARG  33  79.766   6.963 -15.190
  260    HD2  ARG  33           HD2      ARG  33  80.764   9.283 -15.494
  261    HD3  ARG  33           HD1      ARG  33  82.007   8.527 -16.492
  262   HH11  ARG  33          HH21      ARG  33  81.975  10.003 -17.539
  263   HH12  ARG  33          HH22      ARG  33  81.536  10.609 -19.101
  264   HH21  ARG  33          HH11      ARG  33  78.679   8.660 -19.347
  265   HH22  ARG  33          HH12      ARG  33  79.669   9.849 -20.124
  266    H    GLN  34           HN       GLN  34  82.958   3.996 -12.228
  267    HA   GLN  34           HA       GLN  34  83.236   5.047  -9.624
  268    HB2  GLN  34           HB2      GLN  34  85.566   3.471 -10.287
  269    HB3  GLN  34           HB1      GLN  34  84.192   3.031  -9.276
  270    HG2  GLN  34           HG2      GLN  34  84.296   1.448 -11.101
  271    HG3  GLN  34           HG1      GLN  34  82.909   2.502 -11.383
  272   HE21  GLN  34          HE21      GLN  34  82.799   3.078 -13.552
  273   HE22  GLN  34          HE22      GLN  34  84.135   3.411 -14.544
  274    H    THR  35           HN       THR  35  85.118   5.696 -12.519
  275    HA   THR  35           HA       THR  35  86.811   7.289 -12.884
  276    HB   THR  35           HB       THR  35  86.414   8.454 -10.152
  277    HG1  THR  35           HG1      THR  35  84.537   8.891 -12.207
  278   HG21  THR  35          HG21      THR  35  86.698  10.522 -11.319
  279   HG22  THR  35          HG22      THR  35  86.396   9.759 -12.880
  280   HG23  THR  35          HG23      THR  35  87.884   9.409 -12.001
  281    H    ARG  36           HN       ARG  36  86.887   4.850 -10.797
  282    HA   ARG  36           HA       ARG  36  88.433   4.034  -9.178
  283    HE   ARG  36           HE       ARG  36  92.453   5.858 -13.133
  284    HB2  ARG  36           HB2      ARG  36  90.318   3.183 -10.332
  285    HB3  ARG  36           HB1      ARG  36  89.039   3.285 -11.535
  286    HG2  ARG  36           HG2      ARG  36  90.201   4.786 -12.770
  287    HG3  ARG  36           HG1      ARG  36  90.537   5.784 -11.355
  288    HD2  ARG  36           HD2      ARG  36  92.377   4.258 -10.721
  289    HD3  ARG  36           HD1      ARG  36  92.052   3.279 -12.151
  290   HH11  ARG  36          HH21      ARG  36  94.147   3.580 -11.176
  291   HH12  ARG  36          HH22      ARG  36  95.716   4.114 -11.679
  292   HH21  ARG  36          HH11      ARG  36  94.492   6.568 -13.802
  293   HH22  ARG  36          HH12      ARG  36  95.912   5.806 -13.166
  294    H    GLN  37           HN       GLN  37  88.150   6.898  -8.846
  295    HA   GLN  37           HA       GLN  37  90.960   7.673  -8.161
  296    HB2  GLN  37           HB2      GLN  37  89.859   9.279  -9.638
  297    HB3  GLN  37           HB1      GLN  37  88.478   9.377  -8.544
  298    HG2  GLN  37           HG2      GLN  37  89.772  10.428  -6.840
  299    HG3  GLN  37           HG1      GLN  37  91.289  10.037  -7.651
  300   HE21  GLN  37          HE21      GLN  37  92.025  12.195  -8.035
  301   HE22  GLN  37          HE22      GLN  37  91.191  13.294  -9.025
  302    H1U  RCY  38           H1U      RCY  38  83.988   2.630  -1.390
  303    H1S  RCY  38           H1S      RCY  38  85.119   3.807  -5.975
  304    HB1  RCY  38           HB1      RCY  38  85.958   7.817  -4.695
  305    HB2  RCY  38           HB2      RCY  38  86.314   6.359  -3.770
  306    HA   RCY  38           HA       RCY  38  88.219   8.148  -4.298
  307    HN1  RCY  38           HN1      RCY  38  87.824   6.915  -6.904
  308    H    LYS  39           HN       LYS  39  90.015   5.887  -5.652
  309    HA   LYS  39           HA       LYS  39  90.072   3.999  -3.352
  310    HB2  LYS  39           HB2      LYS  39  91.363   3.975  -6.091
  311    HB3  LYS  39           HB1      LYS  39  91.775   2.805  -4.837
  312    HG2  LYS  39           HG2      LYS  39  88.881   3.235  -5.466
  313    HG3  LYS  39           HG1      LYS  39  89.848   2.292  -6.600
  314    HD2  LYS  39           HD2      LYS  39  90.471   0.723  -4.883
  315    HD3  LYS  39           HD1      LYS  39  89.768   1.738  -3.624
  316    HE2  LYS  39           HE2      LYS  39  87.539   1.353  -4.449
  317    HE3  LYS  39           HE1      LYS  39  88.154   0.556  -5.897
  318    HZ1  LYS  39           HZ1      LYS  39  89.086  -1.182  -4.499
  319    HZ2  LYS  39           HZ2      LYS  39  87.408  -1.053  -4.264
  320    HZ3  LYS  39           HZ3      LYS  39  88.482  -0.418  -3.110
  321    H    SER  40           HN       SER  40  91.702   4.099  -1.844
  322    HA   SER  40           HA       SER  40  94.338   5.078  -2.369
  323    HG   SER  40           HG       SER  40  93.723   8.046  -0.132
  324    HB2  SER  40           HB2      SER  40  93.678   7.298  -2.483
  325    HB3  SER  40           HB1      SER  40  92.301   7.051  -1.414
  326    H    LYS  41           HN       LYS  41  91.768   4.499  -0.017
  327    HA   LYS  41           HA       LYS  41  93.799   3.977   2.090
  328    HB2  LYS  41           HB2      LYS  41  91.643   3.639   3.490
  329    HB3  LYS  41           HB1      LYS  41  92.053   5.275   2.977
  330    HG2  LYS  41           HG2      LYS  41  90.353   5.361   1.406
  331    HG3  LYS  41           HG1      LYS  41  90.359   3.616   1.152
  332    HD2  LYS  41           HD2      LYS  41  89.368   3.312   3.416
  333    HD3  LYS  41           HD1      LYS  41  89.288   5.065   3.591
  334    HE2  LYS  41           HE2      LYS  41  87.652   5.286   1.925
  335    HE3  LYS  41           HE1      LYS  41  88.043   3.727   1.201
  336    HZ1  LYS  41           HZ1      LYS  41  85.973   4.091   2.805
  337    HZ2  LYS  41           HZ2      LYS  41  87.144   3.687   3.968
  338    HZ3  LYS  41           HZ3      LYS  41  86.800   2.614   2.696
  339    HA   PRO  42           HA       PRO  42  93.097  -0.352   0.903
  340    HB2  PRO  42           HB2      PRO  42  95.327  -1.382   2.060
  341    HB3  PRO  42           HB1      PRO  42  95.383  -0.485   0.530
  342    HG2  PRO  42           HG2      PRO  42  96.098   0.411   3.269
  343    HG3  PRO  42           HG1      PRO  42  96.853   0.804   1.717
  344    HD2  PRO  42           HD2      PRO  42  95.081   2.465   3.081
  345    HD3  PRO  42           HD1      PRO  42  95.440   2.574   1.345
  346    HA   PRO  43           HA       PRO  43  91.194  -2.023   4.529
  347    HB2  PRO  43           HB2      PRO  43  91.854  -4.711   4.321
  348    HB3  PRO  43           HB1      PRO  43  90.555  -3.920   3.410
  349    HG2  PRO  43           HG2      PRO  43  93.312  -4.616   2.549
  350    HG3  PRO  43           HG1      PRO  43  91.792  -4.680   1.641
  351    HD2  PRO  43           HD2      PRO  43  93.600  -2.678   1.291
  352    HD3  PRO  43           HD1      PRO  43  91.849  -2.415   1.117
  353    H    LYS  44           HN       LYS  44  91.764  -2.164   6.674
  354    HA   LYS  44           HA       LYS  44  94.283  -3.455   7.479
  355    HB2  LYS  44           HB2      LYS  44  93.807  -0.479   7.717
  356    HB3  LYS  44           HB1      LYS  44  94.927  -1.333   8.776
  357    HG2  LYS  44           HG2      LYS  44  95.942  -2.277   6.575
  358    HG3  LYS  44           HG1      LYS  44  95.088  -0.947   5.792
  359    HD2  LYS  44           HD2      LYS  44  96.206   0.528   7.637
  360    HD3  LYS  44           HD1      LYS  44  97.320  -0.829   7.806
  361    HE2  LYS  44           HE2      LYS  44  98.425   0.369   6.166
  362    HE3  LYS  44           HE1      LYS  44  97.392  -0.635   5.149
  363    HZ1  LYS  44           HZ1      LYS  44  97.112   1.550   4.387
  364    HZ2  LYS  44           HZ2      LYS  44  96.974   2.181   5.959
  365    HZ3  LYS  44           HZ3      LYS  44  95.725   1.229   5.310
  366    H    LYS  45           HN       LYS  45  91.191  -3.279   7.933
  367    HA   LYS  45           HA       LYS  45  89.837  -3.938   9.742
  368    HB2  LYS  45           HB2      LYS  45  92.143  -5.005  10.491
  369    HB3  LYS  45           HB1      LYS  45  92.140  -3.686  11.659
  370    HG2  LYS  45           HG2      LYS  45  90.984  -5.290  12.867
  371    HG3  LYS  45           HG1      LYS  45  89.638  -4.494  12.052
  372    HD2  LYS  45           HD2      LYS  45  89.730  -6.193  10.255
  373    HD3  LYS  45           HD1      LYS  45  91.051  -7.002  11.098
  374    HE2  LYS  45           HE2      LYS  45  88.359  -6.491  12.382
  375    HE3  LYS  45           HE1      LYS  45  88.736  -7.978  11.513
  376    HZ1  LYS  45           HZ1      LYS  45  90.138  -8.674  13.119
  377    HZ2  LYS  45           HZ2      LYS  45  89.175  -7.676  14.100
  378    HZ3  LYS  45           HZ3      LYS  45  90.666  -7.111  13.512
  379    H    GLY  46           HN       GLY  46  89.057  -1.678   9.278
  380    HA2  GLY  46           HA2      GLY  46  89.913   0.347  11.265
  381    HA3  GLY  46           HA1      GLY  46  88.847   0.642   9.891
  382    H    VAL  47           HN       VAL  47  86.705  -0.684  10.047
  383    HA   VAL  47           HA       VAL  47  84.692  -1.023  11.194
  384    HB   VAL  47           HB       VAL  47  86.388  -1.511  13.653
  385   HG11  VAL  47          HG11      VAL  47  84.533  -3.245  13.982
  386   HG12  VAL  47          HG12      VAL  47  83.687  -2.442  12.659
  387   HG13  VAL  47          HG13      VAL  47  84.051  -1.556  14.139
  388   HG21  VAL  47          HG21      VAL  47  86.478  -3.892  12.861
  389   HG22  VAL  47          HG22      VAL  47  87.402  -2.786  11.844
  390   HG23  VAL  47          HG23      VAL  47  85.820  -3.358  11.313
  391    H    GLN  48           HN       GLN  48  86.754   1.481  11.801
  392    HA   GLN  48           HA       GLN  48  85.202   2.673  14.016
  393    HB2  GLN  48           HB2      GLN  48  87.296   4.166  12.460
  394    HB3  GLN  48           HB1      GLN  48  86.901   4.263  14.177
  395    HG2  GLN  48           HG2      GLN  48  87.707   1.777  14.246
  396    HG3  GLN  48           HG1      GLN  48  88.510   2.174  12.727
  397   HE21  GLN  48          HE21      GLN  48  88.629   2.606  16.189
  398   HE22  GLN  48          HE22      GLN  48  90.024   3.572  16.222
  399    H    GLY  49           HN       GLY  49  84.448   2.214  10.946
  400    HA2  GLY  49           HA2      GLY  49  82.578   3.308   9.874
  401    HA3  GLY  49           HA1      GLY  49  82.960   4.779  10.771
  402    H1U  RCY  50           H1U      RCY  50  81.569   0.768  11.355
  403    H1S  RCY  50           H1S      RCY  50  84.077   1.915   7.611
  404    HB1  RCY  50           HB1      RCY  50  85.483   4.516   5.273
  405    HB2  RCY  50           HB2      RCY  50  84.674   5.605   6.400
  406    HA   RCY  50           HA       RCY  50  86.478   3.270   6.988
  407    HN1  RCY  50           HN1      RCY  50  85.168   2.744   8.862
  408    H    GLY  51           HN       GLY  51  85.271   6.500   7.928
  409    HA2  GLY  51           HA2      GLY  51  87.719   7.241   9.275
  410    HA3  GLY  51           HA1      GLY  51  87.676   7.892   7.635
  411    H    ASP  52           HN       ASP  52  84.801   7.404   9.602
  412    HA   ASP  52           HA       ASP  52  83.236   8.937  10.431
  413    HB2  ASP  52           HB2      ASP  52  85.424   9.681  11.636
  414    HB3  ASP  52           HB1      ASP  52  85.417  11.019  10.486
  415    H    ASP  53           HN       ASP  53  83.704   8.694   7.553
  416    HA   ASP  53           HA       ASP  53  83.168  11.476   6.608
  417    HB2  ASP  53           HB2      ASP  53  84.969  10.004   5.522
  418    HB3  ASP  53           HB1      ASP  53  83.639   9.040   4.880
  419    H    ILE  54           HN       ILE  54  81.011  11.905   6.678
  420    HA   ILE  54           HA       ILE  54  79.135   9.810   5.637
  421    HB   ILE  54           HB       ILE  54  77.523  11.372   7.196
  422   HG12  ILE  54          HG12      ILE  54  79.816  12.482   7.893
  423   HG13  ILE  54          HG11      ILE  54  78.596  12.144   9.121
  424   HG21  ILE  54          HG21      ILE  54  77.429   9.011   7.379
  425   HG22  ILE  54          HG22      ILE  54  77.944   9.549   8.977
  426   HG23  ILE  54          HG23      ILE  54  79.126   8.896   7.843
  427   HD11  ILE  54          HD11      ILE  54  79.758  10.313   9.966
  428   HD12  ILE  54          HD12      ILE  54  81.091  11.365   9.491
  429   HD13  ILE  54          HD13      ILE  54  80.611  10.025   8.450
  430    HA   PRO  55           HA       PRO  55  78.670  13.623   3.088
  431    HB2  PRO  55           HB2      PRO  55  79.180  12.550   0.672
  432    HB3  PRO  55           HB1      PRO  55  80.490  12.961   1.798
  433    HG2  PRO  55           HG2      PRO  55  79.334  10.309   1.138
  434    HG3  PRO  55           HG1      PRO  55  81.006  10.754   1.514
  435    HD2  PRO  55           HD2      PRO  55  79.166   9.613   3.314
  436    HD3  PRO  55           HD1      PRO  55  80.699  10.397   3.751
  437    H    GLY  56           HN       GLY  56  77.501  10.363   2.163
  438    HA2  GLY  56           HA2      GLY  56  75.147  11.522   0.835
  439    HA3  GLY  56           HA1      GLY  56  75.527   9.805   0.957
  440    H    MET  57           HN       MET  57  75.638  11.699   3.869
  441    HA   MET  57           HA       MET  57  73.587  10.051   5.083
  442    HB2  MET  57           HB2      MET  57  75.393  10.915   6.458
  443    HB3  MET  57           HB1      MET  57  74.967  12.575   6.044
  444    HG2  MET  57           HG2      MET  57  72.821  10.869   7.219
  445    HG3  MET  57           HG1      MET  57  74.100  11.419   8.302
  446    HE1  MET  57           HE1      MET  57  71.451  13.900   9.322
  447    HE2  MET  57           HE2      MET  57  72.395  12.456   9.680
  448    HE3  MET  57           HE3      MET  57  70.958  12.333   8.667
  449    H    GLU  58           HN       GLU  58  73.415  12.683   3.020
  450    HA   GLU  58           HA       GLU  58  70.673  13.380   4.016
  451    HB2  GLU  58           HB2      GLU  58  72.774  15.127   2.709
  452    HB3  GLU  58           HB1      GLU  58  71.084  15.607   2.858
  453    HG2  GLU  58           HG2      GLU  58  72.755  14.740   5.228
  454    HG3  GLU  58           HG1      GLU  58  72.613  16.424   4.722
  455    H    GLY  59           HN       GLY  59  72.332  11.782   1.650
  456    HA2  GLY  59           HA2      GLY  59  70.672  12.673  -0.620
  457    HA3  GLY  59           HA1      GLY  59  71.926  11.434  -0.679
  458    H1U  RCY  60           H1U      RCY  60  74.767   3.636   0.609
  459    H1S  RCY  60           H1S      RCY  60  71.907   6.296   2.606
  460    HB1  RCY  60           HB1      RCY  60  69.144   7.461   0.623
  461    HB2  RCY  60           HB2      RCY  60  68.778   7.458   2.348
  462    HA   RCY  60           HA       RCY  60  67.906   9.366   0.544
  463    HN1  RCY  60           HN1      RCY  60  69.961  10.910   1.991
  464    H    GLY  61           HN       GLY  61  69.069   8.792   3.836
  465    HA2  GLY  61           HA2      GLY  61  67.017  10.531   5.008
  466    HA3  GLY  61           HA1      GLY  61  66.691   8.806   5.185
  467    H    THR  62           HN       THR  62  67.401   8.000   7.088
  468    HA   THR  62           HA       THR  62  70.034   8.903   8.136
  469    HB   THR  62           HB       THR  62  69.205   9.405  10.300
  470    HG1  THR  62           HG1      THR  62  67.628   7.543  10.026
  471   HG21  THR  62          HG21      THR  62  67.622  11.183   9.917
  472   HG22  THR  62          HG22      THR  62  67.053  10.425   8.431
  473   HG23  THR  62          HG23      THR  62  68.679  11.103   8.508
  474    H    ASP  63           HN       ASP  63  68.356   6.407   7.061
  475    HA   ASP  63           HA       ASP  63  68.554   4.475   9.200
  476    HB2  ASP  63           HB2      ASP  63  67.078   4.184   7.209
  477    HB3  ASP  63           HB1      ASP  63  68.515   3.996   6.204
  478    H    ILE  64           HN       ILE  64  70.973   6.171   8.240
  479    HA   ILE  64           HA       ILE  64  72.900   3.898   8.279
  480    HB   ILE  64           HB       ILE  64  73.208   6.349   6.519
  481   HG12  ILE  64          HG12      ILE  64  72.357   3.525   5.799
  482   HG13  ILE  64          HG11      ILE  64  71.344   4.966   5.708
  483   HG21  ILE  64          HG21      ILE  64  75.087   5.150   5.580
  484   HG22  ILE  64          HG22      ILE  64  74.693   3.707   6.514
  485   HG23  ILE  64          HG23      ILE  64  75.277   5.156   7.333
  486   HD11  ILE  64          HD11      ILE  64  73.221   5.910   4.171
  487   HD12  ILE  64          HD12      ILE  64  72.107   4.720   3.497
  488   HD13  ILE  64          HD13      ILE  64  73.721   4.227   4.011
  489    H    THR  65           HN       THR  65  73.937   7.149   7.749
  490    HA   THR  65           HA       THR  65  75.054   8.688   9.090
  491    HB   THR  65           HB       THR  65  74.280   9.038  11.299
  492    HG1  THR  65           HG1      THR  65  72.915   6.773  11.763
  493   HG21  THR  65          HG21      THR  65  72.519   8.935   9.326
  494   HG22  THR  65          HG22      THR  65  71.984   9.171  10.990
  495   HG23  THR  65          HG23      THR  65  71.886   7.573  10.251
  496    H    VAL  66           HN       VAL  66  74.960   5.616  10.939
  497    HA   VAL  66           HA       VAL  66  77.870   5.349  10.600
  498    HB   VAL  66           HB       VAL  66  77.634   5.014  13.353
  499   HG11  VAL  66          HG11      VAL  66  78.901   7.189  13.437
  500   HG12  VAL  66          HG12      VAL  66  78.552   7.399  11.721
  501   HG13  VAL  66          HG13      VAL  66  79.539   6.040  12.261
  502   HG21  VAL  66          HG21      VAL  66  76.502   6.970  14.211
  503   HG22  VAL  66          HG22      VAL  66  75.373   6.132  13.146
  504   HG23  VAL  66          HG23      VAL  66  76.211   7.578  12.581
  505    H    ILE  67           HN       ILE  67  74.770   4.117  11.660
  506    HA   ILE  67           HA       ILE  67  75.894   1.355  11.455
  507    HB   ILE  67           HB       ILE  67  73.997   2.373  13.592
  508   HG12  ILE  67          HG12      ILE  67  76.617   2.645  13.690
  509   HG13  ILE  67          HG11      ILE  67  75.747   2.058  15.108
  510   HG21  ILE  67          HG21      ILE  67  74.292  -0.066  14.400
  511   HG22  ILE  67          HG22      ILE  67  74.825  -0.406  12.754
  512   HG23  ILE  67          HG23      ILE  67  73.199   0.213  13.044
  513   HD11  ILE  67          HD11      ILE  67  76.385  -0.178  14.726
  514   HD12  ILE  67          HD12      ILE  67  77.843   0.735  14.336
  515   HD13  ILE  67          HD13      ILE  67  76.805   0.135  13.042
  516    H1U  RCY  68           H1U      RCY  68  73.545   0.970   0.878
  517    H1S  RCY  68           H1S      RCY  68  71.404   0.808   4.280
  518    HB1  RCY  68           HB1      RCY  68  74.269   0.564   7.243
  519    HB2  RCY  68           HB2      RCY  68  73.303   2.035   7.206
  520    HA   RCY  68           HA       RCY  68  72.048   1.381   9.129
  521    HN1  RCY  68           HN1      RCY  68  74.960   0.903   9.472
  522    HA   PRO  69           HA       PRO  69  70.712  -2.639  10.450
  523    HB2  PRO  69           HB2      PRO  69  69.552  -2.727   7.676
  524    HB3  PRO  69           HB1      PRO  69  68.806  -3.191   9.219
  525    HG2  PRO  69           HG2      PRO  69  68.315  -0.830   8.027
  526    HG3  PRO  69           HG1      PRO  69  68.320  -1.030   9.785
  527    HD2  PRO  69           HD2      PRO  69  70.221   0.444   8.101
  528    HD3  PRO  69           HD1      PRO  69  70.021   0.491   9.866
  529    H    TRP  70           HN       TRP  70  71.905  -2.478   7.067
  530    HA   TRP  70           HA       TRP  70  72.823  -5.257   7.198
  531    HD1  TRP  70           HD1      TRP  70  72.389  -6.688   4.388
  532    HE1  TRP  70           HE1      TRP  70  69.923  -6.922   3.676
  533    HE3  TRP  70           HE3      TRP  70  70.706  -1.994   5.485
  534    HZ2  TRP  70           HZ2      TRP  70  67.546  -5.327   3.585
  535    HZ3  TRP  70           HZ3      TRP  70  68.343  -1.379   5.078
  536    HH2  TRP  70           HH2      TRP  70  66.761  -3.035   4.131
  537    HB2  TRP  70           HB2      TRP  70  73.133  -3.061   5.147
  538    HB3  TRP  70           HB1      TRP  70  73.900  -4.636   4.963
  539    H    GLU  71           HN       GLU  71  74.111  -2.130   7.958
  540    HA   GLU  71           HA       GLU  71  76.861  -2.427   7.607
  541    HB2  GLU  71           HB2      GLU  71  75.836  -0.399   8.581
  542    HB3  GLU  71           HB1      GLU  71  75.482  -1.290  10.060
  543    HG2  GLU  71           HG2      GLU  71  78.300  -1.309   9.066
  544    HG3  GLU  71           HG1      GLU  71  77.704   0.169   9.823
  545    H    ALA  72           HN       ALA  72  74.773  -4.344   9.476
  546    HA   ALA  72           HA       ALA  72  76.430  -5.231  11.587
  547    HB1  ALA  72           HB1      ALA  72  74.498  -6.950  10.007
  548    HB2  ALA  72           HB2      ALA  72  73.989  -5.784  11.229
  549    HB3  ALA  72           HB3      ALA  72  74.988  -7.165  11.688
  550    H1U  RCY  73           H1U      RCY  73  78.533  -4.478   0.593
  551    H1S  RCY  73           H1S      RCY  73  80.833  -4.253   4.621
  552    HB1  RCY  73           HB1      RCY  73  77.848  -5.988   6.390
  553    HB2  RCY  73           HB2      RCY  73  78.985  -7.297   6.073
  554    HA   RCY  73           HA       RCY  73  78.392  -7.931   8.196
  555    HN1  RCY  73           HN1      RCY  73  77.306  -5.241   8.444
  556    H    ASN  74           HN       ASN  74  79.639  -4.762   9.172
  557    HA   ASN  74           HA       ASN  74  81.634  -4.171  10.254
  558    HB2  ASN  74           HB2      ASN  74  80.566  -5.901  11.832
  559    HB3  ASN  74           HB1      ASN  74  81.740  -7.044  11.178
  560   HD21  ASN  74          HD21      ASN  74  83.871  -6.940  11.991
  561   HD22  ASN  74          HD22      ASN  74  84.419  -5.741  13.061
  562    H    HIS  75           HN       HIS  75  83.412  -3.812   9.021
  563    HA   HIS  75           HA       HIS  75  85.417  -4.262   7.881
  564    HD1  HIS  75           HD1      HIS  75  87.425  -8.165   7.903
  565    HD2  HIS  75           HD2      HIS  75  87.606  -4.064   8.644
  566    HE1  HIS  75           HE1      HIS  75  89.825  -7.468   7.487
  567    HE2  HIS  75           HE2      HIS  75  89.948  -4.974   7.935
  568    HB2  HIS  75           HB2      HIS  75  85.385  -6.159   9.767
  569    HB3  HIS  75           HB1      HIS  75  85.158  -7.207   8.369
  570    H1U  RCY  76           H1U      RCY  76  81.441  -3.889  -2.705
  571    H1S  RCY  76           H1S      RCY  76  81.177  -4.147   2.052
  572    HB1  RCY  76           HB1      RCY  76  83.509  -5.489   3.764
  573    HB2  RCY  76           HB2      RCY  76  82.253  -4.861   4.831
  574    HA   RCY  76           HA       RCY  76  81.876  -7.424   5.369
  575    HN1  RCY  76           HN1      RCY  76  82.831  -6.648   7.365
  576    H    GLU  77           HN       GLU  77  85.359  -6.852   5.437
  577    HA   GLU  77           HA       GLU  77  86.186  -8.411   3.252
  578    HB2  GLU  77           HB2      GLU  77  87.526  -8.415   5.970
  579    HB3  GLU  77           HB1      GLU  77  88.288  -8.703   4.407
  580    HG2  GLU  77           HG2      GLU  77  87.484  -6.351   3.762
  581    HG3  GLU  77           HG1      GLU  77  87.161  -6.114   5.480
  582    H    LEU  78           HN       LEU  78  84.530 -10.103   3.172
  583    HA   LEU  78           HA       LEU  78  84.956 -12.288   5.169
  584    HG   LEU  78           HG       LEU  78  83.302 -10.810   6.011
  585    HB2  LEU  78           HB2      LEU  78  82.583 -11.525   3.462
  586    HB3  LEU  78           HB1      LEU  78  82.701 -13.098   4.250
  587   HD11  LEU  78          HD11      LEU  78  80.502 -11.251   4.928
  588   HD12  LEU  78          HD12      LEU  78  81.498  -9.820   4.660
  589   HD13  LEU  78          HD13      LEU  78  80.917 -10.199   6.281
  590   HD21  LEU  78          HD21      LEU  78  81.349 -13.117   6.264
  591   HD22  LEU  78          HD22      LEU  78  81.994 -12.128   7.573
  592   HD23  LEU  78          HD23      LEU  78  83.057 -13.225   6.691
  593    H    HIS  79           HN       HIS  79  83.495 -14.099   3.211
  594    HA   HIS  79           HA       HIS  79  85.288 -14.273   0.905
  595    HD1  HIS  79           HD1      HIS  79  86.301 -15.113   4.976
  596    HD2  HIS  79           HD2      HIS  79  88.394 -14.361   1.447
  597    HE1  HIS  79           HE1      HIS  79  88.324 -13.734   5.624
  598    HE2  HIS  79           HE2      HIS  79  89.606 -13.270   3.485
  599    HB2  HIS  79           HB2      HIS  79  85.413 -16.463   3.000
  600    HB3  HIS  79           HB1      HIS  79  86.318 -16.395   1.489
  601    H    GLU  80           HN       GLU  80  82.392 -14.909   2.456
  602    HA   GLU  80           HA       GLU  80  81.523 -16.623   0.184
  603    HB2  GLU  80           HB2      GLU  80  80.132 -17.911   1.989
  604    HB3  GLU  80           HB1      GLU  80  81.829 -18.332   1.757
  605    HG2  GLU  80           HG2      GLU  80  81.331 -18.088   4.153
  606    HG3  GLU  80           HG1      GLU  80  82.448 -16.828   3.627
  607    H    LEU  81           HN       LEU  81  81.037 -13.931   2.073
  608    HA   LEU  81           HA       LEU  81  78.080 -13.981   1.775
  609    HG   LEU  81           HG       LEU  81  77.572 -11.736   4.481
  610    HB2  LEU  81           HB2      LEU  81  79.700 -13.025   3.798
  611    HB3  LEU  81           HB1      LEU  81  79.341 -11.554   2.901
  612   HD11  LEU  81          HD11      LEU  81  77.038 -11.688   1.841
  613   HD12  LEU  81          HD12      LEU  81  75.767 -11.648   3.062
  614   HD13  LEU  81          HD13      LEU  81  76.183 -13.168   2.271
  615   HD21  LEU  81          HD21      LEU  81  77.774 -13.908   5.363
  616   HD22  LEU  81          HD22      LEU  81  77.690 -14.663   3.771
  617   HD23  LEU  81          HD23      LEU  81  76.237 -13.980   4.501
  618    H    ALA  82           HN       ALA  82  80.850 -11.851   0.985
  619    HA   ALA  82           HA       ALA  82  79.480 -10.001  -0.631
  620    HB1  ALA  82           HB1      ALA  82  81.917  -9.889   0.031
  621    HB2  ALA  82           HB2      ALA  82  81.612  -9.514  -1.666
  622    HB3  ALA  82           HB3      ALA  82  82.246 -11.095  -1.213
  623    H    GLN  83           HN       GLN  83  81.202 -12.935  -1.782
  624    HA   GLN  83           HA       GLN  83  80.920 -14.101  -3.817
  625    HB2  GLN  83           HB2      GLN  83  78.851 -14.612  -2.328
  626    HB3  GLN  83           HB1      GLN  83  77.979 -13.541  -3.422
  627    HG2  GLN  83           HG2      GLN  83  78.756 -14.928  -5.345
  628    HG3  GLN  83           HG1      GLN  83  79.517 -16.036  -4.203
  629   HE21  GLN  83          HE21      GLN  83  78.124 -17.416  -2.916
  630   HE22  GLN  83          HE22      GLN  83  76.465 -17.570  -3.242
  631    H    TYR  84           HN       TYR  84  78.139 -13.219  -5.183
  632    HA   TYR  84           HA       TYR  84  78.706 -10.598  -6.230
  633    HD1  TYR  84           HD2      TYR  84  79.048 -14.610  -7.490
  634    HD2  TYR  84           HD1      TYR  84  78.417 -11.288 -10.139
  635    HE1  TYR  84           HE2      TYR  84  77.922 -16.115  -9.109
  636    HE2  TYR  84           HE1      TYR  84  77.291 -12.792 -11.758
  637    HH   TYR  84           HH       TYR  84  76.094 -14.964 -11.721
  638    HB2  TYR  84           HB2      TYR  84  79.776 -11.017  -8.216
  639    HB3  TYR  84           HB1      TYR  84  80.375 -12.417  -7.334
  640    H    GLY  85           HN       GLY  85  76.518 -12.252  -5.143
  641    HA2  GLY  85           HA2      GLY  85  74.570 -11.834  -7.372
  642    HA3  GLY  85           HA1      GLY  85  74.504 -13.305  -6.400
  643    H    ILE  86           HN       ILE  86  75.525 -10.974  -4.326
  644    HA   ILE  86           HA       ILE  86  72.878 -10.768  -3.087
  645    HB   ILE  86           HB       ILE  86  74.696 -11.074  -1.562
  646   HG12  ILE  86          HG12      ILE  86  74.532  -8.146  -1.183
  647   HG13  ILE  86          HG11      ILE  86  72.974  -8.959  -1.338
  648   HG21  ILE  86          HG21      ILE  86  76.474  -9.076  -1.611
  649   HG22  ILE  86          HG22      ILE  86  76.006  -9.038  -3.311
  650   HG23  ILE  86          HG23      ILE  86  76.673 -10.514  -2.613
  651   HD11  ILE  86          HD11      ILE  86  73.788  -8.835   1.029
  652   HD12  ILE  86          HD12      ILE  86  75.168  -9.829   0.564
  653   HD13  ILE  86          HD13      ILE  86  73.535 -10.488   0.467
  654    H1U  RCY  87           H1U      RCY  87  80.896  -1.892  -2.772
  655    H1S  RCY  87           H1S      RCY  87  76.657  -3.931  -4.023
  656    HB1  RCY  87           HB1      RCY  87  73.957  -5.495  -1.964
  657    HB2  RCY  87           HB2      RCY  87  74.290  -4.420  -3.317
  658    HA   RCY  87           HA       RCY  87  72.736  -6.296  -3.909
  659    HN1  RCY  87           HN1      RCY  87  74.870  -7.964  -2.805
  Start of MODEL   97
    1    HA   MET   1           HA       MET   1  71.484  -6.478  17.079
    2    HB2  MET   1           HB2      MET   1  69.884  -5.181  18.624
    3    HB3  MET   1           HB1      MET   1  71.025  -5.547  19.918
    4    HG2  MET   1           HG2      MET   1  72.840  -4.490  18.610
    5    HG3  MET   1           HG1      MET   1  71.686  -4.102  17.334
    6    HE1  MET   1           HE1      MET   1  72.185  -1.555  17.378
    7    HE2  MET   1           HE2      MET   1  73.477  -1.994  18.492
    8    HE3  MET   1           HE3      MET   1  72.415  -0.641  18.874
    9    H    ASN   2           HN       ASN   2  71.672  -8.739  19.614
   10    HA   ASN   2           HA       ASN   2  74.606  -8.755  19.424
   11    HB2  ASN   2           HB2      ASN   2  74.808  -8.702  21.963
   12    HB3  ASN   2           HB1      ASN   2  74.408  -7.160  21.206
   13   HD21  ASN   2          HD21      ASN   2  73.675  -7.302  23.828
   14   HD22  ASN   2          HD22      ASN   2  72.004  -7.552  23.995
   15    H    LEU   3           HN       LEU   3  74.322 -10.875  18.607
   16    HA   LEU   3           HA       LEU   3  74.164 -13.199  18.771
   17    HG   LEU   3           HG       LEU   3  76.250 -13.277  19.697
   18    HB2  LEU   3           HB2      LEU   3  74.673 -12.293  21.536
   19    HB3  LEU   3           HB1      LEU   3  73.864 -13.854  21.439
   20   HD11  LEU   3          HD11      LEU   3  76.264 -14.206  22.583
   21   HD12  LEU   3          HD12      LEU   3  77.029 -12.755  21.936
   22   HD13  LEU   3          HD13      LEU   3  77.643 -14.348  21.493
   23   HD21  LEU   3          HD21      LEU   3  76.407 -15.648  19.593
   24   HD22  LEU   3          HD22      LEU   3  74.680 -15.309  19.475
   25   HD23  LEU   3          HD23      LEU   3  75.369 -15.857  21.003
   26    H    GLU   4           HN       GLU   4  71.825 -11.311  20.636
   27    HA   GLU   4           HA       GLU   4  69.847 -13.499  20.469
   28    HB2  GLU   4           HB2      GLU   4  69.223 -10.724  21.456
   29    HB3  GLU   4           HB1      GLU   4  68.551 -12.266  21.983
   30    HG2  GLU   4           HG2      GLU   4  71.037 -12.764  22.707
   31    HG3  GLU   4           HG1      GLU   4  71.179 -11.006  22.696
   32    HA   PRO   5           HA       PRO   5  67.815 -12.459  16.695
   33    HB2  PRO   5           HB2      PRO   5  65.427 -11.887  18.424
   34    HB3  PRO   5           HB1      PRO   5  65.525 -12.826  16.921
   35    HG2  PRO   5           HG2      PRO   5  65.434 -13.997  19.328
   36    HG3  PRO   5           HG1      PRO   5  66.350 -14.683  17.978
   37    HD2  PRO   5           HD2      PRO   5  67.356 -13.440  20.459
   38    HD3  PRO   5           HD1      PRO   5  68.197 -14.508  19.316
   39    HA   PRO   6           HA       PRO   6  68.141  -7.961  16.927
   40    HB2  PRO   6           HB2      PRO   6  68.061  -7.431  14.267
   41    HB3  PRO   6           HB1      PRO   6  69.486  -8.147  15.047
   42    HG2  PRO   6           HG2      PRO   6  67.355  -9.468  13.443
   43    HG3  PRO   6           HG1      PRO   6  69.103  -9.760  13.458
   44    HD2  PRO   6           HD2      PRO   6  67.271 -11.340  14.795
   45    HD3  PRO   6           HD1      PRO   6  68.979 -11.189  15.264
   46    H    LYS   7           HN       LYS   7  66.714  -6.158  16.712
   47    HA   LYS   7           HA       LYS   7  63.893  -6.815  16.578
   48    HB2  LYS   7           HB2      LYS   7  63.586  -4.336  16.809
   49    HB3  LYS   7           HB1      LYS   7  64.635  -5.025  18.048
   50    HG2  LYS   7           HG2      LYS   7  66.618  -4.374  16.687
   51    HG3  LYS   7           HG1      LYS   7  65.537  -3.604  15.526
   52    HD2  LYS   7           HD2      LYS   7  66.052  -1.782  16.862
   53    HD3  LYS   7           HD1      LYS   7  64.623  -2.385  17.702
   54    HE2  LYS   7           HE2      LYS   7  66.309  -3.833  19.056
   55    HE3  LYS   7           HE1      LYS   7  67.522  -2.703  18.455
   56    HZ1  LYS   7           HZ1      LYS   7  66.898  -1.277  20.006
   57    HZ2  LYS   7           HZ2      LYS   7  65.703  -2.350  20.559
   58    HZ3  LYS   7           HZ3      LYS   7  65.336  -1.218  19.347
   59    H    ALA   8           HN       ALA   8  65.214  -7.520  14.153
   60    HA   ALA   8           HA       ALA   8  63.553  -5.992  12.261
   61    HB1  ALA   8           HB1      ALA   8  66.546  -6.212  11.823
   62    HB2  ALA   8           HB2      ALA   8  65.741  -4.751  12.394
   63    HB3  ALA   8           HB3      ALA   8  65.381  -5.386  10.788
   64    H    GLU   9           HN       GLU   9  62.550  -7.613  11.174
   65    HA   GLU   9           HA       GLU   9  62.190  -9.711  10.177
   66    HB2  GLU   9           HB2      GLU   9  64.824  -8.712   9.230
   67    HB3  GLU   9           HB1      GLU   9  64.527 -10.431   8.969
   68    HG2  GLU   9           HG2      GLU   9  63.758  -8.983   7.066
   69    HG3  GLU   9           HG1      GLU   9  62.468  -9.953   7.777
   70    H1U  RCY  10           H1U      RCY  10  60.092 -11.788   8.804
   71    H1S  RCY  10           H1S      RCY  10  59.527 -11.284  12.814
   72    HB1  RCY  10           HB1      RCY  10  62.857 -10.991  14.929
   73    HB2  RCY  10           HB2      RCY  10  63.072 -12.713  15.242
   74    HA   RCY  10           HA       RCY  10  64.460 -12.071  13.343
   75    HN1  RCY  10           HN1      RCY  10  62.047 -10.677  12.367
   76    H    ARG  11           HN       ARG  11  63.944 -13.056  10.880
   77    HA   ARG  11           HA       ARG  11  63.385 -15.850  11.410
   78    HE   ARG  11           HE       ARG  11  59.013 -17.999   8.295
   79    HB2  ARG  11           HB2      ARG  11  61.070 -15.085  11.298
   80    HB3  ARG  11           HB1      ARG  11  61.386 -14.260   9.771
   81    HG2  ARG  11           HG2      ARG  11  61.510 -16.241   8.566
   82    HG3  ARG  11           HG1      ARG  11  62.005 -17.186   9.971
   83    HD2  ARG  11           HD2      ARG  11  59.744 -17.005  10.913
   84    HD3  ARG  11           HD1      ARG  11  59.239 -16.016   9.543
   85   HH11  ARG  11          HH21      ARG  11  61.078 -18.427  11.022
   86   HH12  ARG  11          HH22      ARG  11  61.265 -20.132  10.781
   87   HH21  ARG  11          HH11      ARG  11  59.244 -20.223   7.964
   88   HH22  ARG  11          HH12      ARG  11  60.227 -21.149   9.049
   89    H    SER  12           HN       SER  12  65.012 -13.550   9.855
   90    HA   SER  12           HA       SER  12  65.144 -14.069   7.136
   91    HG   SER  12           HG       SER  12  66.587 -11.877   7.037
   92    HB2  SER  12           HB2      SER  12  67.359 -13.554   9.124
   93    HB3  SER  12           HB1      SER  12  67.675 -13.694   7.397
   94    H    ALA  13           HN       ALA  13  65.006 -16.087   6.249
   95    HA   ALA  13           HA       ALA  13  67.164 -18.006   6.818
   96    HB1  ALA  13           HB1      ALA  13  64.256 -18.787   7.192
   97    HB2  ALA  13           HB2      ALA  13  65.412 -18.555   8.503
   98    HB3  ALA  13           HB3      ALA  13  65.650 -19.858   7.338
   99    H    THR  14           HN       THR  14  64.536 -16.819   4.896
  100    HA   THR  14           HA       THR  14  65.672 -18.094   2.518
  101    HB   THR  14           HB       THR  14  64.171 -19.866   3.466
  102    HG1  THR  14           HG1      THR  14  64.430 -19.144   1.080
  103   HG21  THR  14          HG21      THR  14  61.926 -17.950   2.809
  104   HG22  THR  14          HG22      THR  14  62.561 -18.150   4.442
  105   HG23  THR  14          HG23      THR  14  61.811 -19.515   3.615
  106    H    ARG  15           HN       ARG  15  64.169 -17.476   0.557
  107    HA   ARG  15           HA       ARG  15  64.024 -14.687   0.348
  108    HE   ARG  15           HE       ARG  15  65.560 -13.173  -1.878
  109    HB2  ARG  15           HB2      ARG  15  63.243 -16.948  -1.242
  110    HB3  ARG  15           HB1      ARG  15  61.930 -15.774  -1.274
  111    HG2  ARG  15           HG2      ARG  15  63.497 -15.277  -3.079
  112    HG3  ARG  15           HG1      ARG  15  63.581 -13.998  -1.867
  113    HD2  ARG  15           HD2      ARG  15  65.426 -15.964  -1.036
  114    HD3  ARG  15           HD1      ARG  15  65.673 -15.776  -2.772
  115   HH11  ARG  15          HH21      ARG  15  67.280 -16.016  -0.961
  116   HH12  ARG  15          HH22      ARG  15  68.672 -15.154  -0.397
  117   HH21  ARG  15          HH11      ARG  15  67.368 -12.029  -1.147
  118   HH22  ARG  15          HH12      ARG  15  68.721 -12.896  -0.502
  119    H    VAL  16           HN       VAL  16  62.907 -13.420   1.761
  120    HA   VAL  16           HA       VAL  16  60.053 -14.146   2.329
  121    HB   VAL  16           HB       VAL  16  60.458 -12.774   4.474
  122   HG11  VAL  16          HG11      VAL  16  61.671 -15.481   3.914
  123   HG12  VAL  16          HG12      VAL  16  60.147 -15.110   4.720
  124   HG13  VAL  16          HG13      VAL  16  61.677 -14.788   5.536
  125   HG21  VAL  16          HG21      VAL  16  63.336 -13.477   3.838
  126   HG22  VAL  16          HG22      VAL  16  62.740 -12.560   5.221
  127   HG23  VAL  16          HG23      VAL  16  62.660 -11.865   3.602
  128    H    MET  17           HN       MET  17  61.991 -12.056   0.671
  129    HA   MET  17           HA       MET  17  60.596  -9.560   1.301
  130    HB2  MET  17           HB2      MET  17  62.493 -10.303  -0.948
  131    HB3  MET  17           HB1      MET  17  61.883  -8.674  -0.651
  132    HG2  MET  17           HG2      MET  17  63.349 -10.281   1.453
  133    HG3  MET  17           HG1      MET  17  64.170  -9.179   0.348
  134    HE1  MET  17           HE1      MET  17  63.921  -8.996   3.768
  135    HE2  MET  17           HE2      MET  17  64.234  -7.265   3.677
  136    HE3  MET  17           HE3      MET  17  65.061  -8.362   2.574
  137    H    GLY  18           HN       GLY  18  60.820  -9.400  -1.932
  138    HA2  GLY  18           HA2      GLY  18  57.936  -9.697  -2.290
  139    HA3  GLY  18           HA1      GLY  18  59.086  -9.186  -3.527
  140    H    GLY  19           HN       GLY  19  57.768 -10.707  -4.894
  141    HA2  GLY  19           HA2      GLY  19  57.847 -13.549  -4.394
  142    HA3  GLY  19           HA1      GLY  19  57.451 -12.790  -5.938
  143    HA   PRO  20           HA       PRO  20  61.385 -15.189  -6.611
  144    HB2  PRO  20           HB2      PRO  20  60.433 -14.487  -9.367
  145    HB3  PRO  20           HB1      PRO  20  61.110 -16.013  -8.764
  146    HG2  PRO  20           HG2      PRO  20  58.498 -15.724  -9.176
  147    HG3  PRO  20           HG1      PRO  20  59.119 -16.670  -7.813
  148    HD2  PRO  20           HD2      PRO  20  57.833 -13.981  -7.801
  149    HD3  PRO  20           HD1      PRO  20  57.860 -15.226  -6.532
  150    H1U  RCY  21           H1U      RCY  21  64.260  -6.349  -5.579
  151    H1S  RCY  21           H1S      RCY  21  65.693  -8.987  -8.302
  152    HB1  RCY  21           HB1      RCY  21  65.616 -13.431  -7.524
  153    HB2  RCY  21           HB2      RCY  21  64.709 -12.386  -6.432
  154    HA   RCY  21           HA       RCY  21  63.414 -11.517  -8.361
  155    HN1  RCY  21           HN1      RCY  21  63.221 -14.500  -8.288
  156    H    THR  22           HN       THR  22  64.146 -10.750 -10.297
  157    HA   THR  22           HA       THR  22  65.163 -12.755 -12.275
  158    HB   THR  22           HB       THR  22  63.022 -11.731 -12.920
  159    HG1  THR  22           HG1      THR  22  65.241 -10.712 -14.362
  160   HG21  THR  22          HG21      THR  22  64.242  -9.043 -13.236
  161   HG22  THR  22          HG22      THR  22  63.857  -9.535 -11.586
  162   HG23  THR  22          HG23      THR  22  62.589  -9.487 -12.811
  163    HA   PRO  23           HA       PRO  23  68.959 -10.351 -11.283
  164    HB2  PRO  23           HB2      PRO  23  69.889 -12.255 -13.406
  165    HB3  PRO  23           HB1      PRO  23  70.661 -11.814 -11.870
  166    HG2  PRO  23           HG2      PRO  23  69.389 -14.128 -12.160
  167    HG3  PRO  23           HG1      PRO  23  69.310 -13.220 -10.640
  168    HD2  PRO  23           HD2      PRO  23  67.211 -13.565 -12.735
  169    HD3  PRO  23           HD1      PRO  23  67.029 -13.320 -10.984
  170    H    ARG  24           HN       ARG  24  67.868  -8.494 -12.400
  171    HA   ARG  24           HA       ARG  24  69.338  -7.655 -14.714
  172    HE   ARG  24           HE       ARG  24  68.695 -10.321 -19.197
  173    HB2  ARG  24           HB2      ARG  24  67.075  -9.288 -15.278
  174    HB3  ARG  24           HB1      ARG  24  66.628  -7.641 -15.716
  175    HG2  ARG  24           HG2      ARG  24  68.609  -7.425 -17.117
  176    HG3  ARG  24           HG1      ARG  24  69.184  -9.012 -16.602
  177    HD2  ARG  24           HD2      ARG  24  67.039  -9.982 -17.543
  178    HD3  ARG  24           HD1      ARG  24  66.716  -8.397 -18.246
  179   HH11  ARG  24          HH21      ARG  24  67.742  -7.018 -18.944
  180   HH12  ARG  24          HH22      ARG  24  68.625  -6.517 -20.347
  181   HH21  ARG  24          HH11      ARG  24  69.854  -9.687 -21.030
  182   HH22  ARG  24          HH12      ARG  24  69.821  -8.028 -21.528
  183    H    LYS  25           HN       LYS  25  69.606  -5.712 -13.616
  184    HA   LYS  25           HA       LYS  25  67.648  -4.293 -12.161
  185    HB2  LYS  25           HB2      LYS  25  69.872  -3.075 -13.824
  186    HB3  LYS  25           HB1      LYS  25  69.074  -2.340 -12.434
  187    HG2  LYS  25           HG2      LYS  25  69.999  -3.953 -10.930
  188    HG3  LYS  25           HG1      LYS  25  70.545  -4.977 -12.258
  189    HD2  LYS  25           HD2      LYS  25  71.554  -2.161 -11.778
  190    HD3  LYS  25           HD1      LYS  25  72.383  -3.612 -11.212
  191    HE2  LYS  25           HE2      LYS  25  72.030  -4.301 -13.793
  192    HE3  LYS  25           HE1      LYS  25  72.099  -2.549 -13.977
  193    HZ1  LYS  25           HZ1      LYS  25  74.105  -3.318 -12.191
  194    HZ2  LYS  25           HZ2      LYS  25  74.281  -2.647 -13.742
  195    HZ3  LYS  25           HZ3      LYS  25  74.214  -4.333 -13.546
  196    H    GLY  26           HN       GLY  26  68.780  -3.226 -15.380
  197    HA2  GLY  26           HA2      GLY  26  66.200  -3.215 -16.610
  198    HA3  GLY  26           HA1      GLY  26  66.517  -1.616 -15.934
  199    HA   PRO  27           HA       PRO  27  68.123  -1.716 -20.331
  200    HB2  PRO  27           HB2      PRO  27  67.681   1.195 -19.785
  201    HB3  PRO  27           HB1      PRO  27  67.295   0.250 -21.237
  202    HG2  PRO  27           HG2      PRO  27  65.406   0.986 -19.514
  203    HG3  PRO  27           HG1      PRO  27  65.349  -0.580 -20.341
  204    HD2  PRO  27           HD2      PRO  27  66.009   0.018 -17.493
  205    HD3  PRO  27           HD1      PRO  27  65.267  -1.435 -18.200
  206    HA   PRO  28           HA       PRO  28  72.419  -0.930 -19.640
  207    HB2  PRO  28           HB2      PRO  28  72.136   1.245 -21.692
  208    HB3  PRO  28           HB1      PRO  28  73.369  -0.026 -21.564
  209    HG2  PRO  28           HG2      PRO  28  71.318  -0.186 -23.287
  210    HG3  PRO  28           HG1      PRO  28  72.025  -1.613 -22.514
  211    HD2  PRO  28           HD2      PRO  28  69.382  -0.382 -22.066
  212    HD3  PRO  28           HD1      PRO  28  69.950  -2.011 -21.640
  213    H    LYS  29           HN       LYS  29  73.320   0.230 -17.983
  214    HA   LYS  29           HA       LYS  29  73.208   3.097 -17.800
  215    HB2  LYS  29           HB2      LYS  29  70.878   2.667 -17.128
  216    HB3  LYS  29           HB1      LYS  29  71.437   1.556 -15.877
  217    HG2  LYS  29           HG2      LYS  29  72.488   3.310 -14.648
  218    HG3  LYS  29           HG1      LYS  29  72.338   4.440 -15.995
  219    HD2  LYS  29           HD2      LYS  29  69.964   4.579 -15.735
  220    HD3  LYS  29           HD1      LYS  29  69.938   3.207 -14.627
  221    HE2  LYS  29           HE2      LYS  29  71.414   5.782 -14.031
  222    HE3  LYS  29           HE1      LYS  29  69.756   5.480 -13.514
  223    HZ1  LYS  29           HZ1      LYS  29  72.237   4.151 -12.662
  224    HZ2  LYS  29           HZ2      LYS  29  70.765   3.307 -12.580
  225    HZ3  LYS  29           HZ3      LYS  29  70.965   4.757 -11.717
  226    H1U  RCY  30           H1U      RCY  30  79.511   3.703 -10.177
  227    H1S  RCY  30           H1S      RCY  30  79.549   2.146 -13.908
  228    HB1  RCY  30           HB1      RCY  30  77.100   0.425 -16.806
  229    HB2  RCY  30           HB2      RCY  30  76.125   0.006 -15.397
  230    HA   RCY  30           HA       RCY  30  76.153   2.312 -14.628
  231    HN1  RCY  30           HN1      RCY  30  75.443   2.839 -17.404
  232    H    LYS  31           HN       LYS  31  77.628   3.877 -14.225
  233    HA   LYS  31           HA       LYS  31  78.819   5.578 -16.074
  234    HB2  LYS  31           HB2      LYS  31  80.019   4.620 -13.457
  235    HB3  LYS  31           HB1      LYS  31  80.533   6.052 -14.345
  236    HG2  LYS  31           HG2      LYS  31  78.983   7.184 -13.145
  237    HG3  LYS  31           HG1      LYS  31  77.778   6.375 -14.148
  238    HD2  LYS  31           HD2      LYS  31  77.586   4.559 -12.541
  239    HD3  LYS  31           HD1      LYS  31  78.894   5.235 -11.570
  240    HE2  LYS  31           HE2      LYS  31  76.364   6.777 -12.179
  241    HE3  LYS  31           HE1      LYS  31  76.525   5.746 -10.757
  242    HZ1  LYS  31           HZ1      LYS  31  77.579   8.350 -11.226
  243    HZ2  LYS  31           HZ2      LYS  31  78.810   7.257 -10.802
  244    HZ3  LYS  31           HZ3      LYS  31  77.474   7.477  -9.775
  245    H    GLN  32           HN       GLN  32  79.693   4.585 -17.913
  246    HA   GLN  32           HA       GLN  32  81.351   2.285 -17.947
  247    HB2  GLN  32           HB2      GLN  32  80.349   3.335 -19.978
  248    HB3  GLN  32           HB1      GLN  32  81.491   4.671 -19.818
  249    HG2  GLN  32           HG2      GLN  32  83.376   3.125 -20.064
  250    HG3  GLN  32           HG1      GLN  32  82.265   1.757 -20.153
  251   HE21  GLN  32          HE21      GLN  32  80.653   1.840 -22.038
  252   HE22  GLN  32          HE22      GLN  32  81.165   2.560 -23.487
  253    H    ARG  33           HN       ARG  33  83.161   2.122 -16.690
  254    HA   ARG  33           HA       ARG  33  85.357   2.583 -15.979
  255    HE   ARG  33           HE       ARG  33  89.464   3.640 -19.243
  256    HB2  ARG  33           HB2      ARG  33  85.350   3.690 -18.430
  257    HB3  ARG  33           HB1      ARG  33  85.472   5.170 -17.480
  258    HG2  ARG  33           HG2      ARG  33  87.382   4.037 -16.214
  259    HG3  ARG  33           HG1      ARG  33  87.356   2.803 -17.475
  260    HD2  ARG  33           HD2      ARG  33  87.452   4.879 -19.096
  261    HD3  ARG  33           HD1      ARG  33  88.103   5.703 -17.679
  262   HH11  ARG  33          HH21      ARG  33  89.120   5.262 -16.220
  263   HH12  ARG  33          HH22      ARG  33  90.733   4.909 -15.696
  264   HH21  ARG  33          HH11      ARG  33  91.572   3.169 -18.576
  265   HH22  ARG  33          HH12      ARG  33  92.121   3.724 -17.030
  266    H    GLN  34           HN       GLN  34  85.767   3.415 -13.982
  267    HA   GLN  34           HA       GLN  34  83.996   5.104 -12.599
  268    HB2  GLN  34           HB2      GLN  34  86.975   4.771 -12.131
  269    HB3  GLN  34           HB1      GLN  34  85.820   5.416 -10.963
  270    HG2  GLN  34           HG2      GLN  34  84.682   3.327 -10.783
  271    HG3  GLN  34           HG1      GLN  34  85.498   2.678 -12.206
  272   HE21  GLN  34          HE21      GLN  34  85.882   3.383  -8.765
  273   HE22  GLN  34          HE22      GLN  34  87.370   2.586  -8.583
  274    H    THR  35           HN       THR  35  85.203   7.258 -11.519
  275    HA   THR  35           HA       THR  35  86.231   8.938 -13.752
  276    HB   THR  35           HB       THR  35  84.634  10.757 -13.054
  277    HG1  THR  35           HG1      THR  35  83.863   8.682 -11.366
  278   HG21  THR  35          HG21      THR  35  82.790   9.898 -14.329
  279   HG22  THR  35          HG22      THR  35  83.214   8.233 -13.930
  280   HG23  THR  35          HG23      THR  35  84.253   9.175 -14.999
  281    H    ARG  36           HN       ARG  36  86.603   7.839 -10.673
  282    HA   ARG  36           HA       ARG  36  87.800   8.601  -8.799
  283    HE   ARG  36           HE       ARG  36  92.043   7.005  -9.985
  284    HB2  ARG  36           HB2      ARG  36  89.202  10.454 -10.730
  285    HB3  ARG  36           HB1      ARG  36  89.860   9.662  -9.298
  286    HG2  ARG  36           HG2      ARG  36  89.422   7.445 -10.462
  287    HG3  ARG  36           HG1      ARG  36  89.085   8.372 -11.924
  288    HD2  ARG  36           HD2      ARG  36  91.371   7.873 -12.141
  289    HD3  ARG  36           HD1      ARG  36  91.388   9.499 -11.460
  290   HH11  ARG  36          HH21      ARG  36  91.642  10.425 -10.155
  291   HH12  ARG  36          HH22      ARG  36  92.512  10.734  -8.689
  292   HH21  ARG  36          HH11      ARG  36  93.181   7.388  -8.070
  293   HH22  ARG  36          HH12      ARG  36  93.384   9.014  -7.509
  294    H    GLN  37           HN       GLN  37  85.434  10.278  -9.990
  295    HA   GLN  37           HA       GLN  37  85.718  12.449  -8.013
  296    HB2  GLN  37           HB2      GLN  37  85.404  12.943 -10.986
  297    HB3  GLN  37           HB1      GLN  37  85.010  14.154  -9.765
  298    HG2  GLN  37           HG2      GLN  37  87.364  13.833  -8.856
  299    HG3  GLN  37           HG1      GLN  37  87.707  12.892 -10.308
  300   HE21  GLN  37          HE21      GLN  37  85.743  14.735 -11.833
  301   HE22  GLN  37          HE22      GLN  37  86.656  16.134 -12.135
  302    H1U  RCY  38           H1U      RCY  38  81.486   4.905  -3.894
  303    H1S  RCY  38           H1S      RCY  38  79.516   8.247  -6.018
  304    HB1  RCY  38           HB1      RCY  38  81.520  12.210  -5.470
  305    HB2  RCY  38           HB2      RCY  38  82.311  10.647  -5.647
  306    HA   RCY  38           HA       RCY  38  81.516  10.782  -8.125
  307    HN1  RCY  38           HN1      RCY  38  83.900  11.788  -6.898
  308    H    LYS  39           HN       LYS  39  80.405  13.203  -6.103
  309    HA   LYS  39           HA       LYS  39  79.128  14.611  -8.287
  310    HB2  LYS  39           HB2      LYS  39  79.124  14.729  -5.323
  311    HB3  LYS  39           HB1      LYS  39  78.757  16.250  -6.131
  312    HG2  LYS  39           HG2      LYS  39  77.405  13.711  -7.016
  313    HG3  LYS  39           HG1      LYS  39  76.799  14.596  -5.615
  314    HD2  LYS  39           HD2      LYS  39  76.842  16.678  -7.129
  315    HD3  LYS  39           HD1      LYS  39  77.019  15.549  -8.472
  316    HE2  LYS  39           HE2      LYS  39  74.693  15.810  -8.341
  317    HE3  LYS  39           HE1      LYS  39  74.963  14.342  -7.402
  318    HZ1  LYS  39           HZ1      LYS  39  74.911  15.616  -5.387
  319    HZ2  LYS  39           HZ2      LYS  39  73.504  15.949  -6.280
  320    HZ3  LYS  39           HZ3      LYS  39  74.779  17.071  -6.249
  321    H    SER  40           HN       SER  40  82.150  14.597  -8.046
  322    HA   SER  40           HA       SER  40  83.799  16.124  -8.756
  323    HG   SER  40           HG       SER  40  83.938  18.805  -9.466
  324    HB2  SER  40           HB2      SER  40  81.565  17.312  -9.685
  325    HB3  SER  40           HB1      SER  40  82.014  18.495  -8.459
  326    H    LYS  41           HN       LYS  41  83.152  15.437  -5.958
  327    HA   LYS  41           HA       LYS  41  83.595  17.872  -4.400
  328    HB2  LYS  41           HB2      LYS  41  83.627  14.932  -3.650
  329    HB3  LYS  41           HB1      LYS  41  83.795  16.245  -2.488
  330    HG2  LYS  41           HG2      LYS  41  81.432  15.889  -4.354
  331    HG3  LYS  41           HG1      LYS  41  81.447  15.424  -2.653
  332    HD2  LYS  41           HD2      LYS  41  82.273  17.948  -2.358
  333    HD3  LYS  41           HD1      LYS  41  81.391  18.149  -3.873
  334    HE2  LYS  41           HE2      LYS  41  80.292  17.009  -1.286
  335    HE3  LYS  41           HE1      LYS  41  79.873  18.562  -2.010
  336    HZ1  LYS  41           HZ1      LYS  41  78.311  16.628  -2.430
  337    HZ2  LYS  41           HZ2      LYS  41  79.510  16.014  -3.466
  338    HZ3  LYS  41           HZ3      LYS  41  78.799  17.524  -3.785
  339    HA   PRO  42           HA       PRO  42  88.012  17.948  -4.609
  340    HB2  PRO  42           HB2      PRO  42  88.609  18.696  -1.992
  341    HB3  PRO  42           HB1      PRO  42  88.125  19.813  -3.281
  342    HG2  PRO  42           HG2      PRO  42  86.505  18.650  -1.082
  343    HG3  PRO  42           HG1      PRO  42  86.432  20.262  -1.813
  344    HD2  PRO  42           HD2      PRO  42  84.607  18.327  -2.387
  345    HD3  PRO  42           HD1      PRO  42  85.099  19.551  -3.580
  346    HA   PRO  43           HA       PRO  43  89.766  14.165  -3.183
  347    HB2  PRO  43           HB2      PRO  43  92.227  15.025  -2.160
  348    HB3  PRO  43           HB1      PRO  43  91.887  14.678  -3.865
  349    HG2  PRO  43           HG2      PRO  43  91.988  17.284  -2.452
  350    HG3  PRO  43           HG1      PRO  43  92.479  16.869  -4.103
  351    HD2  PRO  43           HD2      PRO  43  90.170  18.196  -3.594
  352    HD3  PRO  43           HD1      PRO  43  90.310  17.040  -4.939
  353    H    LYS  44           HN       LYS  44  90.180  12.913  -1.268
  354    HA   LYS  44           HA       LYS  44  89.847  12.375   0.990
  355    HB2  LYS  44           HB2      LYS  44  90.853  15.187   1.502
  356    HB3  LYS  44           HB1      LYS  44  90.935  13.806   2.595
  357    HG2  LYS  44           HG2      LYS  44  92.292  12.657   0.710
  358    HG3  LYS  44           HG1      LYS  44  92.487  14.283   0.055
  359    HD2  LYS  44           HD2      LYS  44  94.349  14.188   1.427
  360    HD3  LYS  44           HD1      LYS  44  93.168  14.833   2.568
  361    HE2  LYS  44           HE2      LYS  44  92.692  12.524   3.351
  362    HE3  LYS  44           HE1      LYS  44  93.929  11.915   2.252
  363    HZ1  LYS  44           HZ1      LYS  44  94.315  12.795   4.818
  364    HZ2  LYS  44           HZ2      LYS  44  94.907  14.059   3.849
  365    HZ3  LYS  44           HZ3      LYS  44  95.521  12.486   3.666
  366    H    LYS  45           HN       LYS  45  87.498  12.449   0.534
  367    HA   LYS  45           HA       LYS  45  86.061  14.892   1.342
  368    HB2  LYS  45           HB2      LYS  45  84.071  13.144   1.003
  369    HB3  LYS  45           HB1      LYS  45  84.876  13.886  -0.380
  370    HG2  LYS  45           HG2      LYS  45  86.001  11.351   0.767
  371    HG3  LYS  45           HG1      LYS  45  84.582  11.264  -0.277
  372    HD2  LYS  45           HD2      LYS  45  86.799  12.985  -1.243
  373    HD3  LYS  45           HD1      LYS  45  87.116  11.249  -1.233
  374    HE2  LYS  45           HE2      LYS  45  84.553  12.337  -2.384
  375    HE3  LYS  45           HE1      LYS  45  86.024  12.278  -3.355
  376    HZ1  LYS  45           HZ1      LYS  45  86.009   9.832  -2.300
  377    HZ2  LYS  45           HZ2      LYS  45  85.308  10.213  -3.800
  378    HZ3  LYS  45           HZ3      LYS  45  84.340  10.116  -2.407
  379    H    GLY  46           HN       GLY  46  84.917  11.703   2.249
  380    HA2  GLY  46           HA2      GLY  46  84.797  12.614   5.068
  381    HA3  GLY  46           HA1      GLY  46  83.940  11.225   4.399
  382    H    VAL  47           HN       VAL  47  86.147  11.801   6.613
  383    HA   VAL  47           HA       VAL  47  88.181   9.826   5.774
  384    HB   VAL  47           HB       VAL  47  87.948  11.181   8.468
  385   HG11  VAL  47          HG11      VAL  47  90.273  10.690   8.659
  386   HG12  VAL  47          HG12      VAL  47  90.407  10.303   6.944
  387   HG13  VAL  47          HG13      VAL  47  89.538   9.217   8.028
  388   HG21  VAL  47          HG21      VAL  47  89.612  12.829   7.422
  389   HG22  VAL  47          HG22      VAL  47  87.931  12.997   6.916
  390   HG23  VAL  47          HG23      VAL  47  89.095  12.198   5.859
  391    H    GLN  48           HN       GLN  48  86.451  10.172   8.883
  392    HA   GLN  48           HA       GLN  48  86.522   7.307   9.327
  393    HB2  GLN  48           HB2      GLN  48  85.737   9.705  10.801
  394    HB3  GLN  48           HB1      GLN  48  84.599   8.385  11.064
  395    HG2  GLN  48           HG2      GLN  48  86.452   8.319  12.705
  396    HG3  GLN  48           HG1      GLN  48  86.456   6.888  11.674
  397   HE21  GLN  48          HE21      GLN  48  87.476   9.820  10.122
  398   HE22  GLN  48          HE22      GLN  48  89.142   9.500  10.144
  399    H    GLY  49           HN       GLY  49  83.977   6.696  10.280
  400    HA2  GLY  49           HA2      GLY  49  82.585   6.044   7.859
  401    HA3  GLY  49           HA1      GLY  49  81.930   5.860   9.487
  402    H1U  RCY  50           H1U      RCY  50  81.427  10.521  -0.859
  403    H1S  RCY  50           H1S      RCY  50  81.821  10.763   3.580
  404    HB1  RCY  50           HB1      RCY  50  81.473  11.206   5.811
  405    HB2  RCY  50           HB2      RCY  50  80.217  10.092   5.283
  406    HA   RCY  50           HA       RCY  50  81.251  10.519   7.948
  407    HN1  RCY  50           HN1      RCY  50  82.506   8.279   6.942
  408    H    GLY  51           HN       GLY  51  79.191   8.786   5.663
  409    HA2  GLY  51           HA2      GLY  51  76.978   8.034   5.865
  410    HA3  GLY  51           HA1      GLY  51  77.229   7.959   7.608
  411    H    ASP  52           HN       ASP  52  76.598   9.718   8.886
  412    HA   ASP  52           HA       ASP  52  74.402  11.252   8.156
  413    HB2  ASP  52           HB2      ASP  52  75.503  10.980  10.472
  414    HB3  ASP  52           HB1      ASP  52  76.515  12.350  10.013
  415    H    ASP  53           HN       ASP  53  77.560  11.623   6.957
  416    HA   ASP  53           HA       ASP  53  77.721  14.438   6.580
  417    HB2  ASP  53           HB2      ASP  53  78.823  12.099   5.016
  418    HB3  ASP  53           HB1      ASP  53  79.142  13.769   4.541
  419    H    ILE  54           HN       ILE  54  77.794  13.200   3.462
  420    HA   ILE  54           HA       ILE  54  75.891  14.915   2.386
  421    HB   ILE  54           HB       ILE  54  75.680  13.160   0.511
  422   HG12  ILE  54          HG12      ILE  54  77.737  11.510   0.829
  423   HG13  ILE  54          HG11      ILE  54  77.379  11.751   2.539
  424   HG21  ILE  54          HG21      ILE  54  78.106  13.492  -0.133
  425   HG22  ILE  54          HG22      ILE  54  78.358  14.216   1.456
  426   HG23  ILE  54          HG23      ILE  54  77.255  14.973   0.306
  427   HD11  ILE  54          HD11      ILE  54  75.635  10.339   2.397
  428   HD12  ILE  54          HD12      ILE  54  76.033  10.044   0.704
  429   HD13  ILE  54          HD13      ILE  54  74.912  11.335   1.135
  430    HA   PRO  55           HA       PRO  55  72.151  13.009   3.993
  431    HB2  PRO  55           HB2      PRO  55  70.374  14.846   3.126
  432    HB3  PRO  55           HB1      PRO  55  71.523  15.211   4.430
  433    HG2  PRO  55           HG2      PRO  55  71.647  15.969   1.552
  434    HG3  PRO  55           HG1      PRO  55  72.059  16.919   2.990
  435    HD2  PRO  55           HD2      PRO  55  73.921  15.614   1.399
  436    HD3  PRO  55           HD1      PRO  55  74.193  16.060   3.098
  437    H    GLY  56           HN       GLY  56  73.090  11.687   1.739
  438    HA2  GLY  56           HA2      GLY  56  72.374  10.480  -0.144
  439    HA3  GLY  56           HA1      GLY  56  70.762  10.615   0.563
  440    H    MET  57           HN       MET  57  73.017  12.035  -1.708
  441    HA   MET  57           HA       MET  57  71.946  14.418  -2.498
  442    HB2  MET  57           HB2      MET  57  73.131  12.141  -3.992
  443    HB3  MET  57           HB1      MET  57  72.231  13.300  -4.970
  444    HG2  MET  57           HG2      MET  57  74.613  13.941  -4.791
  445    HG3  MET  57           HG1      MET  57  73.570  15.144  -4.034
  446    HE1  MET  57           HE1      MET  57  76.875  13.392  -3.514
  447    HE2  MET  57           HE2      MET  57  75.686  12.110  -3.730
  448    HE3  MET  57           HE3      MET  57  76.543  12.259  -2.198
  449    H    GLU  58           HN       GLU  58  70.347  11.316  -2.753
  450    HA   GLU  58           HA       GLU  58  68.122  10.798  -3.285
  451    HB2  GLU  58           HB2      GLU  58  67.853  12.996  -1.876
  452    HB3  GLU  58           HB1      GLU  58  67.494  13.740  -3.434
  453    HG2  GLU  58           HG2      GLU  58  65.794  11.870  -3.788
  454    HG3  GLU  58           HG1      GLU  58  66.023  11.464  -2.087
  455    H    GLY  59           HN       GLY  59  67.953  10.005  -5.327
  456    HA2  GLY  59           HA2      GLY  59  67.107  11.607  -7.521
  457    HA3  GLY  59           HA1      GLY  59  68.840  11.320  -7.688
  458    H1U  RCY  60           H1U      RCY  60  75.008   4.664  -4.531
  459    H1S  RCY  60           H1S      RCY  60  71.695   5.610  -7.857
  460    HB1  RCY  60           HB1      RCY  60  69.700   6.651  -9.786
  461    HB2  RCY  60           HB2      RCY  60  69.840   5.699  -8.308
  462    HA   RCY  60           HA       RCY  60  67.663   7.293  -9.032
  463    HN1  RCY  60           HN1      RCY  60  69.417   8.878  -7.245
  464    H    GLY  61           HN       GLY  61  69.556   6.339  -6.166
  465    HA2  GLY  61           HA2      GLY  61  67.119   5.412  -4.802
  466    HA3  GLY  61           HA1      GLY  61  68.227   4.135  -5.308
  467    H    THR  62           HN       THR  62  68.246   7.240  -3.526
  468    HA   THR  62           HA       THR  62  69.875   5.969  -1.421
  469    HB   THR  62           HB       THR  62  71.511   6.847  -3.120
  470    HG1  THR  62           HG1      THR  62  71.324   7.912  -0.521
  471   HG21  THR  62          HG21      THR  62  70.578   9.584  -2.250
  472   HG22  THR  62          HG22      THR  62  69.955   8.807  -3.706
  473   HG23  THR  62          HG23      THR  62  71.675   9.171  -3.568
  474    H    ASP  63           HN       ASP  63  67.256   7.637  -2.107
  475    HA   ASP  63           HA       ASP  63  67.290  10.052  -0.667
  476    HB2  ASP  63           HB2      ASP  63  64.883   9.749  -0.362
  477    HB3  ASP  63           HB1      ASP  63  65.338   9.210  -1.978
  478    H    ILE  64           HN       ILE  64  67.794   6.882   0.488
  479    HA   ILE  64           HA       ILE  64  67.171   7.702   3.291
  480    HB   ILE  64           HB       ILE  64  67.658   4.949   2.140
  481   HG12  ILE  64          HG12      ILE  64  65.470   6.318   1.632
  482   HG13  ILE  64          HG11      ILE  64  65.339   4.638   2.154
  483   HG21  ILE  64          HG21      ILE  64  68.300   4.752   4.374
  484   HG22  ILE  64          HG22      ILE  64  66.572   4.416   4.481
  485   HG23  ILE  64          HG23      ILE  64  67.189   6.012   4.910
  486   HD11  ILE  64          HD11      ILE  64  63.880   6.466   3.344
  487   HD12  ILE  64          HD12      ILE  64  65.375   6.836   4.204
  488   HD13  ILE  64          HD13      ILE  64  64.669   5.224   4.316
  489    H    THR  65           HN       THR  65  69.669   5.898   1.472
  490    HA   THR  65           HA       THR  65  71.987   5.794   1.813
  491    HB   THR  65           HB       THR  65  71.651   8.195   3.626
  492    HG1  THR  65           HG1      THR  65  70.887   8.052   1.169
  493   HG21  THR  65          HG21      THR  65  73.861   7.298   3.729
  494   HG22  THR  65          HG22      THR  65  73.950   8.676   2.632
  495   HG23  THR  65          HG23      THR  65  73.910   7.036   1.986
  496    H    VAL  66           HN       VAL  66  70.701   7.028   4.926
  497    HA   VAL  66           HA       VAL  66  72.335   5.538   6.620
  498    HB   VAL  66           HB       VAL  66  69.445   5.728   7.374
  499   HG11  VAL  66          HG11      VAL  66  71.970   6.677   8.755
  500   HG12  VAL  66          HG12      VAL  66  71.312   5.051   8.932
  501   HG13  VAL  66          HG13      VAL  66  70.381   6.444   9.484
  502   HG21  VAL  66          HG21      VAL  66  69.481   7.783   6.249
  503   HG22  VAL  66          HG22      VAL  66  71.198   8.036   6.564
  504   HG23  VAL  66          HG23      VAL  66  70.023   8.245   7.863
  505    H    ILE  67           HN       ILE  67  68.944   4.493   6.195
  506    HA   ILE  67           HA       ILE  67  69.965   1.744   5.617
  507    HB   ILE  67           HB       ILE  67  67.846   2.433   7.675
  508   HG12  ILE  67          HG12      ILE  67  69.989   0.787   8.634
  509   HG13  ILE  67          HG11      ILE  67  70.686   2.203   7.844
  510   HG21  ILE  67          HG21      ILE  67  67.171   0.407   6.615
  511   HG22  ILE  67          HG22      ILE  67  68.014  -0.093   8.082
  512   HG23  ILE  67          HG23      ILE  67  68.831  -0.182   6.521
  513   HD11  ILE  67          HD11      ILE  67  69.357   3.696   9.218
  514   HD12  ILE  67          HD12      ILE  67  70.188   2.560  10.281
  515   HD13  ILE  67          HD13      ILE  67  68.477   2.335   9.916
  516    H1U  RCY  68           H1U      RCY  68  74.185   4.854  -1.390
  517    H1S  RCY  68           H1S      RCY  68  70.031   2.555  -0.678
  518    HB1  RCY  68           HB1      RCY  68  67.808   3.140   0.900
  519    HB2  RCY  68           HB2      RCY  68  67.404   1.453   0.582
  520    HA   RCY  68           HA       RCY  68  66.532   2.804   2.784
  521    HN1  RCY  68           HN1      RCY  68  69.262   2.100   3.435
  522    HA   PRO  69           HA       PRO  69  64.580  -1.112   3.410
  523    HB2  PRO  69           HB2      PRO  69  62.808  -1.202   1.296
  524    HB3  PRO  69           HB1      PRO  69  62.562  -0.219   2.751
  525    HG2  PRO  69           HG2      PRO  69  63.522   0.593   0.061
  526    HG3  PRO  69           HG1      PRO  69  62.489   1.465   1.205
  527    HD2  PRO  69           HD2      PRO  69  65.152   2.032   0.852
  528    HD3  PRO  69           HD1      PRO  69  64.286   2.327   2.376
  529    H    TRP  70           HN       TRP  70  65.404  -0.579  -0.045
  530    HA   TRP  70           HA       TRP  70  65.594  -3.381  -0.664
  531    HD1  TRP  70           HD1      TRP  70  68.627  -0.254  -1.516
  532    HE1  TRP  70           HE1      TRP  70  68.114   2.271  -1.545
  533    HE3  TRP  70           HE3      TRP  70  63.632  -0.383  -2.565
  534    HZ2  TRP  70           HZ2      TRP  70  65.876   4.011  -1.958
  535    HZ3  TRP  70           HZ3      TRP  70  62.336   1.716  -2.770
  536    HH2  TRP  70           HH2      TRP  70  63.447   3.911  -2.469
  537    HB2  TRP  70           HB2      TRP  70  67.226  -2.344  -2.519
  538    HB3  TRP  70           HB1      TRP  70  65.478  -2.154  -2.622
  539    H    GLU  71           HN       GLU  71  67.263  -1.764   1.566
  540    HA   GLU  71           HA       GLU  71  69.449  -3.692   1.573
  541    HB2  GLU  71           HB2      GLU  71  70.663  -2.282   0.174
  542    HB3  GLU  71           HB1      GLU  71  69.863  -0.834   0.769
  543    HG2  GLU  71           HG2      GLU  71  72.294  -1.131   1.504
  544    HG3  GLU  71           HG1      GLU  71  71.133  -0.846   2.801
  545    H    ALA  72           HN       ALA  72  68.681  -4.251   3.623
  546    HA   ALA  72           HA       ALA  72  68.165  -2.239   5.665
  547    HB1  ALA  72           HB1      ALA  72  68.348  -5.256   5.709
  548    HB2  ALA  72           HB2      ALA  72  66.898  -4.258   5.818
  549    HB3  ALA  72           HB3      ALA  72  68.042  -4.304   7.161
  550    H1U  RCY  73           H1U      RCY  73  79.188  -1.196   3.129
  551    H1S  RCY  73           H1S      RCY  73  74.644  -0.251   4.542
  552    HB1  RCY  73           HB1      RCY  73  72.061   0.340   6.331
  553    HB2  RCY  73           HB2      RCY  73  72.818  -0.457   4.951
  554    HA   RCY  73           HA       RCY  73  72.766  -2.604   6.130
  555    HN1  RCY  73           HN1      RCY  73  70.371  -1.232   5.382
  556    H    ASN  74           HN       ASN  74  70.135  -1.345   8.005
  557    HA   ASN  74           HA       ASN  74  71.268  -0.714  10.465
  558    HB2  ASN  74           HB2      ASN  74  68.870  -0.600  10.168
  559    HB3  ASN  74           HB1      ASN  74  68.772  -2.340   9.900
  560   HD21  ASN  74          HD21      ASN  74  68.850   0.136  12.341
  561   HD22  ASN  74          HD22      ASN  74  68.832  -0.900  13.686
  562    H    HIS  75           HN       HIS  75  71.464  -3.716   8.821
  563    HA   HIS  75           HA       HIS  75  72.257  -5.130  11.333
  564    HD1  HIS  75           HD1      HIS  75  72.307  -8.821   8.704
  565    HD2  HIS  75           HD2      HIS  75  72.002  -7.148  12.513
  566    HE1  HIS  75           HE1      HIS  75  72.967 -10.639  10.340
  567    HE2  HIS  75           HE2      HIS  75  72.785  -9.634  12.662
  568    HB2  HIS  75           HB2      HIS  75  70.507  -6.147   9.787
  569    HB3  HIS  75           HB1      HIS  75  71.802  -6.365   8.608
  570    H1U  RCY  76           H1U      RCY  76  76.690  -3.889   0.366
  571    H1S  RCY  76           H1S      RCY  76  77.648  -4.974   4.993
  572    HB1  RCY  76           HB1      RCY  76  76.109  -4.073   6.238
  573    HB2  RCY  76           HB2      RCY  76  74.500  -4.794   6.186
  574    HA   RCY  76           HA       RCY  76  75.924  -5.870   8.441
  575    HN1  RCY  76           HN1      RCY  76  73.334  -4.706   7.933
  576    H    GLU  77           HN       GLU  77  74.773  -3.335   9.950
  577    HA   GLU  77           HA       GLU  77  76.785  -1.291   9.485
  578    HB2  GLU  77           HB2      GLU  77  74.553  -1.757  11.397
  579    HB3  GLU  77           HB1      GLU  77  75.873  -0.761  12.006
  580    HG2  GLU  77           HG2      GLU  77  75.685   0.673   9.974
  581    HG3  GLU  77           HG1      GLU  77  74.298  -0.286   9.457
  582    H    LEU  78           HN       LEU  78  77.731  -0.710  12.053
  583    HA   LEU  78           HA       LEU  78  79.537  -1.261  13.444
  584    HG   LEU  78           HG       LEU  78  77.483  -1.519  14.717
  585    HB2  LEU  78           HB2      LEU  78  77.874  -3.764  13.365
  586    HB3  LEU  78           HB1      LEU  78  79.410  -3.765  14.230
  587   HD11  LEU  78          HD11      LEU  78  76.449  -2.880  16.538
  588   HD12  LEU  78          HD12      LEU  78  77.305  -4.296  15.926
  589   HD13  LEU  78          HD13      LEU  78  76.080  -3.508  14.931
  590   HD21  LEU  78          HD21      LEU  78  78.596  -1.409  16.821
  591   HD22  LEU  78          HD22      LEU  78  79.873  -1.717  15.643
  592   HD23  LEU  78          HD23      LEU  78  79.257  -3.035  16.641
  593    H    HIS  79           HN       HIS  79  79.286  -4.435  11.874
  594    HA   HIS  79           HA       HIS  79  81.967  -4.939  11.467
  595    HD1  HIS  79           HD1      HIS  79  80.881  -5.983  12.915
  596    HD2  HIS  79           HD2      HIS  79  78.749  -8.255  10.141
  597    HE1  HIS  79           HE1      HIS  79  79.718  -7.810  14.229
  598    HE2  HIS  79           HE2      HIS  79  78.417  -9.200  12.552
  599    HB2  HIS  79           HB2      HIS  79  79.755  -5.522   9.476
  600    HB3  HIS  79           HB1      HIS  79  81.313  -6.343   9.550
  601    H    GLU  80           HN       GLU  80  83.559  -4.289  10.014
  602    HA   GLU  80           HA       GLU  80  82.874  -1.938   8.308
  603    HB2  GLU  80           HB2      GLU  80  85.565  -2.962   9.266
  604    HB3  GLU  80           HB1      GLU  80  85.306  -1.497   8.318
  605    HG2  GLU  80           HG2      GLU  80  83.942  -1.956  10.976
  606    HG3  GLU  80           HG1      GLU  80  85.520  -1.177  10.849
  607    H    LEU  81           HN       LEU  81  85.634  -4.096   7.861
  608    HA   LEU  81           HA       LEU  81  85.001  -4.337   5.019
  609    HG   LEU  81           HG       LEU  81  86.582  -5.892   7.800
  610    HB2  LEU  81           HB2      LEU  81  87.043  -5.937   5.129
  611    HB3  LEU  81           HB1      LEU  81  87.318  -4.226   5.451
  612   HD11  LEU  81          HD11      LEU  81  88.143  -7.380   6.594
  613   HD12  LEU  81          HD12      LEU  81  88.889  -6.731   8.055
  614   HD13  LEU  81          HD13      LEU  81  89.308  -6.061   6.478
  615   HD21  LEU  81          HD21      LEU  81  87.227  -3.380   7.674
  616   HD22  LEU  81          HD22      LEU  81  88.880  -3.963   7.481
  617   HD23  LEU  81          HD23      LEU  81  87.971  -4.357   8.939
  618    H    ALA  82           HN       ALA  82  84.704  -6.340   7.894
  619    HA   ALA  82           HA       ALA  82  84.308  -8.862   6.676
  620    HB1  ALA  82           HB1      ALA  82  83.205  -7.628   9.201
  621    HB2  ALA  82           HB2      ALA  82  84.478  -8.838   9.040
  622    HB3  ALA  82           HB3      ALA  82  82.800  -9.277   8.725
  623    H    GLN  83           HN       GLN  83  81.399  -7.857   8.237
  624    HA   GLN  83           HA       GLN  83  79.183  -7.820   7.434
  625    HB2  GLN  83           HB2      GLN  83  80.582  -6.484   5.094
  626    HB3  GLN  83           HB1      GLN  83  78.841  -6.482   5.364
  627    HG2  GLN  83           HG2      GLN  83  79.053  -5.203   7.369
  628    HG3  GLN  83           HG1      GLN  83  80.798  -5.455   7.429
  629   HE21  GLN  83          HE21      GLN  83  79.346  -4.809   4.306
  630   HE22  GLN  83          HE22      GLN  83  79.906  -3.213   4.159
  631    H    TYR  84           HN       TYR  84  81.430  -9.831   6.291
  632    HA   TYR  84           HA       TYR  84  81.483 -11.583   4.740
  633    HD1  TYR  84           HD1      TYR  84  78.536 -13.182   3.101
  634    HD2  TYR  84           HD2      TYR  84  77.464 -10.522   6.299
  635    HE1  TYR  84           HE1      TYR  84  76.312 -12.829   2.062
  636    HE2  TYR  84           HE2      TYR  84  75.240 -10.169   5.260
  637    HH   TYR  84           HH       TYR  84  73.988 -12.139   2.886
  638    HB2  TYR  84           HB2      TYR  84  79.836 -13.097   5.213
  639    HB3  TYR  84           HB1      TYR  84  79.433 -11.933   6.468
  640    H    GLY  85           HN       GLY  85  80.530  -8.734   3.856
  641    HA2  GLY  85           HA2      GLY  85  79.823  -9.599   1.097
  642    HA3  GLY  85           HA1      GLY  85  78.849  -8.350   1.874
  643    H    ILE  86           HN       ILE  86  82.325  -8.666   2.346
  644    HA   ILE  86           HA       ILE  86  83.966  -6.977   2.112
  645    HB   ILE  86           HB       ILE  86  83.923  -8.223  -0.079
  646   HG12  ILE  86          HG12      ILE  86  84.496  -5.432  -0.891
  647   HG13  ILE  86          HG11      ILE  86  85.285  -5.958   0.597
  648   HG21  ILE  86          HG21      ILE  86  82.911  -6.876  -2.005
  649   HG22  ILE  86          HG22      ILE  86  82.050  -5.952  -0.773
  650   HG23  ILE  86          HG23      ILE  86  81.762  -7.684  -0.938
  651   HD11  ILE  86          HD11      ILE  86  85.387  -7.445  -2.045
  652   HD12  ILE  86          HD12      ILE  86  86.216  -7.911  -0.560
  653   HD13  ILE  86          HD13      ILE  86  86.680  -6.432  -1.402
  654    H1U  RCY  87           H1U      RCY  87  77.762  -0.909  -3.245
  655    H1S  RCY  87           H1S      RCY  87  81.327  -3.122  -3.281
  656    HB1  RCY  87           HB1      RCY  87  84.169  -2.107  -0.044
  657    HB2  RCY  87           HB2      RCY  87  82.594  -1.399  -0.398
  658    HA   RCY  87           HA       RCY  87  82.748  -2.734   1.774
  659    HN1  RCY  87           HN1      RCY  87  83.785  -4.771   0.136
  Start of MODEL   98
    1    HA   MET   1           HA       MET   1  67.034  -1.487 -21.561
    2    HB2  MET   1           HB2      MET   1  68.211  -2.114 -19.503
    3    HB3  MET   1           HB1      MET   1  69.287  -1.188 -20.549
    4    HG2  MET   1           HG2      MET   1  68.554   0.882 -19.244
    5    HG3  MET   1           HG1      MET   1  67.820  -0.226 -18.086
    6    HE1  MET   1           HE1      MET   1  70.868   1.652 -19.156
    7    HE2  MET   1           HE2      MET   1  71.736   1.436 -17.638
    8    HE3  MET   1           HE3      MET   1  70.061   1.983 -17.618
    9    H    ASN   2           HN       ASN   2  65.545   1.199 -20.652
   10    HA   ASN   2           HA       ASN   2  64.323   0.823 -18.166
   11    HB2  ASN   2           HB2      ASN   2  63.969   2.733 -19.836
   12    HB3  ASN   2           HB1      ASN   2  62.784   1.689 -20.621
   13   HD21  ASN   2          HD21      ASN   2  62.765   4.229 -18.635
   14   HD22  ASN   2          HD22      ASN   2  61.488   3.827 -17.592
   15    H    LEU   3           HN       LEU   3  63.492  -1.081 -17.439
   16    HA   LEU   3           HA       LEU   3  62.228  -2.975 -19.303
   17    HG   LEU   3           HG       LEU   3  64.198  -3.949 -18.675
   18    HB2  LEU   3           HB2      LEU   3  62.634  -3.066 -16.295
   19    HB3  LEU   3           HB1      LEU   3  61.951  -4.378 -17.253
   20   HD11  LEU   3          HD11      LEU   3  64.846  -2.121 -17.037
   21   HD12  LEU   3          HD12      LEU   3  66.058  -3.384 -17.258
   22   HD13  LEU   3          HD13      LEU   3  65.036  -3.383 -15.820
   23   HD21  LEU   3          HD21      LEU   3  63.974  -5.570 -16.119
   24   HD22  LEU   3          HD22      LEU   3  65.206  -5.811 -17.357
   25   HD23  LEU   3          HD23      LEU   3  63.508  -6.103 -17.734
   26    H    GLU   4           HN       GLU   4  60.139  -4.035 -17.917
   27    HA   GLU   4           HA       GLU   4  58.084  -2.026 -18.275
   28    HB2  GLU   4           HB2      GLU   4  57.903  -4.790 -17.040
   29    HB3  GLU   4           HB1      GLU   4  56.536  -3.804 -17.560
   30    HG2  GLU   4           HG2      GLU   4  56.966  -5.324 -19.356
   31    HG3  GLU   4           HG1      GLU   4  57.612  -3.766 -19.874
   32    HA   PRO   5           HA       PRO   5  58.251   0.013 -14.314
   33    HB2  PRO   5           HB2      PRO   5  55.270  -0.281 -14.514
   34    HB3  PRO   5           HB1      PRO   5  56.232   1.147 -14.084
   35    HG2  PRO   5           HG2      PRO   5  55.165   0.837 -16.518
   36    HG3  PRO   5           HG1      PRO   5  56.722   1.641 -16.267
   37    HD2  PRO   5           HD2      PRO   5  56.164  -1.000 -17.481
   38    HD3  PRO   5           HD1      PRO   5  57.597   0.037 -17.650
   39    HA   PRO   6           HA       PRO   6  57.759  -3.407 -11.483
   40    HB2  PRO   6           HB2      PRO   6  57.969  -2.079  -9.110
   41    HB3  PRO   6           HB1      PRO   6  59.357  -2.351 -10.182
   42    HG2  PRO   6           HG2      PRO   6  57.698   0.098  -9.836
   43    HG3  PRO   6           HG1      PRO   6  59.452  -0.060 -10.035
   44    HD2  PRO   6           HD2      PRO   6  57.772   0.645 -12.088
   45    HD3  PRO   6           HD1      PRO   6  59.313  -0.204 -12.340
   46    H    LYS   7           HN       LYS   7  56.139  -4.375 -10.160
   47    HA   LYS   7           HA       LYS   7  53.967  -2.860  -9.002
   48    HB2  LYS   7           HB2      LYS   7  53.413  -2.748 -11.459
   49    HB3  LYS   7           HB1      LYS   7  53.282  -4.505 -11.455
   50    HG2  LYS   7           HG2      LYS   7  51.271  -4.477 -10.387
   51    HG3  LYS   7           HG1      LYS   7  51.761  -3.171  -9.306
   52    HD2  LYS   7           HD2      LYS   7  51.247  -2.617 -12.220
   53    HD3  LYS   7           HD1      LYS   7  49.905  -2.692 -11.078
   54    HE2  LYS   7           HE2      LYS   7  50.659  -0.839  -9.866
   55    HE3  LYS   7           HE1      LYS   7  52.318  -1.018 -10.436
   56    HZ1  LYS   7           HZ1      LYS   7  49.980   0.066 -11.871
   57    HZ2  LYS   7           HZ2      LYS   7  51.319  -0.536 -12.725
   58    HZ3  LYS   7           HZ3      LYS   7  51.510   0.764 -11.649
   59    H    ALA   8           HN       ALA   8  52.690  -4.189  -7.653
   60    HA   ALA   8           HA       ALA   8  52.498  -7.018  -7.803
   61    HB1  ALA   8           HB1      ALA   8  54.786  -7.315  -7.352
   62    HB2  ALA   8           HB2      ALA   8  54.062  -7.438  -5.750
   63    HB3  ALA   8           HB3      ALA   8  54.845  -5.939  -6.250
   64    H    GLU   9           HN       GLU   9  53.396  -6.109  -4.644
   65    HA   GLU   9           HA       GLU   9  50.648  -5.189  -3.957
   66    HB2  GLU   9           HB2      GLU   9  52.073  -7.570  -2.727
   67    HB3  GLU   9           HB1      GLU   9  50.646  -6.808  -2.025
   68    HG2  GLU   9           HG2      GLU   9  49.742  -8.572  -3.299
   69    HG3  GLU   9           HG1      GLU   9  49.567  -7.174  -4.360
   70    H1U  RCY  10           H1U      RCY  10  57.528  -4.082   2.764
   71    H1S  RCY  10           H1S      RCY  10  54.157  -1.530   1.344
   72    HB1  RCY  10           HB1      RCY  10  52.576  -1.018  -2.392
   73    HB2  RCY  10           HB2      RCY  10  53.711  -2.303  -2.795
   74    HA   RCY  10           HA       RCY  10  52.952  -3.388  -0.564
   75    HN1  RCY  10           HN1      RCY  10  50.769  -3.508  -2.538
   76    H    ARG  11           HN       ARG  11  52.626  -1.359   0.849
   77    HA   ARG  11           HA       ARG  11  50.075  -0.013   0.806
   78    HE   ARG  11           HE       ARG  11  48.849  -2.082   5.465
   79    HB2  ARG  11           HB2      ARG  11  49.584  -2.467   1.567
   80    HB3  ARG  11           HB1      ARG  11  50.320  -1.967   3.089
   81    HG2  ARG  11           HG2      ARG  11  48.720   0.022   3.058
   82    HG3  ARG  11           HG1      ARG  11  47.877  -0.796   1.742
   83    HD2  ARG  11           HD2      ARG  11  46.696  -1.626   3.556
   84    HD3  ARG  11           HD1      ARG  11  47.956  -2.852   3.419
   85   HH11  ARG  11          HH21      ARG  11  46.665   0.182   4.054
   86   HH12  ARG  11          HH22      ARG  11  46.659   1.236   5.429
   87   HH21  ARG  11          HH11      ARG  11  48.854  -0.719   7.269
   88   HH22  ARG  11          HH12      ARG  11  47.899   0.725   7.249
   89    H    SER  12           HN       SER  12  53.204  -0.271   1.713
   90    HA   SER  12           HA       SER  12  52.966   1.256   4.242
   91    HG   SER  12           HG       SER  12  53.942  -0.990   4.619
   92    HB2  SER  12           HB2      SER  12  55.512   0.501   2.797
   93    HB3  SER  12           HB1      SER  12  55.313   0.908   4.499
   94    H    ALA  13           HN       ALA  13  54.091   1.673   0.902
   95    HA   ALA  13           HA       ALA  13  54.664   3.616  -0.283
   96    HB1  ALA  13           HB1      ALA  13  52.808   4.896   1.748
   97    HB2  ALA  13           HB2      ALA  13  52.291   4.134   0.245
   98    HB3  ALA  13           HB3      ALA  13  53.287   5.589   0.199
   99    H    THR  14           HN       THR  14  54.202   5.356   2.761
  100    HA   THR  14           HA       THR  14  57.035   6.218   2.617
  101    HB   THR  14           HB       THR  14  56.370   7.873   4.327
  102    HG1  THR  14           HG1      THR  14  54.077   6.272   4.304
  103   HG21  THR  14          HG21      THR  14  55.964   8.268   1.869
  104   HG22  THR  14          HG22      THR  14  54.900   9.184   2.936
  105   HG23  THR  14          HG23      THR  14  54.300   7.739   2.121
  106    H    ARG  15           HN       ARG  15  55.408   6.110   5.683
  107    HA   ARG  15           HA       ARG  15  56.050   5.059   7.682
  108    HE   ARG  15           HE       ARG  15  57.022   0.556   9.614
  109    HB2  ARG  15           HB2      ARG  15  54.889   3.201   6.495
  110    HB3  ARG  15           HB1      ARG  15  56.434   2.710   5.802
  111    HG2  ARG  15           HG2      ARG  15  56.770   3.024   8.633
  112    HG3  ARG  15           HG1      ARG  15  55.360   2.003   8.347
  113    HD2  ARG  15           HD2      ARG  15  56.672   0.526   6.913
  114    HD3  ARG  15           HD1      ARG  15  58.078   1.579   7.071
  115   HH11  ARG  15          HH21      ARG  15  59.173   0.186   6.946
  116   HH12  ARG  15          HH22      ARG  15  60.278  -0.833   7.806
  117   HH21  ARG  15          HH11      ARG  15  58.452  -0.773  10.753
  118   HH22  ARG  15          HH12      ARG  15  59.870  -1.377   9.962
  119    H    VAL  16           HN       VAL  16  57.996   6.244   8.018
  120    HA   VAL  16           HA       VAL  16  60.333   4.908   8.562
  121    HB   VAL  16           HB       VAL  16  60.069   5.377   5.644
  122   HG11  VAL  16          HG11      VAL  16  61.602   7.162   5.934
  123   HG12  VAL  16          HG12      VAL  16  62.615   5.780   5.520
  124   HG13  VAL  16          HG13      VAL  16  62.486   6.308   7.198
  125   HG21  VAL  16          HG21      VAL  16  61.230   3.385   5.534
  126   HG22  VAL  16          HG22      VAL  16  60.613   3.241   7.179
  127   HG23  VAL  16          HG23      VAL  16  62.265   3.793   6.903
  128    H    MET  17           HN       MET  17  59.800   7.850   6.560
  129    HA   MET  17           HA       MET  17  60.017   9.639   8.790
  130    HB2  MET  17           HB2      MET  17  62.240  10.560   8.437
  131    HB3  MET  17           HB1      MET  17  62.384   8.832   8.742
  132    HG2  MET  17           HG2      MET  17  63.300   8.471   6.709
  133    HG3  MET  17           HG1      MET  17  62.008   9.364   5.907
  134    HE1  MET  17           HE1      MET  17  66.240  10.580   6.715
  135    HE2  MET  17           HE2      MET  17  65.550   9.119   6.013
  136    HE3  MET  17           HE3      MET  17  65.357   9.438   7.736
  137    H    GLY  18           HN       GLY  18  59.719   8.939   5.477
  138    HA2  GLY  18           HA2      GLY  18  58.404  10.323   3.992
  139    HA3  GLY  18           HA1      GLY  18  58.823  11.728   4.974
  140    H    GLY  19           HN       GLY  19  59.612  12.912   3.148
  141    HA2  GLY  19           HA2      GLY  19  61.409  13.696   1.840
  142    HA3  GLY  19           HA1      GLY  19  62.405  12.414   2.532
  143    HA   PRO  20           HA       PRO  20  59.774  11.070  -1.538
  144    HB2  PRO  20           HB2      PRO  20  61.261  13.218  -3.010
  145    HB3  PRO  20           HB1      PRO  20  59.647  12.549  -3.324
  146    HG2  PRO  20           HG2      PRO  20  59.959  14.916  -2.153
  147    HG3  PRO  20           HG1      PRO  20  58.661  13.812  -1.667
  148    HD2  PRO  20           HD2      PRO  20  61.176  14.505  -0.222
  149    HD3  PRO  20           HD1      PRO  20  59.602  14.000   0.430
  150    H1U  RCY  21           H1U      RCY  21  65.043   2.347  -3.586
  151    H1S  RCY  21           H1S      RCY  21  63.960   5.337  -1.111
  152    HB1  RCY  21           HB1      RCY  21  63.257   7.286  -3.988
  153    HB2  RCY  21           HB2      RCY  21  61.634   7.652  -3.402
  154    HA   RCY  21           HA       RCY  21  63.822   9.655  -2.947
  155    HN1  RCY  21           HN1      RCY  21  60.899  10.045  -3.477
  156    H    THR  22           HN       THR  22  64.554  10.983  -4.618
  157    HA   THR  22           HA       THR  22  63.422  10.623  -7.328
  158    HB   THR  22           HB       THR  22  64.992  12.495  -7.913
  159    HG1  THR  22           HG1      THR  22  66.562  12.203  -6.377
  160   HG21  THR  22          HG21      THR  22  62.708  13.023  -7.284
  161   HG22  THR  22          HG22      THR  22  63.782  14.210  -6.543
  162   HG23  THR  22          HG23      THR  22  63.111  12.899  -5.572
  163    HA   PRO  23           HA       PRO  23  66.433   7.409  -8.274
  164    HB2  PRO  23           HB2      PRO  23  66.155   8.662 -10.986
  165    HB3  PRO  23           HB1      PRO  23  66.105   6.948 -10.527
  166    HG2  PRO  23           HG2      PRO  23  63.883   8.325 -11.074
  167    HG3  PRO  23           HG1      PRO  23  63.920   7.061  -9.834
  168    HD2  PRO  23           HD2      PRO  23  63.738  10.006  -9.499
  169    HD3  PRO  23           HD1      PRO  23  63.218   8.711  -8.399
  170    H    ARG  24           HN       ARG  24  68.599   7.379  -9.593
  171    HA   ARG  24           HA       ARG  24  70.412   9.233  -8.520
  172    HE   ARG  24           HE       ARG  24  73.416   6.836 -11.850
  173    HB2  ARG  24           HB2      ARG  24  71.930   8.531 -10.425
  174    HB3  ARG  24           HB1      ARG  24  71.243   7.196  -9.500
  175    HG2  ARG  24           HG2      ARG  24  69.438   6.985 -11.208
  176    HG3  ARG  24           HG1      ARG  24  70.224   8.248 -12.156
  177    HD2  ARG  24           HD2      ARG  24  71.472   5.598 -11.369
  178    HD3  ARG  24           HD1      ARG  24  70.873   6.015 -12.974
  179   HH11  ARG  24          HH21      ARG  24  70.789   7.710 -13.904
  180   HH12  ARG  24          HH22      ARG  24  71.739   8.770 -14.891
  181   HH21  ARG  24          HH11      ARG  24  74.672   8.215 -13.127
  182   HH22  ARG  24          HH12      ARG  24  73.938   9.056 -14.451
  183    H    LYS  25           HN       LYS  25  71.529  11.054  -9.521
  184    HA   LYS  25           HA       LYS  25  70.120  12.290 -11.839
  185    HB2  LYS  25           HB2      LYS  25  70.103  14.477 -10.662
  186    HB3  LYS  25           HB1      LYS  25  69.102  13.280  -9.844
  187    HG2  LYS  25           HG2      LYS  25  70.272  13.886  -7.986
  188    HG3  LYS  25           HG1      LYS  25  71.536  12.851  -8.652
  189    HD2  LYS  25           HD2      LYS  25  72.699  14.846  -8.306
  190    HD3  LYS  25           HD1      LYS  25  72.209  15.008  -9.993
  191    HE2  LYS  25           HE2      LYS  25  70.138  16.222  -9.157
  192    HE3  LYS  25           HE1      LYS  25  70.900  16.255  -7.566
  193    HZ1  LYS  25           HZ1      LYS  25  71.245  18.228  -9.160
  194    HZ2  LYS  25           HZ2      LYS  25  72.365  17.213  -9.935
  195    HZ3  LYS  25           HZ3      LYS  25  72.580  17.629  -8.302
  196    H    GLY  26           HN       GLY  26  72.967  12.085  -9.768
  197    HA2  GLY  26           HA2      GLY  26  74.499  13.804 -11.638
  198    HA3  GLY  26           HA1      GLY  26  75.089  13.183 -10.095
  199    HA   PRO  27           HA       PRO  27  76.026  10.490 -14.155
  200    HB2  PRO  27           HB2      PRO  27  78.697  11.782 -13.744
  201    HB3  PRO  27           HB1      PRO  27  77.902  11.298 -15.254
  202    HG2  PRO  27           HG2      PRO  27  78.008  13.849 -14.473
  203    HG3  PRO  27           HG1      PRO  27  76.612  13.190 -15.341
  204    HD2  PRO  27           HD2      PRO  27  76.845  13.963 -12.479
  205    HD3  PRO  27           HD1      PRO  27  75.404  13.894 -13.517
  206    HA   PRO  28           HA       PRO  28  77.611   7.191 -11.659
  207    HB2  PRO  28           HB2      PRO  28  79.902   7.060 -13.594
  208    HB3  PRO  28           HB1      PRO  28  78.878   5.750 -12.973
  209    HG2  PRO  28           HG2      PRO  28  78.531   6.781 -15.416
  210    HG3  PRO  28           HG1      PRO  28  77.174   6.207 -14.435
  211    HD2  PRO  28           HD2      PRO  28  77.917   8.984 -15.147
  212    HD3  PRO  28           HD1      PRO  28  76.346   8.336 -14.629
  213    H    LYS  29           HN       LYS  29  79.085   6.956  -9.936
  214    HA   LYS  29           HA       LYS  29  81.537   8.613  -9.912
  215    HB2  LYS  29           HB2      LYS  29  79.601   9.986  -8.972
  216    HB3  LYS  29           HB1      LYS  29  79.536   8.820  -7.650
  217    HG2  LYS  29           HG2      LYS  29  82.022   9.274  -7.299
  218    HG3  LYS  29           HG1      LYS  29  81.833  10.640  -8.400
  219    HD2  LYS  29           HD2      LYS  29  80.202  10.226  -5.878
  220    HD3  LYS  29           HD1      LYS  29  81.594  11.302  -6.005
  221    HE2  LYS  29           HE2      LYS  29  79.812  12.765  -6.405
  222    HE3  LYS  29           HE1      LYS  29  80.294  12.316  -8.041
  223    HZ1  LYS  29           HZ1      LYS  29  78.454  10.437  -6.981
  224    HZ2  LYS  29           HZ2      LYS  29  78.332  11.382  -8.387
  225    HZ3  LYS  29           HZ3      LYS  29  77.806  12.003  -6.896
  226    H1U  RCY  30           H1U      RCY  30  80.738   7.542 -10.204
  227    H1S  RCY  30           H1S      RCY  30  84.511   5.779 -10.407
  228    HB1  RCY  30           HB1      RCY  30  85.019   5.900  -6.309
  229    HB2  RCY  30           HB2      RCY  30  84.918   7.124  -7.575
  230    HA   RCY  30           HA       RCY  30  82.846   5.027  -7.747
  231    HN1  RCY  30           HN1      RCY  30  83.088   7.839  -8.399
  232    H    LYS  31           HN       LYS  31  81.727   7.820  -6.215
  233    HA   LYS  31           HA       LYS  31  80.932   8.235  -4.045
  234    HB2  LYS  31           HB2      LYS  31  80.152   5.589  -4.846
  235    HB3  LYS  31           HB1      LYS  31  80.528   5.547  -3.126
  236    HG2  LYS  31           HG2      LYS  31  78.225   6.153  -3.252
  237    HG3  LYS  31           HG1      LYS  31  79.085   7.655  -2.910
  238    HD2  LYS  31           HD2      LYS  31  77.594   8.214  -4.668
  239    HD3  LYS  31           HD1      LYS  31  79.152   7.989  -5.465
  240    HE2  LYS  31           HE2      LYS  31  77.938   5.433  -5.343
  241    HE3  LYS  31           HE1      LYS  31  76.692   6.553  -5.893
  242    HZ1  LYS  31           HZ1      LYS  31  77.672   6.689  -7.858
  243    HZ2  LYS  31           HZ2      LYS  31  78.779   5.495  -7.373
  244    HZ3  LYS  31           HZ3      LYS  31  79.150   7.139  -7.155
  245    H    GLN  32           HN       GLN  32  83.861   7.451  -4.538
  246    HA   GLN  32           HA       GLN  32  84.547   7.209  -1.662
  247    HB2  GLN  32           HB2      GLN  32  85.565   5.355  -3.837
  248    HB3  GLN  32           HB1      GLN  32  86.308   5.496  -2.243
  249    HG2  GLN  32           HG2      GLN  32  84.048   4.951  -1.244
  250    HG3  GLN  32           HG1      GLN  32  83.491   4.584  -2.877
  251   HE21  GLN  32          HE21      GLN  32  86.372   3.777  -0.839
  252   HE22  GLN  32          HE22      GLN  32  86.397   2.137  -1.276
  253    H    ARG  33           HN       ARG  33  85.647   9.110  -1.442
  254    HA   ARG  33           HA       ARG  33  87.952   9.584  -3.268
  255    HE   ARG  33           HE       ARG  33  85.897  11.553  -6.335
  256    HB2  ARG  33           HB2      ARG  33  85.855  10.958  -3.898
  257    HB3  ARG  33           HB1      ARG  33  86.139  11.839  -2.397
  258    HG2  ARG  33           HG2      ARG  33  87.399  13.142  -3.829
  259    HG3  ARG  33           HG1      ARG  33  88.625  11.957  -3.375
  260    HD2  ARG  33           HD2      ARG  33  88.708  12.073  -5.756
  261    HD3  ARG  33           HD1      ARG  33  87.835  10.586  -5.388
  262   HH11  ARG  33          HH21      ARG  33  88.332  13.894  -5.644
  263   HH12  ARG  33          HH22      ARG  33  87.500  15.189  -6.439
  264   HH21  ARG  33          HH11      ARG  33  84.798  13.230  -7.378
  265   HH22  ARG  33          HH12      ARG  33  85.500  14.812  -7.421
  266    H    GLN  34           HN       GLN  34  86.443   9.850  -0.153
  267    HA   GLN  34           HA       GLN  34  88.710  11.384   0.968
  268    HB2  GLN  34           HB2      GLN  34  86.157  10.297   2.182
  269    HB3  GLN  34           HB1      GLN  34  87.396  11.138   3.115
  270    HG2  GLN  34           HG2      GLN  34  87.169  13.095   1.586
  271    HG3  GLN  34           HG1      GLN  34  85.855  12.260   0.757
  272   HE21  GLN  34          HE21      GLN  34  86.761  13.044   4.173
  273   HE22  GLN  34          HE22      GLN  34  85.187  13.479   4.638
  274    H    THR  35           HN       THR  35  87.307   8.137   1.127
  275    HA   THR  35           HA       THR  35  88.076   6.250   2.375
  276    HB   THR  35           HB       THR  35  89.119   5.689   0.374
  277    HG1  THR  35           HG1      THR  35  90.709   4.687   1.268
  278   HG21  THR  35          HG21      THR  35  90.962   7.010  -0.621
  279   HG22  THR  35          HG22      THR  35  90.897   8.115   0.752
  280   HG23  THR  35          HG23      THR  35  89.527   7.999  -0.352
  281    H    ARG  36           HN       ARG  36  88.159   7.067   4.545
  282    HA   ARG  36           HA       ARG  36  90.946   7.482   5.518
  283    HE   ARG  36           HE       ARG  36  93.315  11.336   6.976
  284    HB2  ARG  36           HB2      ARG  36  89.424   9.648   5.246
  285    HB3  ARG  36           HB1      ARG  36  88.729   9.079   6.762
  286    HG2  ARG  36           HG2      ARG  36  90.464  10.344   7.612
  287    HG3  ARG  36           HG1      ARG  36  91.312   8.810   7.407
  288    HD2  ARG  36           HD2      ARG  36  91.892   9.644   5.042
  289    HD3  ARG  36           HD1      ARG  36  91.375  11.234   5.606
  290   HH11  ARG  36          HH21      ARG  36  92.774   8.212   5.622
  291   HH12  ARG  36          HH22      ARG  36  94.322   7.593   6.093
  292   HH21  ARG  36          HH11      ARG  36  95.340  10.547   7.598
  293   HH22  ARG  36          HH12      ARG  36  95.774   8.915   7.211
  294    H    GLN  37           HN       GLN  37  87.722   6.283   5.968
  295    HA   GLN  37           HA       GLN  37  88.374   5.322   8.711
  296    HB2  GLN  37           HB2      GLN  37  85.737   4.872   7.329
  297    HB3  GLN  37           HB1      GLN  37  86.073   5.043   9.052
  298    HG2  GLN  37           HG2      GLN  37  86.634   7.427   8.701
  299    HG3  GLN  37           HG1      GLN  37  86.267   7.254   6.985
  300   HE21  GLN  37          HE21      GLN  37  83.949   5.487   7.355
  301   HE22  GLN  37          HE22      GLN  37  82.712   6.434   8.029
  302    H1U  RCY  38           H1U      RCY  38  83.825   4.182   4.509
  303    H1S  RCY  38           H1S      RCY  38  85.748   0.161   3.843
  304    HB1  RCY  38           HB1      RCY  38  88.593   1.255   5.769
  305    HB2  RCY  38           HB2      RCY  38  86.980   1.967   5.717
  306    HA   RCY  38           HA       RCY  38  86.773   0.770   8.093
  307    HN1  RCY  38           HN1      RCY  38  86.931   3.013   8.843
  308    H    LYS  39           HN       LYS  39  88.778   1.901   9.865
  309    HA   LYS  39           HA       LYS  39  90.825  -0.241   9.583
  310    HB2  LYS  39           HB2      LYS  39  91.414   2.704  10.025
  311    HB3  LYS  39           HB1      LYS  39  92.585   1.421  10.322
  312    HG2  LYS  39           HG2      LYS  39  93.158   1.768   8.140
  313    HG3  LYS  39           HG1      LYS  39  91.742   0.770   7.806
  314    HD2  LYS  39           HD2      LYS  39  91.536   2.772   6.478
  315    HD3  LYS  39           HD1      LYS  39  90.365   2.891   7.792
  316    HE2  LYS  39           HE2      LYS  39  92.136   4.863   7.177
  317    HE3  LYS  39           HE1      LYS  39  91.465   4.624   8.790
  318    HZ1  LYS  39           HZ1      LYS  39  93.908   4.791   8.766
  319    HZ2  LYS  39           HZ2      LYS  39  93.980   3.385   7.814
  320    HZ3  LYS  39           HZ3      LYS  39  93.359   3.313   9.394
  321    H    SER  40           HN       SER  40  88.749   1.719  11.460
  322    HA   SER  40           HA       SER  40  89.967   0.754  14.012
  323    HG   SER  40           HG       SER  40  86.901   3.221  14.079
  324    HB2  SER  40           HB2      SER  40  88.538   2.433  15.096
  325    HB3  SER  40           HB1      SER  40  89.505   3.184  13.830
  326    H    LYS  41           HN       LYS  41  87.104   0.542  11.990
  327    HA   LYS  41           HA       LYS  41  85.190  -0.503  13.712
  328    HB2  LYS  41           HB2      LYS  41  85.831  -1.592  10.957
  329    HB3  LYS  41           HB1      LYS  41  84.285  -1.719  11.796
  330    HG2  LYS  41           HG2      LYS  41  85.589   0.932  11.133
  331    HG3  LYS  41           HG1      LYS  41  84.415   0.146  10.078
  332    HD2  LYS  41           HD2      LYS  41  82.787   1.115  11.297
  333    HD3  LYS  41           HD1      LYS  41  83.262   0.074  12.640
  334    HE2  LYS  41           HE2      LYS  41  83.286   2.460  13.299
  335    HE3  LYS  41           HE1      LYS  41  84.900   1.754  13.380
  336    HZ1  LYS  41           HZ1      LYS  41  85.502   2.764  11.357
  337    HZ2  LYS  41           HZ2      LYS  41  84.729   3.978  12.260
  338    HZ3  LYS  41           HZ3      LYS  41  83.903   3.201  10.996
  339    HA   PRO  42           HA       PRO  42  87.620  -4.100  15.037
  340    HB2  PRO  42           HB2      PRO  42  86.221  -4.652  17.293
  341    HB3  PRO  42           HB1      PRO  42  87.366  -3.299  17.199
  342    HG2  PRO  42           HG2      PRO  42  84.397  -3.268  17.041
  343    HG3  PRO  42           HG1      PRO  42  85.500  -2.121  17.819
  344    HD2  PRO  42           HD2      PRO  42  84.322  -1.722  15.335
  345    HD3  PRO  42           HD1      PRO  42  85.808  -0.918  15.884
  346    HA   PRO  43           HA       PRO  43  85.045  -7.407  13.554
  347    HB2  PRO  43           HB2      PRO  43  86.235  -9.574  14.675
  348    HB3  PRO  43           HB1      PRO  43  87.021  -8.614  13.405
  349    HG2  PRO  43           HG2      PRO  43  87.464  -8.563  16.349
  350    HG3  PRO  43           HG1      PRO  43  88.640  -8.464  15.027
  351    HD2  PRO  43           HD2      PRO  43  87.730  -6.266  16.422
  352    HD3  PRO  43           HD1      PRO  43  88.341  -6.192  14.755
  353    H    LYS  44           HN       LYS  44  83.601  -9.222  14.296
  354    HA   LYS  44           HA       LYS  44  81.973 -10.107  15.722
  355    HB2  LYS  44           HB2      LYS  44  84.122 -10.326  17.203
  356    HB3  LYS  44           HB1      LYS  44  83.442  -8.969  18.094
  357    HG2  LYS  44           HG2      LYS  44  82.547 -10.818  19.229
  358    HG3  LYS  44           HG1      LYS  44  81.250 -10.389  18.112
  359    HD2  LYS  44           HD2      LYS  44  81.785 -12.156  16.631
  360    HD3  LYS  44           HD1      LYS  44  83.377 -12.392  17.354
  361    HE2  LYS  44           HE2      LYS  44  81.752 -14.154  18.042
  362    HE3  LYS  44           HE1      LYS  44  82.358 -13.224  19.413
  363    HZ1  LYS  44           HZ1      LYS  44  79.896 -12.378  18.041
  364    HZ2  LYS  44           HZ2      LYS  44  80.382 -12.102  19.645
  365    HZ3  LYS  44           HZ3      LYS  44  79.834 -13.640  19.173
  366    H    LYS  45           HN       LYS  45  82.823  -7.378  17.846
  367    HA   LYS  45           HA       LYS  45  80.057  -6.343  17.433
  368    HB2  LYS  45           HB2      LYS  45  80.957  -6.825  19.766
  369    HB3  LYS  45           HB1      LYS  45  82.062  -5.472  19.530
  370    HG2  LYS  45           HG2      LYS  45  80.232  -3.925  19.264
  371    HG3  LYS  45           HG1      LYS  45  79.058  -5.240  19.224
  372    HD2  LYS  45           HD2      LYS  45  80.825  -5.115  21.612
  373    HD3  LYS  45           HD1      LYS  45  79.600  -3.853  21.471
  374    HE2  LYS  45           HE2      LYS  45  78.776  -5.857  22.713
  375    HE3  LYS  45           HE1      LYS  45  77.841  -5.529  21.254
  376    HZ1  LYS  45           HZ1      LYS  45  79.065  -7.203  20.083
  377    HZ2  LYS  45           HZ2      LYS  45  78.445  -7.885  21.510
  378    HZ3  LYS  45           HZ3      LYS  45  80.088  -7.462  21.411
  379    H    GLY  46           HN       GLY  46  79.855  -3.913  17.356
  380    HA2  GLY  46           HA2      GLY  46  82.233  -2.487  16.335
  381    HA3  GLY  46           HA1      GLY  46  80.881  -2.653  15.214
  382    H    VAL  47           HN       VAL  47  82.190  -0.663  17.564
  383    HA   VAL  47           HA       VAL  47  79.720   0.341  18.721
  384    HB   VAL  47           HB       VAL  47  81.700   0.640  20.029
  385   HG11  VAL  47          HG11      VAL  47  83.403   2.358  18.693
  386   HG12  VAL  47          HG12      VAL  47  82.855   1.283  17.406
  387   HG13  VAL  47          HG13      VAL  47  83.631   0.616  18.842
  388   HG21  VAL  47          HG21      VAL  47  81.365   2.829  20.612
  389   HG22  VAL  47          HG22      VAL  47  80.057   2.725  19.434
  390   HG23  VAL  47          HG23      VAL  47  81.614   3.409  18.965
  391    H    GLN  48           HN       GLN  48  81.873   2.716  17.348
  392    HA   GLN  48           HA       GLN  48  80.213   3.157  14.977
  393    HB2  GLN  48           HB2      GLN  48  79.171   5.158  15.594
  394    HB3  GLN  48           HB1      GLN  48  79.050   4.214  17.078
  395    HG2  GLN  48           HG2      GLN  48  81.312   5.296  17.720
  396    HG3  GLN  48           HG1      GLN  48  80.969   6.453  16.434
  397   HE21  GLN  48          HE21      GLN  48  79.807   5.250  19.577
  398   HE22  GLN  48          HE22      GLN  48  78.782   6.567  19.891
  399    H    GLY  49           HN       GLY  49  81.155   4.773  13.566
  400    HA2  GLY  49           HA2      GLY  49  83.337   6.442  14.109
  401    HA3  GLY  49           HA1      GLY  49  84.035   4.872  13.709
  402    H1U  RCY  50           H1U      RCY  50  83.381   1.277   5.207
  403    H1S  RCY  50           H1S      RCY  50  81.196   3.302   7.913
  404    HB1  RCY  50           HB1      RCY  50  80.331   4.637  10.066
  405    HB2  RCY  50           HB2      RCY  50  82.000   4.459   9.525
  406    HA   RCY  50           HA       RCY  50  82.400   6.838   9.809
  407    HN1  RCY  50           HN1      RCY  50  81.049   6.182  12.351
  408    H    GLY  51           HN       GLY  51  79.852   7.153  12.048
  409    HA2  GLY  51           HA2      GLY  51  78.254   8.815  10.148
  410    HA3  GLY  51           HA1      GLY  51  77.635   8.138  11.656
  411    H    ASP  52           HN       ASP  52  80.816   9.531  11.656
  412    HA   ASP  52           HA       ASP  52  80.335  11.294  13.792
  413    HB2  ASP  52           HB2      ASP  52  82.392  12.501  13.002
  414    HB3  ASP  52           HB1      ASP  52  82.603  10.752  13.113
  415    H    ASP  53           HN       ASP  53  79.580  11.659  10.413
  416    HA   ASP  53           HA       ASP  53  78.133  14.148  11.012
  417    HB2  ASP  53           HB2      ASP  53  80.347  14.106   8.935
  418    HB3  ASP  53           HB1      ASP  53  79.257  15.455   9.259
  419    H    ILE  54           HN       ILE  54  78.768  14.219   7.788
  420    HA   ILE  54           HA       ILE  54  76.495  12.378   7.149
  421    HB   ILE  54           HB       ILE  54  77.164  14.981   5.753
  422   HG12  ILE  54          HG12      ILE  54  74.929  14.378   7.715
  423   HG13  ILE  54          HG11      ILE  54  76.381  15.297   8.111
  424   HG21  ILE  54          HG21      ILE  54  74.734  13.170   5.614
  425   HG22  ILE  54          HG22      ILE  54  75.998  13.265   4.388
  426   HG23  ILE  54          HG23      ILE  54  74.969  14.662   4.704
  427   HD11  ILE  54          HD11      ILE  54  74.726  16.927   7.571
  428   HD12  ILE  54          HD12      ILE  54  74.200  16.027   6.148
  429   HD13  ILE  54          HD13      ILE  54  75.771  16.829   6.154
  430    HA   PRO  55           HA       PRO  55  79.658  10.690   4.436
  431    HB2  PRO  55           HB2      PRO  55  78.191   8.699   3.317
  432    HB3  PRO  55           HB1      PRO  55  78.762   8.624   4.996
  433    HG2  PRO  55           HG2      PRO  55  76.062   9.322   3.957
  434    HG3  PRO  55           HG1      PRO  55  76.513   8.360   5.374
  435    HD2  PRO  55           HD2      PRO  55  75.723  11.005   5.502
  436    HD3  PRO  55           HD1      PRO  55  76.749  10.216   6.720
  437    H    GLY  56           HN       GLY  56  79.081   9.587   1.917
  438    HA2  GLY  56           HA2      GLY  56  78.760  11.989   0.321
  439    HA3  GLY  56           HA1      GLY  56  78.956  10.352  -0.309
  440    H    MET  57           HN       MET  57  76.447  11.534   1.915
  441    HA   MET  57           HA       MET  57  74.388  10.352   0.186
  442    HB2  MET  57           HB2      MET  57  74.284  10.203   2.682
  443    HB3  MET  57           HB1      MET  57  74.075  11.953   2.746
  444    HG2  MET  57           HG2      MET  57  71.921  11.866   1.935
  445    HG3  MET  57           HG1      MET  57  72.238  10.437   0.951
  446    HE1  MET  57           HE1      MET  57  73.354  10.456   4.829
  447    HE2  MET  57           HE2      MET  57  71.728  10.583   5.493
  448    HE3  MET  57           HE3      MET  57  72.327  11.830   4.402
  449    H    GLU  58           HN       GLU  58  75.988  12.781  -0.661
  450    HA   GLU  58           HA       GLU  58  73.888  14.871  -0.777
  451    HB2  GLU  58           HB2      GLU  58  76.750  14.829  -1.786
  452    HB3  GLU  58           HB1      GLU  58  75.666  16.217  -1.890
  453    HG2  GLU  58           HG2      GLU  58  76.313  14.849   0.729
  454    HG3  GLU  58           HG1      GLU  58  77.249  16.209   0.109
  455    H    GLY  59           HN       GLY  59  75.020  12.232  -2.625
  456    HA2  GLY  59           HA2      GLY  59  73.102  12.668  -4.709
  457    HA3  GLY  59           HA1      GLY  59  74.705  13.126  -5.285
  458    H1U  RCY  60           H1U      RCY  60  77.154   3.542  -0.917
  459    H1S  RCY  60           H1S      RCY  60  75.523   7.442  -2.338
  460    HB1  RCY  60           HB1      RCY  60  73.494   6.834  -3.524
  461    HB2  RCY  60           HB2      RCY  60  72.168   7.992  -3.640
  462    HA   RCY  60           HA       RCY  60  75.081   8.506  -4.311
  463    HN1  RCY  60           HN1      RCY  60  73.009  10.426  -3.673
  464    H    GLY  61           HN       GLY  61  75.169   9.246  -6.670
  465    HA2  GLY  61           HA2      GLY  61  72.967   8.198  -8.348
  466    HA3  GLY  61           HA1      GLY  61  74.354   9.122  -8.927
  467    H    THR  62           HN       THR  62  73.052   6.003  -8.648
  468    HA   THR  62           HA       THR  62  75.167   4.761 -10.087
  469    HB   THR  62           HB       THR  62  76.573   4.898  -8.170
  470    HG1  THR  62           HG1      THR  62  75.427   2.512  -8.822
  471   HG21  THR  62          HG21      THR  62  74.687   5.505  -6.613
  472   HG22  THR  62          HG22      THR  62  75.854   4.378  -5.924
  473   HG23  THR  62          HG23      THR  62  74.298   3.788  -6.507
  474    H    ASP  63           HN       ASP  63  73.199   4.019 -11.127
  475    HA   ASP  63           HA       ASP  63  71.255   2.415  -9.710
  476    HB2  ASP  63           HB2      ASP  63  70.542   1.745 -12.038
  477    HB3  ASP  63           HB1      ASP  63  70.589   3.487 -11.769
  478    H    ILE  64           HN       ILE  64  71.949   0.543  -8.751
  479    HA   ILE  64           HA       ILE  64  72.913  -1.585  -8.515
  480    HB   ILE  64           HB       ILE  64  72.044  -1.369 -11.367
  481   HG12  ILE  64          HG12      ILE  64  70.790  -3.413 -10.710
  482   HG13  ILE  64          HG11      ILE  64  71.594  -3.384  -9.140
  483   HG21  ILE  64          HG21      ILE  64  72.922  -3.704 -11.781
  484   HG22  ILE  64          HG22      ILE  64  73.904  -3.523 -10.327
  485   HG23  ILE  64          HG23      ILE  64  74.170  -2.460 -11.708
  486   HD11  ILE  64          HD11      ILE  64  69.989  -1.046 -10.195
  487   HD12  ILE  64          HD12      ILE  64  70.563  -1.305  -8.548
  488   HD13  ILE  64          HD13      ILE  64  69.279  -2.320  -9.204
  489    H    THR  65           HN       THR  65  74.499   0.946  -9.775
  490    HA   THR  65           HA       THR  65  76.689   1.331 -10.543
  491    HB   THR  65           HB       THR  65  77.024   0.957  -8.118
  492    HG1  THR  65           HG1      THR  65  79.124   0.880  -8.374
  493   HG21  THR  65          HG21      THR  65  76.140  -1.267  -7.864
  494   HG22  THR  65          HG22      THR  65  77.848  -1.335  -7.430
  495   HG23  THR  65          HG23      THR  65  77.314  -1.923  -9.005
  496    H    VAL  66           HN       VAL  66  75.340  -0.448 -12.217
  497    HA   VAL  66           HA       VAL  66  75.826  -1.896 -13.992
  498    HB   VAL  66           HB       VAL  66  78.695  -1.964 -13.039
  499   HG11  VAL  66          HG11      VAL  66  79.153  -2.264 -15.416
  500   HG12  VAL  66          HG12      VAL  66  77.451  -2.020 -15.805
  501   HG13  VAL  66          HG13      VAL  66  77.953  -3.452 -14.908
  502   HG21  VAL  66          HG21      VAL  66  78.322   0.359 -13.075
  503   HG22  VAL  66          HG22      VAL  66  77.163   0.246 -14.399
  504   HG23  VAL  66          HG23      VAL  66  78.885   0.031 -14.713
  505    H    ILE  67           HN       ILE  67  77.710  -2.749 -11.077
  506    HA   ILE  67           HA       ILE  67  76.405  -5.428 -11.131
  507    HB   ILE  67           HB       ILE  67  79.370  -4.907 -10.726
  508   HG12  ILE  67          HG12      ILE  67  78.867  -6.883 -12.685
  509   HG13  ILE  67          HG11      ILE  67  77.757  -5.557 -13.037
  510   HG21  ILE  67          HG21      ILE  67  78.706  -6.643  -9.209
  511   HG22  ILE  67          HG22      ILE  67  79.423  -7.449 -10.604
  512   HG23  ILE  67          HG23      ILE  67  77.669  -7.394 -10.423
  513   HD11  ILE  67          HD11      ILE  67  79.761  -3.993 -12.779
  514   HD12  ILE  67          HD12      ILE  67  79.775  -5.035 -14.203
  515   HD13  ILE  67          HD13      ILE  67  80.770  -5.440 -12.804
  516    H1U  RCY  68           H1U      RCY  68  73.627  -3.183  -0.360
  517    H1S  RCY  68           H1S      RCY  68  72.449  -1.901  -4.791
  518    HB1  RCY  68           HB1      RCY  68  73.742  -4.731  -6.442
  519    HB2  RCY  68           HB2      RCY  68  73.701  -3.860  -7.974
  520    HA   RCY  68           HA       RCY  68  76.339  -3.584  -6.983
  521    HN1  RCY  68           HN1      RCY  68  75.089  -4.719  -9.354
  522    HA   PRO  69           HA       PRO  69  78.108  -7.340  -5.364
  523    HB2  PRO  69           HB2      PRO  69  77.175  -6.099  -2.796
  524    HB3  PRO  69           HB1      PRO  69  78.742  -6.833  -3.190
  525    HG2  PRO  69           HG2      PRO  69  78.400  -4.184  -3.143
  526    HG3  PRO  69           HG1      PRO  69  79.488  -4.968  -4.298
  527    HD2  PRO  69           HD2      PRO  69  76.875  -3.662  -4.789
  528    HD3  PRO  69           HD1      PRO  69  78.204  -3.986  -5.923
  529    H    TRP  70           HN       TRP  70  74.799  -6.429  -4.959
  530    HA   TRP  70           HA       TRP  70  73.947  -8.605  -3.291
  531    HD1  TRP  70           HD1      TRP  70  71.931 -10.001  -3.232
  532    HE1  TRP  70           HE1      TRP  70  70.222  -9.910  -1.305
  533    HE3  TRP  70           HE3      TRP  70  70.960  -4.989  -3.152
  534    HZ2  TRP  70           HZ2      TRP  70  68.648  -7.965   0.089
  535    HZ3  TRP  70           HZ3      TRP  70  69.356  -4.046  -1.520
  536    HH2  TRP  70           HH2      TRP  70  68.199  -5.523   0.099
  537    HB2  TRP  70           HB2      TRP  70  72.709  -6.399  -4.338
  538    HB3  TRP  70           HB1      TRP  70  72.030  -7.671  -5.352
  539    H    GLU  71           HN       GLU  71  74.490  -8.315  -6.769
  540    HA   GLU  71           HA       GLU  71  73.560 -11.125  -7.140
  541    HB2  GLU  71           HB2      GLU  71  74.408  -9.134  -9.261
  542    HB3  GLU  71           HB1      GLU  71  73.531 -10.645  -9.504
  543    HG2  GLU  71           HG2      GLU  71  72.520  -8.214  -7.998
  544    HG3  GLU  71           HG1      GLU  71  71.966  -8.763  -9.580
  545    H    ALA  72           HN       ALA  72  76.404  -9.343  -6.642
  546    HA   ALA  72           HA       ALA  72  78.173 -10.987  -8.276
  547    HB1  ALA  72           HB1      ALA  72  78.552  -8.566  -7.359
  548    HB2  ALA  72           HB2      ALA  72  79.920  -9.676  -7.425
  549    HB3  ALA  72           HB3      ALA  72  79.090  -9.390  -5.896
  550    H1U  RCY  73           H1U      RCY  73  81.802  -7.516   0.830
  551    H1S  RCY  73           H1S      RCY  73  81.810 -11.606  -0.559
  552    HB1  RCY  73           HB1      RCY  73  78.139 -12.073  -1.977
  553    HB2  RCY  73           HB2      RCY  73  79.133 -10.874  -2.802
  554    HA   RCY  73           HA       RCY  73  79.447 -13.171  -4.352
  555    HN1  RCY  73           HN1      RCY  73  78.237 -10.569  -4.722
  556    H    ASN  74           HN       ASN  74  76.190 -12.069  -4.653
  557    HA   ASN  74           HA       ASN  74  74.159 -13.237  -4.569
  558    HB2  ASN  74           HB2      ASN  74  75.706 -14.920  -5.829
  559    HB3  ASN  74           HB1      ASN  74  75.717 -15.805  -4.303
  560   HD21  ASN  74          HD21      ASN  74  73.057 -13.971  -5.906
  561   HD22  ASN  74          HD22      ASN  74  71.984 -15.285  -5.955
  562    H    HIS  75           HN       HIS  75  76.248 -15.329  -2.551
  563    HA   HIS  75           HA       HIS  75  74.444 -15.887  -0.515
  564    HD1  HIS  75           HD1      HIS  75  74.702 -16.519   1.958
  565    HD2  HIS  75           HD2      HIS  75  78.548 -14.906   1.932
  566    HE1  HIS  75           HE1      HIS  75  75.295 -16.045   4.375
  567    HE2  HIS  75           HE2      HIS  75  77.634 -15.062   4.373
  568    HB2  HIS  75           HB2      HIS  75  76.509 -16.984  -0.322
  569    HB3  HIS  75           HB1      HIS  75  77.429 -15.493  -0.521
  570    H1U  RCY  76           H1U      RCY  76  73.828  -6.569   2.995
  571    H1S  RCY  76           H1S      RCY  76  75.486 -10.006   1.709
  572    HB1  RCY  76           HB1      RCY  76  73.241 -10.223   0.591
  573    HB2  RCY  76           HB2      RCY  76  73.014 -11.310  -0.778
  574    HA   RCY  76           HA       RCY  76  74.210 -12.178   1.868
  575    HN1  RCY  76           HN1      RCY  76  73.079 -14.102  -0.045
  576    H    GLU  77           HN       GLU  77  71.364 -13.136  -0.058
  577    HA   GLU  77           HA       GLU  77  69.470 -12.001   1.816
  578    HB2  GLU  77           HB2      GLU  77  69.102 -12.632  -0.674
  579    HB3  GLU  77           HB1      GLU  77  68.849 -14.271  -0.073
  580    HG2  GLU  77           HG2      GLU  77  66.681 -13.292  -0.132
  581    HG3  GLU  77           HG1      GLU  77  67.163 -13.242   1.564
  582    H    LEU  78           HN       LEU  78  71.047 -15.128   1.467
  583    HA   LEU  78           HA       LEU  78  69.470 -16.810   3.006
  584    HG   LEU  78           HG       LEU  78  71.111 -18.122   4.833
  585    HB2  LEU  78           HB2      LEU  78  71.686 -17.391   1.953
  586    HB3  LEU  78           HB1      LEU  78  72.478 -16.581   3.303
  587   HD11  LEU  78          HD11      LEU  78  69.438 -19.015   3.449
  588   HD12  LEU  78          HD12      LEU  78  70.602 -20.336   3.543
  589   HD13  LEU  78          HD13      LEU  78  70.559 -19.300   2.117
  590   HD21  LEU  78          HD21      LEU  78  73.259 -19.142   2.960
  591   HD22  LEU  78          HD22      LEU  78  72.669 -20.091   4.325
  592   HD23  LEU  78          HD23      LEU  78  73.455 -18.537   4.605
  593    H    HIS  79           HN       HIS  79  71.337 -14.053   4.093
  594    HA   HIS  79           HA       HIS  79  71.524 -13.052   6.206
  595    HD1  HIS  79           HD1      HIS  79  67.989 -11.758   8.120
  596    HD2  HIS  79           HD2      HIS  79  70.354 -11.460   4.697
  597    HE1  HIS  79           HE1      HIS  79  67.923  -9.327   7.413
  598    HE2  HIS  79           HE2      HIS  79  69.358  -9.132   5.331
  599    HB2  HIS  79           HB2      HIS  79  68.790 -14.150   6.000
  600    HB3  HIS  79           HB1      HIS  79  69.331 -13.883   7.657
  601    H    GLU  80           HN       GLU  80  73.220 -13.943   7.304
  602    HA   GLU  80           HA       GLU  80  72.617 -16.093   9.229
  603    HB2  GLU  80           HB2      GLU  80  73.400 -17.207   7.078
  604    HB3  GLU  80           HB1      GLU  80  74.952 -16.403   7.324
  605    HG2  GLU  80           HG2      GLU  80  75.165 -18.580   8.300
  606    HG3  GLU  80           HG1      GLU  80  74.990 -17.451   9.644
  607    H    LEU  81           HN       LEU  81  74.914 -13.776   7.875
  608    HA   LEU  81           HA       LEU  81  76.542 -13.802  10.327
  609    HG   LEU  81           HG       LEU  81  76.088 -10.831   8.261
  610    HB2  LEU  81           HB2      LEU  81  77.965 -12.210   9.198
  611    HB3  LEU  81           HB1      LEU  81  77.557 -13.477   8.046
  612   HD11  LEU  81          HD11      LEU  81  78.389 -10.494   7.466
  613   HD12  LEU  81          HD12      LEU  81  77.247 -10.276   6.139
  614   HD13  LEU  81          HD13      LEU  81  78.174 -11.771   6.268
  615   HD21  LEU  81          HD21      LEU  81  74.572 -12.286   7.262
  616   HD22  LEU  81          HD22      LEU  81  75.842 -13.288   6.558
  617   HD23  LEU  81          HD23      LEU  81  75.457 -11.721   5.845
  618    H    ALA  82           HN       ALA  82  73.647 -12.942  10.298
  619    HA   ALA  82           HA       ALA  82  73.520 -10.096  10.645
  620    HB1  ALA  82           HB1      ALA  82  71.764 -12.287  11.797
  621    HB2  ALA  82           HB2      ALA  82  71.497 -11.429  10.279
  622    HB3  ALA  82           HB3      ALA  82  71.373 -10.567  11.813
  623    H    GLN  83           HN       GLN  83  75.730 -11.481  12.143
  624    HA   GLN  83           HA       GLN  83  75.236 -11.602  14.921
  625    HB2  GLN  83           HB2      GLN  83  77.621 -11.119  13.199
  626    HB3  GLN  83           HB1      GLN  83  77.770 -10.639  14.889
  627    HG2  GLN  83           HG2      GLN  83  76.713 -13.357  14.100
  628    HG3  GLN  83           HG1      GLN  83  78.439 -13.057  14.304
  629   HE21  GLN  83          HE21      GLN  83  75.934 -14.322  15.983
  630   HE22  GLN  83          HE22      GLN  83  76.355 -13.860  17.561
  631    H    TYR  84           HN       TYR  84  75.508  -8.856  12.788
  632    HA   TYR  84           HA       TYR  84  75.774  -6.935  15.005
  633    HD1  TYR  84           HD1      TYR  84  77.280  -8.388  12.149
  634    HD2  TYR  84           HD2      TYR  84  77.610  -4.377  13.649
  635    HE1  TYR  84           HE1      TYR  84  79.752  -8.557  12.057
  636    HE2  TYR  84           HE2      TYR  84  80.082  -4.546  13.557
  637    HH   TYR  84           HH       TYR  84  81.724  -6.544  11.835
  638    HB2  TYR  84           HB2      TYR  84  75.360  -6.592  12.020
  639    HB3  TYR  84           HB1      TYR  84  75.496  -5.243  13.148
  640    H    GLY  85           HN       GLY  85  73.340  -7.596  12.469
  641    HA2  GLY  85           HA2      GLY  85  71.007  -7.901  13.670
  642    HA3  GLY  85           HA1      GLY  85  71.303  -6.229  14.151
  643    H    ILE  86           HN       ILE  86  72.576  -5.388  11.714
  644    HA   ILE  86           HA       ILE  86  70.189  -5.409   9.905
  645    HB   ILE  86           HB       ILE  86  71.903  -3.340   9.082
  646   HG12  ILE  86          HG12      ILE  86  71.695  -3.423  12.111
  647   HG13  ILE  86          HG11      ILE  86  73.181  -3.640  11.185
  648   HG21  ILE  86          HG21      ILE  86  69.420  -3.319   9.208
  649   HG22  ILE  86          HG22      ILE  86  70.130  -1.886   9.954
  650   HG23  ILE  86          HG23      ILE  86  69.527  -3.200  10.965
  651   HD11  ILE  86          HD11      ILE  86  71.477  -1.154  11.408
  652   HD12  ILE  86          HD12      ILE  86  72.687  -1.353  10.141
  653   HD13  ILE  86          HD13      ILE  86  73.177  -1.347  11.835
  654    H1U  RCY  87           H1U      RCY  87  77.967  -0.063   5.185
  655    H1S  RCY  87           H1S      RCY  87  76.120  -3.761   6.194
  656    HB1  RCY  87           HB1      RCY  87  75.981  -5.704   6.880
  657    HB2  RCY  87           HB2      RCY  87  76.223  -6.132   8.568
  658    HA   RCY  87           HA       RCY  87  73.702  -6.172   6.950
  659    HN1  RCY  87           HN1      RCY  87  73.776  -5.197   9.712
  Start of MODEL   99
    1    HA   MET   1           HA       MET   1  50.798   0.044   1.667
    2    HB2  MET   1           HB2      MET   1  49.199   0.599  -0.819
    3    HB3  MET   1           HB1      MET   1  49.573  -1.069  -0.386
    4    HG2  MET   1           HG2      MET   1  47.373  -0.129   0.532
    5    HG3  MET   1           HG1      MET   1  48.448  -0.886   1.707
    6    HE1  MET   1           HE1      MET   1  49.409   0.170   3.687
    7    HE2  MET   1           HE2      MET   1  47.650   0.121   3.788
    8    HE3  MET   1           HE3      MET   1  48.520   1.542   4.362
    9    H    ASN   2           HN       ASN   2  51.714   1.161  -1.598
   10    HA   ASN   2           HA       ASN   2  54.299  -0.041  -1.481
   11    HB2  ASN   2           HB2      ASN   2  53.679  -1.783  -3.381
   12    HB3  ASN   2           HB1      ASN   2  53.474  -2.209  -1.682
   13   HD21  ASN   2          HD21      ASN   2  51.461  -0.189  -3.899
   14   HD22  ASN   2          HD22      ASN   2  50.030  -1.062  -3.627
   15    H    LEU   3           HN       LEU   3  51.639   1.263  -3.341
   16    HA   LEU   3           HA       LEU   3  53.242   1.732  -5.736
   17    HG   LEU   3           HG       LEU   3  49.989   1.596  -7.173
   18    HB2  LEU   3           HB2      LEU   3  50.463   2.284  -4.840
   19    HB3  LEU   3           HB1      LEU   3  51.124   3.439  -5.993
   20   HD11  LEU   3          HD11      LEU   3  52.790   0.872  -7.737
   21   HD12  LEU   3          HD12      LEU   3  52.483   2.608  -7.717
   22   HD13  LEU   3          HD13      LEU   3  51.570   1.564  -8.806
   23   HD21  LEU   3          HD21      LEU   3  50.225  -0.182  -5.547
   24   HD22  LEU   3          HD22      LEU   3  51.984  -0.106  -5.651
   25   HD23  LEU   3          HD23      LEU   3  51.044  -0.694  -7.023
   26    H    GLU   4           HN       GLU   4  51.919   3.826  -3.152
   27    HA   GLU   4           HA       GLU   4  53.751   5.990  -4.042
   28    HB2  GLU   4           HB2      GLU   4  51.341   5.867  -2.236
   29    HB3  GLU   4           HB1      GLU   4  52.443   7.242  -2.158
   30    HG2  GLU   4           HG2      GLU   4  52.096   7.732  -4.506
   31    HG3  GLU   4           HG1      GLU   4  51.145   6.262  -4.715
   32    HA   PRO   5           HA       PRO   5  57.015   5.570  -1.109
   33    HB2  PRO   5           HB2      PRO   5  55.922   8.124   0.037
   34    HB3  PRO   5           HB1      PRO   5  57.604   7.680  -0.313
   35    HG2  PRO   5           HG2      PRO   5  56.140   9.232  -1.955
   36    HG3  PRO   5           HG1      PRO   5  57.402   8.137  -2.540
   37    HD2  PRO   5           HD2      PRO   5  54.499   7.951  -2.911
   38    HD3  PRO   5           HD1      PRO   5  55.790   7.046  -3.729
   39    HA   PRO   6           HA       PRO   6  54.142   3.712   2.011
   40    HB2  PRO   6           HB2      PRO   6  56.612   2.134   2.538
   41    HB3  PRO   6           HB1      PRO   6  54.954   1.572   2.254
   42    HG2  PRO   6           HG2      PRO   6  56.864   1.325   0.404
   43    HG3  PRO   6           HG1      PRO   6  55.177   1.650  -0.028
   44    HD2  PRO   6           HD2      PRO   6  57.516   3.520  -0.026
   45    HD3  PRO   6           HD1      PRO   6  56.106   3.475  -1.110
   46    H    LYS   7           HN       LYS   7  54.378   3.500   4.414
   47    HA   LYS   7           HA       LYS   7  54.932   4.467   6.477
   48    HB2  LYS   7           HB2      LYS   7  57.718   4.617   5.291
   49    HB3  LYS   7           HB1      LYS   7  57.295   4.565   7.001
   50    HG2  LYS   7           HG2      LYS   7  56.381   2.349   5.188
   51    HG3  LYS   7           HG1      LYS   7  58.040   2.353   5.787
   52    HD2  LYS   7           HD2      LYS   7  57.366   2.171   8.029
   53    HD3  LYS   7           HD1      LYS   7  55.736   2.749   7.684
   54    HE2  LYS   7           HE2      LYS   7  56.869   0.114   6.702
   55    HE3  LYS   7           HE1      LYS   7  55.807   0.290   8.099
   56    HZ1  LYS   7           HZ1      LYS   7  54.673   1.649   5.925
   57    HZ2  LYS   7           HZ2      LYS   7  54.073   0.291   6.750
   58    HZ3  LYS   7           HZ3      LYS   7  55.094   0.090   5.407
   59    H    ALA   8           HN       ALA   8  56.421   6.487   7.343
   60    HA   ALA   8           HA       ALA   8  55.165   8.829   6.353
   61    HB1  ALA   8           HB1      ALA   8  57.696   8.443   7.967
   62    HB2  ALA   8           HB2      ALA   8  56.092   8.867   8.565
   63    HB3  ALA   8           HB3      ALA   8  57.017  10.033   7.618
   64    H    GLU   9           HN       GLU   9  57.204  10.711   5.956
   65    HA   GLU   9           HA       GLU   9  57.965  10.058   3.185
   66    HB2  GLU   9           HB2      GLU   9  57.029  12.329   4.101
   67    HB3  GLU   9           HB1      GLU   9  58.696  12.620   4.594
   68    HG2  GLU   9           HG2      GLU   9  57.753  11.977   1.783
   69    HG3  GLU   9           HG1      GLU   9  58.320  13.546   2.356
   70    H1U  RCY  10           H1U      RCY  10  57.077  10.056   7.367
   71    H1S  RCY  10           H1S      RCY  10  61.543  11.427   7.599
   72    HB1  RCY  10           HB1      RCY  10  62.606  12.482   4.444
   73    HB2  RCY  10           HB2      RCY  10  63.569  12.003   5.841
   74    HA   RCY  10           HA       RCY  10  62.223  10.126   4.825
   75    HN1  RCY  10           HN1      RCY  10  59.883  11.790   5.654
   76    H    ARG  11           HN       ARG  11  60.538   8.865   6.572
   77    HA   ARG  11           HA       ARG  11  60.481   7.798   8.654
   78    HE   ARG  11           HE       ARG  11  62.084   3.565   8.063
   79    HB2  ARG  11           HB2      ARG  11  63.366   8.653   8.441
   80    HB3  ARG  11           HB1      ARG  11  62.775   7.805   9.867
   81    HG2  ARG  11           HG2      ARG  11  62.328   6.761   7.065
   82    HG3  ARG  11           HG1      ARG  11  63.748   6.332   8.018
   83    HD2  ARG  11           HD2      ARG  11  61.874   5.813   9.859
   84    HD3  ARG  11           HD1      ARG  11  60.893   5.561   8.415
   85   HH11  ARG  11          HH21      ARG  11  63.856   5.778  10.025
   86   HH12  ARG  11          HH22      ARG  11  65.161   4.679  10.319
   87   HH21  ARG  11          HH11      ARG  11  63.779   2.116   8.436
   88   HH22  ARG  11          HH12      ARG  11  65.118   2.605   9.420
   89    H    SER  12           HN       SER  12  59.855   8.330  10.731
   90    HA   SER  12           HA       SER  12  59.847  11.207  11.401
   91    HG   SER  12           HG       SER  12  59.149  10.687  14.083
   92    HB2  SER  12           HB2      SER  12  57.765   9.984  11.726
   93    HB3  SER  12           HB1      SER  12  58.581   8.795  12.738
   94    H    ALA  13           HN       ALA  13  60.458  11.840  13.685
   95    HA   ALA  13           HA       ALA  13  62.233  12.036  15.228
   96    HB1  ALA  13           HB1      ALA  13  62.682   9.824  16.433
   97    HB2  ALA  13           HB2      ALA  13  61.513   9.098  15.329
   98    HB3  ALA  13           HB3      ALA  13  61.007  10.374  16.435
   99    H    THR  14           HN       THR  14  63.403  12.297  12.913
  100    HA   THR  14           HA       THR  14  65.136  10.272  11.957
  101    HB   THR  14           HB       THR  14  66.334  12.033  10.832
  102    HG1  THR  14           HG1      THR  14  66.763  13.486  12.381
  103   HG21  THR  14          HG21      THR  14  64.520  13.243   9.786
  104   HG22  THR  14          HG22      THR  14  63.479  12.981  11.186
  105   HG23  THR  14          HG23      THR  14  63.944  11.620  10.165
  106    H    ARG  15           HN       ARG  15  66.274  13.107  13.820
  107    HA   ARG  15           HA       ARG  15  67.864  13.224  15.548
  108    HE   ARG  15           HE       ARG  15  67.939  11.707  19.998
  109    HB2  ARG  15           HB2      ARG  15  66.537  10.983  16.190
  110    HB3  ARG  15           HB1      ARG  15  68.073  10.243  15.744
  111    HG2  ARG  15           HG2      ARG  15  69.187  11.964  17.273
  112    HG3  ARG  15           HG1      ARG  15  67.570  12.329  17.875
  113    HD2  ARG  15           HD2      ARG  15  67.401   9.723  18.181
  114    HD3  ARG  15           HD1      ARG  15  69.163   9.798  18.150
  115   HH11  ARG  15          HH21      ARG  15  69.140   8.522  19.455
  116   HH12  ARG  15          HH22      ARG  15  69.482   8.222  21.126
  117   HH21  ARG  15          HH11      ARG  15  68.378  11.334  22.184
  118   HH22  ARG  15          HH12      ARG  15  69.051   9.814  22.671
  119    H    VAL  16           HN       VAL  16  68.352  10.577  13.220
  120    HA   VAL  16           HA       VAL  16  70.330   9.821  12.181
  121    HB   VAL  16           HB       VAL  16  71.097  12.717  11.953
  122   HG11  VAL  16          HG11      VAL  16  72.273  10.736  10.811
  123   HG12  VAL  16          HG12      VAL  16  71.786  12.073   9.770
  124   HG13  VAL  16          HG13      VAL  16  70.823  10.596   9.817
  125   HG21  VAL  16          HG21      VAL  16  68.689  12.822  11.764
  126   HG22  VAL  16          HG22      VAL  16  68.658  11.389  10.736
  127   HG23  VAL  16          HG23      VAL  16  69.351  12.894  10.131
  128    H    MET  17           HN       MET  17  72.750  11.719  12.217
  129    HA   MET  17           HA       MET  17  73.643  11.558  15.017
  130    HB2  MET  17           HB2      MET  17  74.377   9.564  12.974
  131    HB3  MET  17           HB1      MET  17  75.772  10.305  13.756
  132    HG2  MET  17           HG2      MET  17  74.958   9.690  15.948
  133    HG3  MET  17           HG1      MET  17  73.422   9.142  15.277
  134    HE1  MET  17           HE1      MET  17  72.881   7.041  14.464
  135    HE2  MET  17           HE2      MET  17  73.369   6.714  16.125
  136    HE3  MET  17           HE3      MET  17  73.838   5.603  14.841
  137    H    GLY  18           HN       GLY  18  74.667  12.045  11.628
  138    HA2  GLY  18           HA2      GLY  18  76.107  13.653  10.702
  139    HA3  GLY  18           HA1      GLY  18  75.373  14.745  11.878
  140    H    GLY  19           HN       GLY  19  76.672  15.508  13.487
  141    HA2  GLY  19           HA2      GLY  19  78.454  15.546  15.046
  142    HA3  GLY  19           HA1      GLY  19  78.938  13.946  14.481
  143    HA   PRO  20           HA       PRO  20  81.980  17.162  12.927
  144    HB2  PRO  20           HB2      PRO  20  83.885  15.011  13.667
  145    HB3  PRO  20           HB1      PRO  20  83.921  16.737  14.074
  146    HG2  PRO  20           HG2      PRO  20  83.331  14.857  15.884
  147    HG3  PRO  20           HG1      PRO  20  82.590  16.466  15.917
  148    HD2  PRO  20           HD2      PRO  20  81.407  13.865  15.007
  149    HD3  PRO  20           HD1      PRO  20  80.629  15.225  15.850
  150    H1U  RCY  21           H1U      RCY  21  81.302   7.992   5.778
  151    H1S  RCY  21           H1S      RCY  21  82.398  11.454   8.184
  152    HB1  RCY  21           HB1      RCY  21  80.688  12.385   8.972
  153    HB2  RCY  21           HB2      RCY  21  80.278  12.653  10.666
  154    HA   RCY  21           HA       RCY  21  82.521  14.248   9.492
  155    HN1  RCY  21           HN1      RCY  21  80.436  14.930  11.531
  156    H    THR  22           HN       THR  22  81.962  14.581   7.324
  157    HA   THR  22           HA       THR  22  79.373  16.012   6.849
  158    HB   THR  22           HB       THR  22  81.913  16.410   5.259
  159    HG1  THR  22           HG1      THR  22  81.018  17.591   7.648
  160   HG21  THR  22          HG21      THR  22  79.792  17.112   4.216
  161   HG22  THR  22          HG22      THR  22  80.787  18.509   4.624
  162   HG23  THR  22          HG23      THR  22  79.411  18.080   5.641
  163    HA   PRO  23           HA       PRO  23  79.173  12.380   4.108
  164    HB2  PRO  23           HB2      PRO  23  76.466  12.292   3.875
  165    HB3  PRO  23           HB1      PRO  23  77.319  11.695   5.312
  166    HG2  PRO  23           HG2      PRO  23  75.841  14.239   4.915
  167    HG3  PRO  23           HG1      PRO  23  75.958  13.210   6.351
  168    HD2  PRO  23           HD2      PRO  23  77.411  15.555   5.958
  169    HD3  PRO  23           HD1      PRO  23  77.857  14.263   7.094
  170    H    ARG  24           HN       ARG  24  77.097  12.297   2.166
  171    HA   ARG  24           HA       ARG  24  76.543  13.109   0.042
  172    HE   ARG  24           HE       ARG  24  73.936  17.052  -0.114
  173    HB2  ARG  24           HB2      ARG  24  77.468  15.830   0.988
  174    HB3  ARG  24           HB1      ARG  24  76.300  15.463  -0.278
  175    HG2  ARG  24           HG2      ARG  24  74.813  14.435   1.446
  176    HG3  ARG  24           HG1      ARG  24  75.957  14.943   2.689
  177    HD2  ARG  24           HD2      ARG  24  74.527  16.757   2.730
  178    HD3  ARG  24           HD1      ARG  24  75.655  17.305   1.490
  179   HH11  ARG  24          HH21      ARG  24  73.216  15.454   2.855
  180   HH12  ARG  24          HH22      ARG  24  71.585  15.076   2.410
  181   HH21  ARG  24          HH11      ARG  24  71.811  16.568  -0.712
  182   HH22  ARG  24          HH12      ARG  24  70.789  15.707   0.391
  183    H    LYS  25           HN       LYS  25  79.502  14.705   1.250
  184    HA   LYS  25           HA       LYS  25  81.562  15.053   0.173
  185    HB2  LYS  25           HB2      LYS  25  81.124  12.395   0.483
  186    HB3  LYS  25           HB1      LYS  25  81.293  12.458  -1.269
  187    HG2  LYS  25           HG2      LYS  25  83.513  12.177  -0.583
  188    HG3  LYS  25           HG1      LYS  25  83.402  13.930  -0.746
  189    HD2  LYS  25           HD2      LYS  25  84.387  13.681   1.368
  190    HD3  LYS  25           HD1      LYS  25  82.678  13.873   1.763
  191    HE2  LYS  25           HE2      LYS  25  82.836  11.168   1.369
  192    HE3  LYS  25           HE1      LYS  25  84.423  11.510   2.057
  193    HZ1  LYS  25           HZ1      LYS  25  82.748  12.984   3.591
  194    HZ2  LYS  25           HZ2      LYS  25  83.375  11.460   4.005
  195    HZ3  LYS  25           HZ3      LYS  25  81.834  11.585   3.299
  196    H    GLY  26           HN       GLY  26  82.097  13.615  -2.480
  197    HA2  GLY  26           HA2      GLY  26  81.572  15.786  -4.218
  198    HA3  GLY  26           HA1      GLY  26  81.950  14.151  -4.760
  199    HA   PRO  27           HA       PRO  27  77.377  15.591  -5.531
  200    HB2  PRO  27           HB2      PRO  27  78.281  15.214  -8.350
  201    HB3  PRO  27           HB1      PRO  27  77.230  16.466  -7.662
  202    HG2  PRO  27           HG2      PRO  27  79.757  16.972  -8.356
  203    HG3  PRO  27           HG1      PRO  27  78.991  17.754  -6.963
  204    HD2  PRO  27           HD2      PRO  27  81.035  15.577  -7.010
  205    HD3  PRO  27           HD1      PRO  27  80.771  16.853  -5.801
  206    HA   PRO  28           HA       PRO  28  75.823  11.467  -5.964
  207    HB2  PRO  28           HB2      PRO  28  74.369  12.400  -8.413
  208    HB3  PRO  28           HB1      PRO  28  73.750  11.514  -7.006
  209    HG2  PRO  28           HG2      PRO  28  73.310  14.123  -7.316
  210    HG3  PRO  28           HG1      PRO  28  73.584  13.409  -5.719
  211    HD2  PRO  28           HD2      PRO  28  75.391  15.132  -7.337
  212    HD3  PRO  28           HD1      PRO  28  75.319  14.912  -5.575
  213    H    LYS  29           HN       LYS  29  75.839   9.553  -7.451
  214    HA   LYS  29           HA       LYS  29  77.112   9.752 -10.049
  215    HB2  LYS  29           HB2      LYS  29  78.858   9.733  -7.845
  216    HB3  LYS  29           HB1      LYS  29  78.877   8.073  -8.435
  217    HG2  LYS  29           HG2      LYS  29  79.224  10.475 -10.247
  218    HG3  LYS  29           HG1      LYS  29  80.580   9.608  -9.525
  219    HD2  LYS  29           HD2      LYS  29  79.882   7.536 -10.612
  220    HD3  LYS  29           HD1      LYS  29  78.452   8.333 -11.269
  221    HE2  LYS  29           HE2      LYS  29  79.985   9.938 -12.459
  222    HE3  LYS  29           HE1      LYS  29  81.345   8.950 -11.928
  223    HZ1  LYS  29           HZ1      LYS  29  79.124   8.184 -13.728
  224    HZ2  LYS  29           HZ2      LYS  29  80.133   7.031 -12.993
  225    HZ3  LYS  29           HZ3      LYS  29  80.788   8.182 -14.057
  226    H1U  RCY  30           H1U      RCY  30  76.827   1.254 -12.454
  227    H1S  RCY  30           H1S      RCY  30  73.937   2.777  -9.830
  228    HB1  RCY  30           HB1      RCY  30  75.135   5.530 -10.426
  229    HB2  RCY  30           HB2      RCY  30  74.078   6.903 -10.098
  230    HA   RCY  30           HA       RCY  30  74.318   6.062  -7.593
  231    HN1  RCY  30           HN1      RCY  30  75.549   8.061  -7.539
  232    H    LYS  31           HN       LYS  31  77.088   5.525  -9.785
  233    HA   LYS  31           HA       LYS  31  77.991   3.350  -7.933
  234    HB2  LYS  31           HB2      LYS  31  78.803   2.176 -10.031
  235    HB3  LYS  31           HB1      LYS  31  77.050   2.257  -9.856
  236    HG2  LYS  31           HG2      LYS  31  76.815   3.846 -11.536
  237    HG3  LYS  31           HG1      LYS  31  78.454   4.463 -11.323
  238    HD2  LYS  31           HD2      LYS  31  78.172   3.141 -13.432
  239    HD3  LYS  31           HD1      LYS  31  79.392   2.467 -12.351
  240    HE2  LYS  31           HE2      LYS  31  76.579   1.507 -12.046
  241    HE3  LYS  31           HE1      LYS  31  77.501   0.928 -13.433
  242    HZ1  LYS  31           HZ1      LYS  31  77.676   0.100 -10.763
  243    HZ2  LYS  31           HZ2      LYS  31  79.155   0.821 -11.187
  244    HZ3  LYS  31           HZ3      LYS  31  78.545  -0.474 -12.102
  245    H    GLN  32           HN       GLN  32  80.032   3.319 -10.472
  246    HA   GLN  32           HA       GLN  32  81.628   5.664 -10.154
  247    HB2  GLN  32           HB2      GLN  32  83.523   4.549  -8.862
  248    HB3  GLN  32           HB1      GLN  32  82.101   4.964  -7.910
  249    HG2  GLN  32           HG2      GLN  32  81.308   2.540  -8.502
  250    HG3  GLN  32           HG1      GLN  32  83.013   2.256  -8.852
  251   HE21  GLN  32          HE21      GLN  32  80.684   2.568  -6.302
  252   HE22  GLN  32          HE22      GLN  32  81.776   2.476  -5.006
  253    H    ARG  33           HN       ARG  33  83.866   3.254 -10.016
  254    HA   ARG  33           HA       ARG  33  83.606   2.500 -12.887
  255    HE   ARG  33           HE       ARG  33  84.549   4.674 -16.603
  256    HB2  ARG  33           HB2      ARG  33  85.710   4.169 -11.624
  257    HB3  ARG  33           HB1      ARG  33  86.304   2.895 -12.687
  258    HG2  ARG  33           HG2      ARG  33  84.030   4.613 -13.623
  259    HG3  ARG  33           HG1      ARG  33  85.668   5.266 -13.678
  260    HD2  ARG  33           HD2      ARG  33  86.353   3.787 -15.300
  261    HD3  ARG  33           HD1      ARG  33  85.281   2.506 -14.733
  262   HH11  ARG  33          HH21      ARG  33  83.663   2.035 -14.570
  263   HH12  ARG  33          HH22      ARG  33  82.136   1.776 -15.346
  264   HH21  ARG  33          HH11      ARG  33  82.561   4.351 -17.629
  265   HH22  ARG  33          HH12      ARG  33  81.512   3.087 -17.078
  266    H    GLN  34           HN       GLN  34  84.700   1.826  -9.665
  267    HA   GLN  34           HA       GLN  34  85.167  -0.997 -10.462
  268    HB2  GLN  34           HB2      GLN  34  87.189   0.862  -9.262
  269    HB3  GLN  34           HB1      GLN  34  87.185  -0.817  -8.723
  270    HG2  GLN  34           HG2      GLN  34  87.549  -1.632 -10.938
  271    HG3  GLN  34           HG1      GLN  34  87.194  -0.058 -11.651
  272   HE21  GLN  34          HE21      GLN  34  89.453  -1.352  -9.135
  273   HE22  GLN  34          HE22      GLN  34  90.796  -0.474  -9.689
  274    H    THR  35           HN       THR  35  83.884  -2.178  -9.151
  275    HA   THR  35           HA       THR  35  83.906  -1.824  -6.267
  276    HB   THR  35           HB       THR  35  82.351  -0.083  -6.508
  277    HG1  THR  35           HG1      THR  35  80.741  -0.970  -5.488
  278   HG21  THR  35          HG21      THR  35  80.417  -0.322  -8.173
  279   HG22  THR  35          HG22      THR  35  81.315  -1.679  -8.854
  280   HG23  THR  35          HG23      THR  35  82.019  -0.062  -8.863
  281    H    ARG  36           HN       ARG  36  83.410  -3.581  -9.051
  282    HA   ARG  36           HA       ARG  36  81.664  -5.624  -7.825
  283    HE   ARG  36           HE       ARG  36  84.576  -3.893  -9.020
  284    HB2  ARG  36           HB2      ARG  36  82.324  -6.773 -10.144
  285    HB3  ARG  36           HB1      ARG  36  81.109  -5.502 -10.067
  286    HG2  ARG  36           HG2      ARG  36  82.692  -5.005 -11.865
  287    HG3  ARG  36           HG1      ARG  36  82.878  -3.818 -10.574
  288    HD2  ARG  36           HD2      ARG  36  84.551  -6.271 -10.377
  289    HD3  ARG  36           HD1      ARG  36  84.976  -5.124 -11.648
  290   HH11  ARG  36          HH21      ARG  36  86.717  -5.423 -11.247
  291   HH12  ARG  36          HH22      ARG  36  88.144  -4.716 -10.567
  292   HH21  ARG  36          HH11      ARG  36  86.427  -2.961  -8.118
  293   HH22  ARG  36          HH12      ARG  36  87.980  -3.322  -8.795
  294    H    GLN  37           HN       GLN  37  84.196  -5.179  -6.529
  295    HA   GLN  37           HA       GLN  37  85.477  -7.842  -7.025
  296    HB2  GLN  37           HB2      GLN  37  86.902  -5.944  -7.830
  297    HB3  GLN  37           HB1      GLN  37  86.913  -5.306  -6.186
  298    HG2  GLN  37           HG2      GLN  37  87.911  -7.427  -5.381
  299    HG3  GLN  37           HG1      GLN  37  87.936  -8.032  -7.038
  300   HE21  GLN  37          HE21      GLN  37  89.838  -6.454  -4.743
  301   HE22  GLN  37          HE22      GLN  37  90.966  -5.739  -5.791
  302    H1U  RCY  38           H1U      RCY  38  83.181  -4.064  -0.587
  303    H1S  RCY  38           H1S      RCY  38  82.389  -8.374  -0.620
  304    HB1  RCY  38           HB1      RCY  38  85.313 -10.711  -2.411
  305    HB2  RCY  38           HB2      RCY  38  84.452 -10.528  -3.938
  306    HA   RCY  38           HA       RCY  38  84.567  -7.958  -2.675
  307    HN1  RCY  38           HN1      RCY  38  85.421  -9.109  -5.241
  308    H    LYS  39           HN       LYS  39  86.082  -9.833  -1.004
  309    HA   LYS  39           HA       LYS  39  88.854  -8.753  -1.359
  310    HB2  LYS  39           HB2      LYS  39  87.190  -8.848   1.168
  311    HB3  LYS  39           HB1      LYS  39  88.932  -8.573   1.164
  312    HG2  LYS  39           HG2      LYS  39  88.447  -6.674  -0.513
  313    HG3  LYS  39           HG1      LYS  39  86.763  -6.833  -0.012
  314    HD2  LYS  39           HD2      LYS  39  87.505  -5.235   1.502
  315    HD3  LYS  39           HD1      LYS  39  87.807  -6.713   2.417
  316    HE2  LYS  39           HE2      LYS  39  89.873  -5.681   2.621
  317    HE3  LYS  39           HE1      LYS  39  90.138  -6.619   1.151
  318    HZ1  LYS  39           HZ1      LYS  39  89.110  -3.845   1.092
  319    HZ2  LYS  39           HZ2      LYS  39  89.772  -4.749  -0.186
  320    HZ3  LYS  39           HZ3      LYS  39  90.770  -4.192   1.071
  321    H    SER  40           HN       SER  40  88.713 -10.284   1.534
  322    HA   SER  40           HA       SER  40  90.365 -12.442   0.821
  323    HG   SER  40           HG       SER  40  89.657 -13.819   4.070
  324    HB2  SER  40           HB2      SER  40  90.223 -11.802   3.123
  325    HB3  SER  40           HB1      SER  40  88.484 -12.076   3.160
  326    H    LYS  41           HN       LYS  41  86.959 -12.869   1.859
  327    HA   LYS  41           HA       LYS  41  86.581 -15.487   1.130
  328    HB2  LYS  41           HB2      LYS  41  84.190 -14.658   0.355
  329    HB3  LYS  41           HB1      LYS  41  84.664 -14.556   2.048
  330    HG2  LYS  41           HG2      LYS  41  85.481 -12.227   0.434
  331    HG3  LYS  41           HG1      LYS  41  83.734 -12.434   0.567
  332    HD2  LYS  41           HD2      LYS  41  84.094 -12.717   3.079
  333    HD3  LYS  41           HD1      LYS  41  85.741 -12.144   2.811
  334    HE2  LYS  41           HE2      LYS  41  83.185 -10.650   2.159
  335    HE3  LYS  41           HE1      LYS  41  84.340 -10.250   3.430
  336    HZ1  LYS  41           HZ1      LYS  41  84.378  -9.357   0.833
  337    HZ2  LYS  41           HZ2      LYS  41  85.627 -10.506   0.910
  338    HZ3  LYS  41           HZ3      LYS  41  85.614  -9.187   1.981
  339    HA   PRO  42           HA       PRO  42  87.296 -15.698  -3.246
  340    HB2  PRO  42           HB2      PRO  42  85.936 -18.002  -3.827
  341    HB3  PRO  42           HB1      PRO  42  87.490 -17.985  -2.972
  342    HG2  PRO  42           HG2      PRO  42  84.738 -18.269  -1.874
  343    HG3  PRO  42           HG1      PRO  42  86.231 -19.103  -1.411
  344    HD2  PRO  42           HD2      PRO  42  85.194 -17.008   0.018
  345    HD3  PRO  42           HD1      PRO  42  86.933 -17.373  -0.042
  346    HA   PRO  43           HA       PRO  43  83.798 -13.997  -5.356
  347    HB2  PRO  43           HB2      PRO  43  84.148 -14.940  -7.911
  348    HB3  PRO  43           HB1      PRO  43  85.142 -13.655  -7.197
  349    HG2  PRO  43           HG2      PRO  43  85.755 -16.546  -7.539
  350    HG3  PRO  43           HG1      PRO  43  86.811 -15.136  -7.729
  351    HD2  PRO  43           HD2      PRO  43  86.843 -16.730  -5.500
  352    HD3  PRO  43           HD1      PRO  43  87.267 -15.004  -5.463
  353    H    LYS  44           HN       LYS  44  81.699 -14.650  -5.171
  354    HA   LYS  44           HA       LYS  44  80.607 -16.867  -6.614
  355    HB2  LYS  44           HB2      LYS  44  81.922 -17.633  -4.248
  356    HB3  LYS  44           HB1      LYS  44  80.215 -17.634  -3.820
  357    HG2  LYS  44           HG2      LYS  44  81.300 -18.980  -6.307
  358    HG3  LYS  44           HG1      LYS  44  81.066 -19.822  -4.775
  359    HD2  LYS  44           HD2      LYS  44  78.701 -19.415  -4.814
  360    HD3  LYS  44           HD1      LYS  44  78.855 -18.291  -6.165
  361    HE2  LYS  44           HE2      LYS  44  78.093 -20.769  -6.617
  362    HE3  LYS  44           HE1      LYS  44  79.236 -19.993  -7.713
  363    HZ1  LYS  44           HZ1      LYS  44  80.994 -21.173  -6.865
  364    HZ2  LYS  44           HZ2      LYS  44  79.752 -22.326  -6.751
  365    HZ3  LYS  44           HZ3      LYS  44  80.241 -21.460  -5.373
  366    H    LYS  45           HN       LYS  45  78.538 -17.423  -4.557
  367    HA   LYS  45           HA       LYS  45  77.298 -14.727  -4.241
  368    HB2  LYS  45           HB2      LYS  45  76.166 -17.116  -5.695
  369    HB3  LYS  45           HB1      LYS  45  75.095 -15.935  -4.941
  370    HG2  LYS  45           HG2      LYS  45  76.376 -14.139  -6.212
  371    HG3  LYS  45           HG1      LYS  45  77.140 -15.446  -7.118
  372    HD2  LYS  45           HD2      LYS  45  74.984 -16.227  -7.916
  373    HD3  LYS  45           HD1      LYS  45  74.142 -15.056  -6.901
  374    HE2  LYS  45           HE2      LYS  45  75.806 -13.399  -8.265
  375    HE3  LYS  45           HE1      LYS  45  75.551 -14.655  -9.477
  376    HZ1  LYS  45           HZ1      LYS  45  73.628 -12.806  -8.279
  377    HZ2  LYS  45           HZ2      LYS  45  73.077 -14.359  -8.694
  378    HZ3  LYS  45           HZ3      LYS  45  73.754 -13.349  -9.881
  379    H    GLY  46           HN       GLY  46  78.439 -15.926  -2.120
  380    HA2  GLY  46           HA2      GLY  46  77.656 -16.205   0.135
  381    HA3  GLY  46           HA1      GLY  46  76.085 -16.701  -0.498
  382    H    VAL  47           HN       VAL  47  78.761 -17.857   1.045
  383    HA   VAL  47           HA       VAL  47  78.037 -20.644   0.394
  384    HB   VAL  47           HB       VAL  47  80.554 -21.164   0.140
  385   HG11  VAL  47          HG11      VAL  47  80.455 -20.821  -2.249
  386   HG12  VAL  47          HG12      VAL  47  79.272 -19.526  -2.064
  387   HG13  VAL  47          HG13      VAL  47  78.821 -21.191  -1.697
  388   HG21  VAL  47          HG21      VAL  47  81.182 -18.807   0.898
  389   HG22  VAL  47          HG22      VAL  47  80.631 -18.250  -0.683
  390   HG23  VAL  47          HG23      VAL  47  81.985 -19.374  -0.566
  391    H    GLN  48           HN       GLN  48  79.304 -18.231   2.461
  392    HA   GLN  48           HA       GLN  48  80.343 -20.143   4.452
  393    HB2  GLN  48           HB2      GLN  48  81.390 -17.882   4.043
  394    HB3  GLN  48           HB1      GLN  48  79.938 -17.152   4.729
  395    HG2  GLN  48           HG2      GLN  48  80.320 -18.559   6.796
  396    HG3  GLN  48           HG1      GLN  48  81.882 -19.016   6.115
  397   HE21  GLN  48          HE21      GLN  48  80.081 -15.888   6.371
  398   HE22  GLN  48          HE22      GLN  48  81.391 -15.024   7.017
  399    H    GLY  49           HN       GLY  49  78.111 -17.392   4.905
  400    HA2  GLY  49           HA2      GLY  49  76.107 -19.227   6.092
  401    HA3  GLY  49           HA1      GLY  49  76.772 -17.974   7.141
  402    H1U  RCY  50           H1U      RCY  50  77.252  -9.149   5.109
  403    H1S  RCY  50           H1S      RCY  50  73.209 -11.793   4.740
  404    HB1  RCY  50           HB1      RCY  50  75.726 -14.684   2.973
  405    HB2  RCY  50           HB2      RCY  50  75.428 -14.698   4.711
  406    HA   RCY  50           HA       RCY  50  73.475 -16.314   4.147
  407    HN1  RCY  50           HN1      RCY  50  75.873 -17.848   3.687
  408    H    GLY  51           HN       GLY  51  72.462 -15.720   2.106
  409    HA2  GLY  51           HA2      GLY  51  72.068 -15.923  -0.214
  410    HA3  GLY  51           HA1      GLY  51  73.759 -16.386  -0.417
  411    H    ASP  52           HN       ASP  52  73.101 -18.424   1.874
  412    HA   ASP  52           HA       ASP  52  72.794 -20.704   0.180
  413    HB2  ASP  52           HB2      ASP  52  71.972 -21.607   2.650
  414    HB3  ASP  52           HB1      ASP  52  73.657 -21.474   2.147
  415    H    ASP  53           HN       ASP  53  70.495 -18.475   1.422
  416    HA   ASP  53           HA       ASP  53  68.325 -19.918   0.093
  417    HB2  ASP  53           HB2      ASP  53  68.426 -19.650   3.104
  418    HB3  ASP  53           HB1      ASP  53  66.911 -19.874   2.231
  419    H    ILE  54           HN       ILE  54  68.264 -17.620   2.816
  420    HA   ILE  54           HA       ILE  54  66.999 -15.633   0.973
  421    HB   ILE  54           HB       ILE  54  66.832 -15.577   3.987
  422   HG12  ILE  54          HG12      ILE  54  64.437 -16.604   3.261
  423   HG13  ILE  54          HG11      ILE  54  65.461 -17.362   2.041
  424   HG21  ILE  54          HG21      ILE  54  66.166 -13.555   2.745
  425   HG22  ILE  54          HG22      ILE  54  64.761 -14.319   3.488
  426   HG23  ILE  54          HG23      ILE  54  65.062 -14.516   1.762
  427   HD11  ILE  54          HD11      ILE  54  67.022 -17.964   4.021
  428   HD12  ILE  54          HD12      ILE  54  65.528 -18.884   3.844
  429   HD13  ILE  54          HD13      ILE  54  65.633 -17.595   5.043
  430    HA   PRO  55           HA       PRO  55  70.946 -13.598   1.966
  431    HB2  PRO  55           HB2      PRO  55  70.970 -11.883  -0.146
  432    HB3  PRO  55           HB1      PRO  55  71.415 -13.594  -0.299
  433    HG2  PRO  55           HG2      PRO  55  68.889 -12.226  -1.051
  434    HG3  PRO  55           HG1      PRO  55  69.736 -13.560  -1.851
  435    HD2  PRO  55           HD2      PRO  55  67.508 -13.863  -0.211
  436    HD3  PRO  55           HD1      PRO  55  68.672 -15.152  -0.584
  437    H    GLY  56           HN       GLY  56  70.484 -12.371   3.788
  438    HA2  GLY  56           HA2      GLY  56  70.397  -9.991   4.504
  439    HA3  GLY  56           HA1      GLY  56  69.105  -9.756   3.325
  440    H    MET  57           HN       MET  57  67.276 -11.581   3.722
  441    HA   MET  57           HA       MET  57  65.430 -11.995   5.130
  442    HB2  MET  57           HB2      MET  57  67.017 -13.830   5.709
  443    HB3  MET  57           HB1      MET  57  67.683 -12.819   6.991
  444    HG2  MET  57           HG2      MET  57  65.831 -13.061   8.335
  445    HG3  MET  57           HG1      MET  57  64.725 -13.181   6.966
  446    HE1  MET  57           HE1      MET  57  63.765 -14.869   8.836
  447    HE2  MET  57           HE2      MET  57  63.809 -16.542   8.286
  448    HE3  MET  57           HE3      MET  57  63.331 -15.266   7.169
  449    H    GLU  58           HN       GLU  58  66.452  -9.274   5.244
  450    HA   GLU  58           HA       GLU  58  65.380  -8.553   7.914
  451    HB2  GLU  58           HB2      GLU  58  67.229  -6.950   8.301
  452    HB3  GLU  58           HB1      GLU  58  67.822  -8.609   8.226
  453    HG2  GLU  58           HG2      GLU  58  69.333  -7.463   6.841
  454    HG3  GLU  58           HG1      GLU  58  68.170  -8.115   5.687
  455    H    GLY  59           HN       GLY  59  65.881  -7.915   4.573
  456    HA2  GLY  59           HA2      GLY  59  63.763  -6.038   4.405
  457    HA3  GLY  59           HA1      GLY  59  65.272  -5.128   4.489
  458    H1U  RCY  60           H1U      RCY  60  70.580  -4.885   1.682
  459    H1S  RCY  60           H1S      RCY  60  68.842  -7.326  -1.544
  460    HB1  RCY  60           HB1      RCY  60  65.996  -9.880   0.819
  461    HB2  RCY  60           HB2      RCY  60  67.355  -9.167   1.685
  462    HA   RCY  60           HA       RCY  60  66.524  -6.942   0.523
  463    HN1  RCY  60           HN1      RCY  60  65.955  -8.069   3.082
  464    H    GLY  61           HN       GLY  61  64.328  -5.871   0.295
  465    HA2  GLY  61           HA2      GLY  61  62.749  -6.195  -1.672
  466    HA3  GLY  61           HA1      GLY  61  62.359  -7.754  -0.945
  467    H    THR  62           HN       THR  62  62.912  -5.446   1.456
  468    HA   THR  62           HA       THR  62  60.095  -4.514   1.509
  469    HB   THR  62           HB       THR  62  59.534  -5.503   3.547
  470    HG1  THR  62           HG1      THR  62  61.718  -6.597   4.489
  471   HG21  THR  62          HG21      THR  62  61.487  -7.494   2.359
  472   HG22  THR  62          HG22      THR  62  59.843  -7.230   1.777
  473   HG23  THR  62          HG23      THR  62  60.112  -7.869   3.398
  474    H    ASP  63           HN       ASP  63  62.723  -4.625   3.935
  475    HA   ASP  63           HA       ASP  63  62.321  -1.852   4.637
  476    HB2  ASP  63           HB2      ASP  63  63.587  -4.007   5.818
  477    HB3  ASP  63           HB1      ASP  63  64.949  -3.005   5.320
  478    H    ILE  64           HN       ILE  64  64.718  -3.565   2.646
  479    HA   ILE  64           HA       ILE  64  66.365  -1.289   2.096
  480    HB   ILE  64           HB       ILE  64  65.874  -3.901   0.667
  481   HG12  ILE  64          HG12      ILE  64  68.500  -2.849   1.677
  482   HG13  ILE  64          HG11      ILE  64  67.324  -3.476   2.832
  483   HG21  ILE  64          HG21      ILE  64  67.915  -3.139  -0.739
  484   HG22  ILE  64          HG22      ILE  64  67.460  -1.506  -0.253
  485   HG23  ILE  64          HG23      ILE  64  66.331  -2.497  -1.176
  486   HD11  ILE  64          HD11      ILE  64  67.837  -5.131   0.410
  487   HD12  ILE  64          HD12      ILE  64  67.520  -5.635   2.070
  488   HD13  ILE  64          HD13      ILE  64  69.124  -5.062   1.614
  489    H    THR  65           HN       THR  65  63.210  -2.098   1.089
  490    HA   THR  65           HA       THR  65  61.927  -1.390  -0.807
  491    HB   THR  65           HB       THR  65  61.508   0.288   0.911
  492    HG1  THR  65           HG1      THR  65  61.972   1.239  -1.703
  493   HG21  THR  65          HG21      THR  65  63.758   0.914   1.502
  494   HG22  THR  65          HG22      THR  65  62.941   2.368   0.929
  495   HG23  THR  65          HG23      THR  65  64.072   1.520  -0.124
  496    H    VAL  66           HN       VAL  66  64.396  -2.200  -1.785
  497    HA   VAL  66           HA       VAL  66  65.694  -1.977  -3.726
  498    HB   VAL  66           HB       VAL  66  64.175   0.555  -4.371
  499   HG11  VAL  66          HG11      VAL  66  66.069  -0.066  -5.815
  500   HG12  VAL  66          HG12      VAL  66  64.546  -0.247  -6.685
  501   HG13  VAL  66          HG13      VAL  66  65.374  -1.669  -6.051
  502   HG21  VAL  66          HG21      VAL  66  62.667  -1.176  -5.654
  503   HG22  VAL  66          HG22      VAL  66  62.355  -0.856  -3.948
  504   HG23  VAL  66          HG23      VAL  66  63.242  -2.304  -4.426
  505    H    ILE  67           HN       ILE  67  64.953   1.146  -2.186
  506    HA   ILE  67           HA       ILE  67  67.882   1.618  -1.910
  507    HB   ILE  67           HB       ILE  67  65.832   3.595  -2.958
  508   HG12  ILE  67          HG12      ILE  67  68.220   3.617  -4.450
  509   HG13  ILE  67          HG11      ILE  67  67.877   1.914  -4.143
  510   HG21  ILE  67          HG21      ILE  67  67.104   4.860  -1.410
  511   HG22  ILE  67          HG22      ILE  67  67.903   5.138  -2.957
  512   HG23  ILE  67          HG23      ILE  67  68.592   3.998  -1.801
  513   HD11  ILE  67          HD11      ILE  67  66.068   3.954  -5.455
  514   HD12  ILE  67          HD12      ILE  67  65.490   2.384  -4.897
  515   HD13  ILE  67          HD13      ILE  67  66.716   2.473  -6.162
  516    H1U  RCY  68           H1U      RCY  68  73.537   4.232   0.558
  517    H1S  RCY  68           H1S      RCY  68  69.795   3.013   1.411
  518    HB1  RCY  68           HB1      RCY  68  67.033   0.579   3.111
  519    HB2  RCY  68           HB2      RCY  68  67.811   2.012   3.778
  520    HA   RCY  68           HA       RCY  68  65.774   2.211   2.060
  521    HN1  RCY  68           HN1      RCY  68  67.854   1.255   0.331
  522    HA   PRO  69           HA       PRO  69  66.976   6.512   1.776
  523    HB2  PRO  69           HB2      PRO  69  65.296   7.488   3.724
  524    HB3  PRO  69           HB1      PRO  69  64.772   7.095   2.075
  525    HG2  PRO  69           HG2      PRO  69  64.468   5.519   4.577
  526    HG3  PRO  69           HG1      PRO  69  63.347   5.715   3.220
  527    HD2  PRO  69           HD2      PRO  69  64.895   3.479   3.563
  528    HD3  PRO  69           HD1      PRO  69  64.358   4.051   1.969
  529    H    TRP  70           HN       TRP  70  67.014   4.686   4.775
  530    HA   TRP  70           HA       TRP  70  68.537   6.727   6.214
  531    HD1  TRP  70           HD1      TRP  70  69.482   2.456   6.596
  532    HE1  TRP  70           HE1      TRP  70  68.001   0.494   5.825
  533    HE3  TRP  70           HE3      TRP  70  64.901   4.708   6.726
  534    HZ2  TRP  70           HZ2      TRP  70  65.233  -0.050   5.327
  535    HZ3  TRP  70           HZ3      TRP  70  62.864   3.449   6.100
  536    HH2  TRP  70           HH2      TRP  70  63.021   1.077   5.402
  537    HB2  TRP  70           HB2      TRP  70  68.847   4.752   7.859
  538    HB3  TRP  70           HB1      TRP  70  67.213   5.372   7.624
  539    H    GLU  71           HN       GLU  71  69.415   4.939   3.646
  540    HA   GLU  71           HA       GLU  71  72.247   4.885   4.551
  541    HB2  GLU  71           HB2      GLU  71  70.608   2.515   3.788
  542    HB3  GLU  71           HB1      GLU  71  72.247   2.584   3.142
  543    HG2  GLU  71           HG2      GLU  71  71.725   3.103   6.064
  544    HG3  GLU  71           HG1      GLU  71  71.895   1.455   5.457
  545    H    ALA  72           HN       ALA  72  69.888   5.405   2.148
  546    HA   ALA  72           HA       ALA  72  71.338   5.059  -0.253
  547    HB1  ALA  72           HB1      ALA  72  69.820   6.672  -1.236
  548    HB2  ALA  72           HB2      ALA  72  69.442   7.349   0.349
  549    HB3  ALA  72           HB3      ALA  72  68.909   5.718  -0.064
  550    H1U  RCY  73           H1U      RCY  73  77.142   0.132   2.511
  551    H1S  RCY  73           H1S      RCY  73  76.077   4.235   0.238
  552    HB1  RCY  73           HB1      RCY  73  76.553   7.649   0.352
  553    HB2  RCY  73           HB2      RCY  73  75.885   6.303  -0.570
  554    HA   RCY  73           HA       RCY  73  74.302   8.257   1.127
  555    HN1  RCY  73           HN1      RCY  73  73.537   5.656   0.153
  556    H    ASN  74           HN       ASN  74  73.635   6.948  -2.072
  557    HA   ASN  74           HA       ASN  74  73.203   8.085  -4.079
  558    HB2  ASN  74           HB2      ASN  74  73.785  10.734  -2.784
  559    HB3  ASN  74           HB1      ASN  74  72.598  10.334  -4.024
  560   HD21  ASN  74          HD21      ASN  74  70.803   8.741  -3.206
  561   HD22  ASN  74          HD22      ASN  74  70.233   8.998  -1.628
  562    H    HIS  75           HN       HIS  75  75.812   9.808  -2.285
  563    HA   HIS  75           HA       HIS  75  77.312  10.287  -4.699
  564    HD1  HIS  75           HD1      HIS  75  80.323   9.227  -1.831
  565    HD2  HIS  75           HD2      HIS  75  76.667  10.394  -0.197
  566    HE1  HIS  75           HE1      HIS  75  80.241   8.254   0.506
  567    HE2  HIS  75           HE2      HIS  75  78.021   8.957   1.512
  568    HB2  HIS  75           HB2      HIS  75  79.110  11.023  -3.232
  569    HB3  HIS  75           HB1      HIS  75  77.576  11.640  -2.622
  570    H1U  RCY  76           H1U      RCY  76  76.138  -1.289  -4.801
  571    H1S  RCY  76           H1S      RCY  76  77.239   3.032  -3.406
  572    HB1  RCY  76           HB1      RCY  76  78.262   5.866  -4.707
  573    HB2  RCY  76           HB2      RCY  76  77.468   5.407  -3.201
  574    HA   RCY  76           HA       RCY  76  79.478   6.180  -1.946
  575    HN1  RCY  76           HN1      RCY  76  78.275   8.191  -1.949
  576    H    GLU  77           HN       GLU  77  79.957   8.506  -4.446
  577    HA   GLU  77           HA       GLU  77  82.250   7.249  -5.684
  578    HB2  GLU  77           HB2      GLU  77  80.744   9.173  -6.588
  579    HB3  GLU  77           HB1      GLU  77  81.783  10.227  -5.629
  580    HG2  GLU  77           HG2      GLU  77  82.792  10.161  -7.783
  581    HG3  GLU  77           HG1      GLU  77  83.760   9.071  -6.790
  582    H    LEU  78           HN       LEU  78  82.301   7.388  -2.729
  583    HA   LEU  78           HA       LEU  78  83.900   9.337  -1.583
  584    HG   LEU  78           HG       LEU  78  85.976   8.000  -0.188
  585    HB2  LEU  78           HB2      LEU  78  83.045   7.273  -0.428
  586    HB3  LEU  78           HB1      LEU  78  84.325   6.355  -1.218
  587   HD11  LEU  78          HD11      LEU  78  84.896   8.998   1.997
  588   HD12  LEU  78          HD12      LEU  78  83.397   8.878   1.077
  589   HD13  LEU  78          HD13      LEU  78  84.729   9.860   0.468
  590   HD21  LEU  78          HD21      LEU  78  85.809   6.922   2.082
  591   HD22  LEU  78          HD22      LEU  78  85.724   5.773   0.746
  592   HD23  LEU  78          HD23      LEU  78  84.253   6.251   1.593
  593    H    HIS  79           HN       HIS  79  84.788   6.983  -3.996
  594    HA   HIS  79           HA       HIS  79  87.165   8.401  -4.724
  595    HD1  HIS  79           HD1      HIS  79  87.958   9.386  -2.441
  596    HD2  HIS  79           HD2      HIS  79  90.885   6.839  -3.973
  597    HE1  HIS  79           HE1      HIS  79  90.152  10.642  -2.287
  598    HE2  HIS  79           HE2      HIS  79  91.942   9.103  -3.216
  599    HB2  HIS  79           HB2      HIS  79  87.455   6.542  -2.554
  600    HB3  HIS  79           HB1      HIS  79  88.301   5.885  -3.951
  601    H    GLU  80           HN       GLU  80  86.976   4.903  -4.625
  602    HA   GLU  80           HA       GLU  80  85.557   4.156  -6.858
  603    HB2  GLU  80           HB2      GLU  80  86.757   5.646  -8.329
  604    HB3  GLU  80           HB1      GLU  80  88.310   5.184  -7.634
  605    HG2  GLU  80           HG2      GLU  80  88.181   2.987  -8.587
  606    HG3  GLU  80           HG1      GLU  80  86.496   3.222  -9.054
  607    H    LEU  81           HN       LEU  81  88.656   3.982  -5.260
  608    HA   LEU  81           HA       LEU  81  88.688   1.013  -5.478
  609    HG   LEU  81           HG       LEU  81  92.140   1.217  -6.242
  610    HB2  LEU  81           HB2      LEU  81  90.747   3.067  -5.459
  611    HB3  LEU  81           HB1      LEU  81  91.016   1.941  -4.134
  612   HD11  LEU  81          HD11      LEU  81  91.661  -1.021  -5.891
  613   HD12  LEU  81          HD12      LEU  81  89.922  -0.743  -5.806
  614   HD13  LEU  81          HD13      LEU  81  90.949  -0.330  -4.433
  615   HD21  LEU  81          HD21      LEU  81  89.553   0.417  -7.449
  616   HD22  LEU  81          HD22      LEU  81  91.026   0.996  -8.227
  617   HD23  LEU  81          HD23      LEU  81  89.907   2.144  -7.493
  618    H    ALA  82           HN       ALA  82  87.404   3.314  -3.629
  619    HA   ALA  82           HA       ALA  82  88.155   2.978  -0.980
  620    HB1  ALA  82           HB1      ALA  82  85.861   3.572  -0.384
  621    HB2  ALA  82           HB2      ALA  82  85.294   3.102  -1.986
  622    HB3  ALA  82           HB3      ALA  82  86.349   4.501  -1.799
  623    H    GLN  83           HN       GLN  83  88.796   0.933  -0.361
  624    HA   GLN  83           HA       GLN  83  88.108  -1.574  -0.889
  625    HB2  GLN  83           HB2      GLN  83  87.689  -1.520   1.936
  626    HB3  GLN  83           HB1      GLN  83  89.160  -1.950   1.070
  627    HG2  GLN  83           HG2      GLN  83  89.624  -0.108   2.613
  628    HG3  GLN  83           HG1      GLN  83  89.763   0.463   0.949
  629   HE21  GLN  83          HE21      GLN  83  88.726   2.428   0.622
  630   HE22  GLN  83          HE22      GLN  83  87.352   2.963   1.464
  631    H    TYR  84           HN       TYR  84  85.966   0.329   1.283
  632    HA   TYR  84           HA       TYR  84  83.549  -0.456   0.021
  633    HD1  TYR  84           HD1      TYR  84  85.205  -0.430   3.139
  634    HD2  TYR  84           HD2      TYR  84  84.748  -4.534   1.958
  635    HE1  TYR  84           HE1      TYR  84  86.968  -1.091   4.754
  636    HE2  TYR  84           HE2      TYR  84  86.510  -5.196   3.572
  637    HH   TYR  84           HH       TYR  84  88.642  -3.097   4.926
  638    HB2  TYR  84           HB2      TYR  84  82.821  -2.083   1.938
  639    HB3  TYR  84           HB1      TYR  84  83.799  -2.710   0.618
  640    H    GLY  85           HN       GLY  85  84.330   1.952   1.089
  641    HA2  GLY  85           HA2      GLY  85  83.844   3.562   2.754
  642    HA3  GLY  85           HA1      GLY  85  82.237   2.834   2.673
  643    H    ILE  86           HN       ILE  86  85.328   1.512   3.825
  644    HA   ILE  86           HA       ILE  86  85.991   0.709   5.912
  645    HB   ILE  86           HB       ILE  86  85.213   1.717   7.839
  646   HG12  ILE  86          HG12      ILE  86  82.569   2.471   7.624
  647   HG13  ILE  86          HG11      ILE  86  82.603   0.971   6.696
  648   HG21  ILE  86          HG21      ILE  86  84.956   3.936   7.336
  649   HG22  ILE  86          HG22      ILE  86  83.631   3.634   6.213
  650   HG23  ILE  86          HG23      ILE  86  85.298   3.375   5.700
  651   HD11  ILE  86          HD11      ILE  86  83.610   1.328   9.535
  652   HD12  ILE  86          HD12      ILE  86  83.704  -0.168   8.605
  653   HD13  ILE  86          HD13      ILE  86  82.132   0.492   9.058
  654    H1U  RCY  87           H1U      RCY  87  80.323   1.238  -0.494
  655    H1S  RCY  87           H1S      RCY  87  78.465  -0.231   3.754
  656    HB1  RCY  87           HB1      RCY  87  80.524  -2.679   4.553
  657    HB2  RCY  87           HB2      RCY  87  81.245  -1.436   3.534
  658    HA   RCY  87           HA       RCY  87  82.170  -2.114   6.343
  659    HN1  RCY  87           HN1      RCY  87  82.865   0.083   4.590
  Start of MODEL  100
    1    HA   MET   1           HA       MET   1  66.926  13.382  25.467
    2    HB2  MET   1           HB2      MET   1  65.042  12.084  26.641
    3    HB3  MET   1           HB1      MET   1  65.107  10.977  25.269
    4    HG2  MET   1           HG2      MET   1  67.598  10.752  25.707
    5    HG3  MET   1           HG1      MET   1  67.332  11.628  27.214
    6    HE1  MET   1           HE1      MET   1  66.398  10.867  29.205
    7    HE2  MET   1           HE2      MET   1  65.427   9.425  29.493
    8    HE3  MET   1           HE3      MET   1  64.767  10.747  28.534
    9    H    ASN   2           HN       ASN   2  64.916  11.605  23.090
   10    HA   ASN   2           HA       ASN   2  66.989  11.801  21.069
   11    HB2  ASN   2           HB2      ASN   2  67.655   9.898  22.778
   12    HB3  ASN   2           HB1      ASN   2  66.439   8.967  21.905
   13   HD21  ASN   2          HD21      ASN   2  69.347  11.006  21.282
   14   HD22  ASN   2          HD22      ASN   2  69.838  10.143  19.904
   15    H    LEU   3           HN       LEU   3  66.313  10.315  19.128
   16    HA   LEU   3           HA       LEU   3  63.420  10.724  18.742
   17    HG   LEU   3           HG       LEU   3  65.462  11.930  15.882
   18    HB2  LEU   3           HB2      LEU   3  65.400   9.538  16.778
   19    HB3  LEU   3           HB1      LEU   3  63.834  10.258  16.419
   20   HD11  LEU   3          HD11      LEU   3  64.628  12.676  18.686
   21   HD12  LEU   3          HD12      LEU   3  63.450  12.558  17.378
   22   HD13  LEU   3          HD13      LEU   3  64.773  13.720  17.271
   23   HD21  LEU   3          HD21      LEU   3  67.093  10.633  17.633
   24   HD22  LEU   3          HD22      LEU   3  66.668  12.053  18.589
   25   HD23  LEU   3          HD23      LEU   3  67.428  12.248  17.009
   26    H    GLU   4           HN       GLU   4  62.303   8.830  17.464
   27    HA   GLU   4           HA       GLU   4  63.064   6.222  18.716
   28    HB2  GLU   4           HB2      GLU   4  60.345   7.530  18.532
   29    HB3  GLU   4           HB1      GLU   4  60.535   5.797  18.799
   30    HG2  GLU   4           HG2      GLU   4  61.943   7.836  20.527
   31    HG3  GLU   4           HG1      GLU   4  60.314   7.268  20.897
   32    HA   PRO   5           HA       PRO   5  63.222   4.612  14.573
   33    HB2  PRO   5           HB2      PRO   5  61.618   2.388  15.793
   34    HB3  PRO   5           HB1      PRO   5  63.055   2.299  14.755
   35    HG2  PRO   5           HG2      PRO   5  63.191   1.957  17.408
   36    HG3  PRO   5           HG1      PRO   5  64.495   2.718  16.484
   37    HD2  PRO   5           HD2      PRO   5  62.606   3.952  18.395
   38    HD3  PRO   5           HD1      PRO   5  64.183   4.544  17.830
   39    HA   PRO   6           HA       PRO   6  59.180   5.748  13.015
   40    HB2  PRO   6           HB2      PRO   6  59.488   5.039  10.408
   41    HB3  PRO   6           HB1      PRO   6  60.320   6.439  11.116
   42    HG2  PRO   6           HG2      PRO   6  61.372   3.709  10.562
   43    HG3  PRO   6           HG1      PRO   6  62.146   5.286  10.330
   44    HD2  PRO   6           HD2      PRO   6  62.660   3.654  12.485
   45    HD3  PRO   6           HD1      PRO   6  62.828   5.423  12.534
   46    H    LYS   7           HN       LYS   7  57.179   4.748  12.426
   47    HA   LYS   7           HA       LYS   7  56.883   1.984  13.139
   48    HB2  LYS   7           HB2      LYS   7  54.572   2.338  11.980
   49    HB3  LYS   7           HB1      LYS   7  54.938   3.277  13.428
   50    HG2  LYS   7           HG2      LYS   7  55.407   5.234  12.185
   51    HG3  LYS   7           HG1      LYS   7  55.577   4.336  10.676
   52    HD2  LYS   7           HD2      LYS   7  53.426   5.512  10.707
   53    HD3  LYS   7           HD1      LYS   7  53.159   3.770  10.765
   54    HE2  LYS   7           HE2      LYS   7  51.782   5.143  12.412
   55    HE3  LYS   7           HE1      LYS   7  52.716   3.823  13.118
   56    HZ1  LYS   7           HZ1      LYS   7  53.755   6.590  12.941
   57    HZ2  LYS   7           HZ2      LYS   7  54.346   5.306  13.884
   58    HZ3  LYS   7           HZ3      LYS   7  52.864   6.039  14.275
   59    H    ALA   8           HN       ALA   8  57.203   0.193  11.897
   60    HA   ALA   8           HA       ALA   8  56.917   0.385   8.955
   61    HB1  ALA   8           HB1      ALA   8  59.189   0.724   8.833
   62    HB2  ALA   8           HB2      ALA   8  59.222  -1.029   9.019
   63    HB3  ALA   8           HB3      ALA   8  59.484   0.011  10.418
   64    H    GLU   9           HN       GLU   9  58.275  -1.937  11.329
   65    HA   GLU   9           HA       GLU   9  57.770  -4.205  11.656
   66    HB2  GLU   9           HB2      GLU   9  55.660  -3.136  12.479
   67    HB3  GLU   9           HB1      GLU   9  54.983  -3.303  10.860
   68    HG2  GLU   9           HG2      GLU   9  54.237  -5.189  12.192
   69    HG3  GLU   9           HG1      GLU   9  55.404  -5.776  11.007
   70    H1U  RCY  10           H1U      RCY  10  58.345  -7.735   3.382
   71    H1S  RCY  10           H1S      RCY  10  57.445  -8.105   7.359
   72    HB1  RCY  10           HB1      RCY  10  54.522  -6.600   6.730
   73    HB2  RCY  10           HB2      RCY  10  53.983  -6.009   8.301
   74    HA   RCY  10           HA       RCY  10  56.858  -5.690   7.461
   75    HN1  RCY  10           HN1      RCY  10  55.134  -4.224   9.420
   76    H    ARG  11           HN       ARG  11  57.386  -4.206   5.896
   77    HA   ARG  11           HA       ARG  11  55.688  -2.001   5.149
   78    HE   ARG  11           HE       ARG  11  56.244  -0.293   5.538
   79    HB2  ARG  11           HB2      ARG  11  57.810  -3.176   3.354
   80    HB3  ARG  11           HB1      ARG  11  57.327  -1.489   3.529
   81    HG2  ARG  11           HG2      ARG  11  58.819  -3.172   5.560
   82    HG3  ARG  11           HG1      ARG  11  59.443  -1.781   4.671
   83    HD2  ARG  11           HD2      ARG  11  57.424  -1.842   6.902
   84    HD3  ARG  11           HD1      ARG  11  58.867  -0.841   6.742
   85   HH11  ARG  11          HH21      ARG  11  59.647   0.254   5.584
   86   HH12  ARG  11          HH22      ARG  11  59.545   1.791   4.792
   87   HH21  ARG  11          HH11      ARG  11  56.090   1.711   4.505
   88   HH22  ARG  11          HH12      ARG  11  57.531   2.616   4.182
   89    H    SER  12           HN       SER  12  56.180  -2.563   2.185
   90    HA   SER  12           HA       SER  12  53.590  -3.453   1.494
   91    HG   SER  12           HG       SER  12  54.123  -2.855  -1.609
   92    HB2  SER  12           HB2      SER  12  55.345  -2.289   0.011
   93    HB3  SER  12           HB1      SER  12  56.014  -3.896  -0.257
   94    H    ALA  13           HN       ALA  13  53.470  -5.530  -0.111
   95    HA   ALA  13           HA       ALA  13  54.889  -7.832   1.124
   96    HB1  ALA  13           HB1      ALA  13  52.797  -7.652   2.388
   97    HB2  ALA  13           HB2      ALA  13  52.739  -9.069   1.339
   98    HB3  ALA  13           HB3      ALA  13  51.872  -7.601   0.887
   99    H    THR  14           HN       THR  14  55.848  -7.424  -1.137
  100    HA   THR  14           HA       THR  14  56.137  -8.283  -3.298
  101    HB   THR  14           HB       THR  14  53.625  -9.914  -3.030
  102    HG1  THR  14           HG1      THR  14  54.501 -10.339  -1.095
  103   HG21  THR  14          HG21      THR  14  54.820 -11.470  -4.371
  104   HG22  THR  14          HG22      THR  14  56.369 -10.705  -4.014
  105   HG23  THR  14          HG23      THR  14  55.201  -9.890  -5.054
  106    H    ARG  15           HN       ARG  15  55.156  -5.869  -3.343
  107    HA   ARG  15           HA       ARG  15  52.866  -5.979  -5.263
  108    HE   ARG  15           HE       ARG  15  49.609  -7.241  -4.691
  109    HB2  ARG  15           HB2      ARG  15  52.954  -4.699  -2.717
  110    HB3  ARG  15           HB1      ARG  15  52.998  -3.423  -3.929
  111    HG2  ARG  15           HG2      ARG  15  50.684  -3.833  -3.550
  112    HG3  ARG  15           HG1      ARG  15  51.052  -4.652  -5.068
  113    HD2  ARG  15           HD2      ARG  15  51.565  -6.705  -3.502
  114    HD3  ARG  15           HD1      ARG  15  50.550  -5.834  -2.353
  115   HH11  ARG  15          HH21      ARG  15  49.181  -4.442  -2.724
  116   HH12  ARG  15          HH22      ARG  15  47.497  -4.276  -3.095
  117   HH21  ARG  15          HH11      ARG  15  47.412  -7.041  -5.186
  118   HH22  ARG  15          HH12      ARG  15  46.496  -5.747  -4.488
  119    H    VAL  16           HN       VAL  16  56.059  -5.489  -5.054
  120    HA   VAL  16           HA       VAL  16  56.487  -2.946  -6.294
  121    HB   VAL  16           HB       VAL  16  58.246  -5.339  -6.815
  122   HG11  VAL  16          HG11      VAL  16  58.978  -2.506  -6.054
  123   HG12  VAL  16          HG12      VAL  16  58.667  -2.975  -7.725
  124   HG13  VAL  16          HG13      VAL  16  59.992  -3.721  -6.832
  125   HG21  VAL  16          HG21      VAL  16  59.319  -4.724  -4.571
  126   HG22  VAL  16          HG22      VAL  16  57.783  -5.585  -4.483
  127   HG23  VAL  16          HG23      VAL  16  57.834  -3.843  -4.217
  128    H    MET  17           HN       MET  17  58.114  -4.541  -8.496
  129    HA   MET  17           HA       MET  17  56.003  -5.393 -10.324
  130    HB2  MET  17           HB2      MET  17  56.083  -2.774 -10.290
  131    HB3  MET  17           HB1      MET  17  57.562  -2.979 -11.228
  132    HG2  MET  17           HG2      MET  17  55.859  -2.814 -12.865
  133    HG3  MET  17           HG1      MET  17  56.167  -4.546 -12.735
  134    HE1  MET  17           HE1      MET  17  52.253  -3.423 -13.241
  135    HE2  MET  17           HE2      MET  17  53.760  -3.667 -14.120
  136    HE3  MET  17           HE3      MET  17  53.490  -2.160 -13.248
  137    H    GLY  18           HN       GLY  18  58.990  -5.709  -9.162
  138    HA2  GLY  18           HA2      GLY  18  60.497  -6.090 -11.639
  139    HA3  GLY  18           HA1      GLY  18  61.051  -6.503 -10.016
  140    H    GLY  19           HN       GLY  19  58.681  -7.579 -12.472
  141    HA2  GLY  19           HA2      GLY  19  58.191 -10.147 -11.374
  142    HA3  GLY  19           HA1      GLY  19  58.042  -9.753 -13.088
  143    HA   PRO  20           HA       PRO  20  61.336 -13.056 -12.611
  144    HB2  PRO  20           HB2      PRO  20  60.496 -13.189 -15.489
  145    HB3  PRO  20           HB1      PRO  20  60.859 -14.510 -14.359
  146    HG2  PRO  20           HG2      PRO  20  58.355 -13.872 -14.984
  147    HG3  PRO  20           HG1      PRO  20  58.796 -14.384 -13.346
  148    HD2  PRO  20           HD2      PRO  20  58.085 -11.663 -14.335
  149    HD3  PRO  20           HD1      PRO  20  57.885 -12.364 -12.714
  150    H1U  RCY  21           H1U      RCY  21  66.492  -3.477 -10.766
  151    H1S  RCY  21           H1S      RCY  21  65.135  -7.126 -12.497
  152    HB1  RCY  21           HB1      RCY  21  65.463  -8.849 -13.215
  153    HB2  RCY  21           HB2      RCY  21  65.196 -10.161 -12.068
  154    HA   RCY  21           HA       RCY  21  63.726  -9.701 -14.677
  155    HN1  RCY  21           HN1      RCY  21  62.838 -11.200 -12.364
  156    H    THR  22           HN       THR  22  66.013  -9.832 -15.483
  157    HA   THR  22           HA       THR  22  67.233 -12.528 -15.251
  158    HB   THR  22           HB       THR  22  65.690 -12.521 -17.240
  159    HG1  THR  22           HG1      THR  22  67.420 -13.873 -17.362
  160   HG21  THR  22          HG21      THR  22  67.654 -10.562 -18.437
  161   HG22  THR  22          HG22      THR  22  66.142 -10.041 -17.692
  162   HG23  THR  22          HG23      THR  22  66.111 -11.099 -19.102
  163    HA   PRO  23           HA       PRO  23  71.078 -10.374 -14.801
  164    HB2  PRO  23           HB2      PRO  23  71.945 -12.141 -17.071
  165    HB3  PRO  23           HB1      PRO  23  72.772 -11.792 -15.540
  166    HG2  PRO  23           HG2      PRO  23  71.401 -14.065 -15.950
  167    HG3  PRO  23           HG1      PRO  23  71.514 -13.292 -14.362
  168    HD2  PRO  23           HD2      PRO  23  69.176 -13.534 -16.137
  169    HD3  PRO  23           HD1      PRO  23  69.236 -13.126 -14.409
  170    H    ARG  24           HN       ARG  24  72.000  -8.540 -15.745
  171    HA   ARG  24           HA       ARG  24  71.975  -8.092 -18.617
  172    HE   ARG  24           HE       ARG  24  68.154  -6.158 -18.364
  173    HB2  ARG  24           HB2      ARG  24  70.502  -6.006 -18.397
  174    HB3  ARG  24           HB1      ARG  24  69.667  -7.558 -18.350
  175    HG2  ARG  24           HG2      ARG  24  69.201  -7.400 -16.089
  176    HG3  ARG  24           HG1      ARG  24  70.616  -6.399 -15.762
  177    HD2  ARG  24           HD2      ARG  24  68.282  -5.265 -15.683
  178    HD3  ARG  24           HD1      ARG  24  69.571  -4.444 -16.563
  179   HH11  ARG  24          HH21      ARG  24  67.852  -3.274 -16.499
  180   HH12  ARG  24          HH22      ARG  24  66.716  -2.537 -17.579
  181   HH21  ARG  24          HH11      ARG  24  66.673  -5.212 -19.785
  182   HH22  ARG  24          HH12      ARG  24  66.049  -3.634 -19.439
  183    H    LYS  25           HN       LYS  25  74.249  -7.873 -17.722
  184    HA   LYS  25           HA       LYS  25  74.796  -5.410 -16.197
  185    HB2  LYS  25           HB2      LYS  25  76.951  -7.037 -17.509
  186    HB3  LYS  25           HB1      LYS  25  76.964  -6.224 -15.944
  187    HG2  LYS  25           HG2      LYS  25  75.431  -8.744 -16.648
  188    HG3  LYS  25           HG1      LYS  25  76.836  -8.633 -15.588
  189    HD2  LYS  25           HD2      LYS  25  74.162  -7.284 -15.109
  190    HD3  LYS  25           HD1      LYS  25  74.744  -8.727 -14.278
  191    HE2  LYS  25           HE2      LYS  25  75.729  -5.895 -14.060
  192    HE3  LYS  25           HE1      LYS  25  75.339  -7.037 -12.774
  193    HZ1  LYS  25           HZ1      LYS  25  77.628  -7.049 -12.784
  194    HZ2  LYS  25           HZ2      LYS  25  77.740  -6.905 -14.473
  195    HZ3  LYS  25           HZ3      LYS  25  77.278  -8.382 -13.772
  196    H    GLY  26           HN       GLY  26  73.631  -5.471 -18.997
  197    HA2  GLY  26           HA2      GLY  26  75.442  -4.635 -20.967
  198    HA3  GLY  26           HA1      GLY  26  73.778  -4.058 -20.870
  199    HA   PRO  27           HA       PRO  27  74.589   0.035 -19.517
  200    HB2  PRO  27           HB2      PRO  27  74.169  -0.738 -16.650
  201    HB3  PRO  27           HB1      PRO  27  73.487   0.625 -17.558
  202    HG2  PRO  27           HG2      PRO  27  72.066  -1.576 -17.036
  203    HG3  PRO  27           HG1      PRO  27  71.868  -0.663 -18.541
  204    HD2  PRO  27           HD2      PRO  27  73.105  -3.323 -18.121
  205    HD3  PRO  27           HD1      PRO  27  72.415  -2.620 -19.600
  206    HA   PRO  28           HA       PRO  28  79.003   0.034 -18.743
  207    HB2  PRO  28           HB2      PRO  28  78.335   2.663 -17.459
  208    HB3  PRO  28           HB1      PRO  28  79.623   2.271 -18.615
  209    HG2  PRO  28           HG2      PRO  28  77.366   3.505 -19.362
  210    HG3  PRO  28           HG1      PRO  28  78.218   2.369 -20.420
  211    HD2  PRO  28           HD2      PRO  28  75.630   2.033 -19.029
  212    HD3  PRO  28           HD1      PRO  28  76.275   1.159 -20.435
  213    H    LYS  29           HN       LYS  29  80.151  -0.828 -17.044
  214    HA   LYS  29           HA       LYS  29  78.852  -1.153 -14.453
  215    HB2  LYS  29           HB2      LYS  29  80.857  -2.404 -13.839
  216    HB3  LYS  29           HB1      LYS  29  80.340  -2.896 -15.453
  217    HG2  LYS  29           HG2      LYS  29  81.963  -1.075 -16.314
  218    HG3  LYS  29           HG1      LYS  29  82.646  -1.108 -14.688
  219    HD2  LYS  29           HD2      LYS  29  82.410  -3.457 -16.590
  220    HD3  LYS  29           HD1      LYS  29  83.899  -2.647 -16.101
  221    HE2  LYS  29           HE2      LYS  29  83.210  -3.248 -13.686
  222    HE3  LYS  29           HE1      LYS  29  82.068  -4.367 -14.429
  223    HZ1  LYS  29           HZ1      LYS  29  83.942  -5.656 -14.152
  224    HZ2  LYS  29           HZ2      LYS  29  85.011  -4.389 -14.523
  225    HZ3  LYS  29           HZ3      LYS  29  84.115  -5.136 -15.757
  226    H1U  RCY  30           H1U      RCY  30  78.595   5.428  -6.447
  227    H1S  RCY  30           H1S      RCY  30  79.371   3.593  -9.948
  228    HB1  RCY  30           HB1      RCY  30  80.860   1.972 -11.905
  229    HB2  RCY  30           HB2      RCY  30  79.215   2.427 -12.351
  230    HA   RCY  30           HA       RCY  30  80.281   3.585 -14.394
  231    HN1  RCY  30           HN1      RCY  30  79.459   1.603 -15.339
  232    H    LYS  31           HN       LYS  31  82.114   2.715 -16.018
  233    HA   LYS  31           HA       LYS  31  84.557   1.680 -15.155
  234    HB2  LYS  31           HB2      LYS  31  84.395   4.043 -17.034
  235    HB3  LYS  31           HB1      LYS  31  85.550   2.709 -17.057
  236    HG2  LYS  31           HG2      LYS  31  83.568   1.165 -17.483
  237    HG3  LYS  31           HG1      LYS  31  82.608   2.619 -17.760
  238    HD2  LYS  31           HD2      LYS  31  85.195   2.078 -19.230
  239    HD3  LYS  31           HD1      LYS  31  83.628   1.550 -19.843
  240    HE2  LYS  31           HE2      LYS  31  83.918   3.648 -20.869
  241    HE3  LYS  31           HE1      LYS  31  82.904   4.022 -19.475
  242    HZ1  LYS  31           HZ1      LYS  31  85.746   4.073 -18.957
  243    HZ2  LYS  31           HZ2      LYS  31  84.534   5.169 -18.492
  244    HZ3  LYS  31           HZ3      LYS  31  85.213   5.258 -20.047
  245    H    GLN  32           HN       GLN  32  86.026   2.369 -13.667
  246    HA   GLN  32           HA       GLN  32  86.876   5.055 -13.327
  247    HB2  GLN  32           HB2      GLN  32  84.355   4.526 -12.102
  248    HB3  GLN  32           HB1      GLN  32  85.537   4.660 -10.803
  249    HG2  GLN  32           HG2      GLN  32  85.238   6.680 -13.045
  250    HG3  GLN  32           HG1      GLN  32  84.519   6.862 -11.444
  251   HE21  GLN  32          HE21      GLN  32  87.136   5.331 -10.490
  252   HE22  GLN  32          HE22      GLN  32  88.263   6.594 -10.366
  253    H    ARG  33           HN       ARG  33  86.459   1.848 -12.031
  254    HA   ARG  33           HA       ARG  33  89.082   2.141 -10.611
  255    HE   ARG  33           HE       ARG  33  86.301   0.716 -11.543
  256    HB2  ARG  33           HB2      ARG  33  87.257  -0.013  -9.685
  257    HB3  ARG  33           HB1      ARG  33  88.294   1.061  -8.752
  258    HG2  ARG  33           HG2      ARG  33  86.253   1.946  -8.149
  259    HG3  ARG  33           HG1      ARG  33  86.524   2.882  -9.619
  260    HD2  ARG  33           HD2      ARG  33  84.632   0.633  -9.125
  261    HD3  ARG  33           HD1      ARG  33  84.427   2.077 -10.116
  262   HH11  ARG  33          HH21      ARG  33  83.360  -0.220 -10.006
  263   HH12  ARG  33          HH22      ARG  33  83.016  -1.485 -11.138
  264   HH21  ARG  33          HH11      ARG  33  85.868  -0.930 -13.030
  265   HH22  ARG  33          HH12      ARG  33  84.436  -1.887 -12.850
  266    H    GLN  34           HN       GLN  34  90.614   0.614 -11.152
  267    HA   GLN  34           HA       GLN  34  90.446  -0.890 -13.504
  268    HB2  GLN  34           HB2      GLN  34  92.043  -1.887 -11.150
  269    HB3  GLN  34           HB1      GLN  34  92.460  -1.932 -12.863
  270    HG2  GLN  34           HG2      GLN  34  92.445   0.633 -12.774
  271    HG3  GLN  34           HG1      GLN  34  92.429   0.461 -11.019
  272   HE21  GLN  34          HE21      GLN  34  94.628   1.403 -10.918
  273   HE22  GLN  34          HE22      GLN  34  95.980   0.476 -11.360
  274    H    THR  35           HN       THR  35  90.418  -2.408 -10.280
  275    HA   THR  35           HA       THR  35  88.357  -4.325 -11.306
  276    HB   THR  35           HB       THR  35  89.480  -6.004  -9.741
  277    HG1  THR  35           HG1      THR  35  90.781  -3.975  -8.964
  278   HG21  THR  35          HG21      THR  35  91.184  -6.595 -11.391
  279   HG22  THR  35          HG22      THR  35  91.131  -4.964 -12.061
  280   HG23  THR  35          HG23      THR  35  89.733  -6.027 -12.216
  281    H    ARG  36           HN       ARG  36  89.904  -3.284  -8.240
  282    HA   ARG  36           HA       ARG  36  87.519  -2.228  -7.104
  283    HE   ARG  36           HE       ARG  36  84.004  -4.182  -3.966
  284    HB2  ARG  36           HB2      ARG  36  87.533  -5.062  -7.164
  285    HB3  ARG  36           HB1      ARG  36  87.881  -4.616  -5.496
  286    HG2  ARG  36           HG2      ARG  36  85.913  -3.009  -5.638
  287    HG3  ARG  36           HG1      ARG  36  85.502  -3.781  -7.170
  288    HD2  ARG  36           HD2      ARG  36  84.409  -5.367  -6.004
  289    HD3  ARG  36           HD1      ARG  36  85.966  -5.891  -5.361
  290   HH11  ARG  36          HH21      ARG  36  87.163  -5.543  -4.195
  291   HH12  ARG  36          HH22      ARG  36  87.530  -5.310  -2.519
  292   HH21  ARG  36          HH11      ARG  36  84.464  -3.871  -1.775
  293   HH22  ARG  36          HH12      ARG  36  86.002  -4.364  -1.148
  294    H    GLN  37           HN       GLN  37  90.600  -2.174  -7.251
  295    HA   GLN  37           HA       GLN  37  91.710  -2.574  -4.679
  296    HB2  GLN  37           HB2      GLN  37  93.120  -2.075  -6.606
  297    HB3  GLN  37           HB1      GLN  37  92.378  -0.484  -6.775
  298    HG2  GLN  37           HG2      GLN  37  94.589  -0.399  -5.609
  299    HG3  GLN  37           HG1      GLN  37  93.267   0.208  -4.611
  300   HE21  GLN  37          HE21      GLN  37  93.927  -3.241  -5.277
  301   HE22  GLN  37          HE22      GLN  37  94.288  -3.649  -3.669
  302    H1U  RCY  38           H1U      RCY  38  82.831   0.664  -2.742
  303    H1S  RCY  38           H1S      RCY  38  87.199   0.202  -0.765
  304    HB1  RCY  38           HB1      RCY  38  89.114  -0.430  -1.374
  305    HB2  RCY  38           HB2      RCY  38  88.788   0.053  -3.037
  306    HA   RCY  38           HA       RCY  38  90.912   1.522  -2.813
  307    HN1  RCY  38           HN1      RCY  38  91.938  -1.157  -2.874
  308    H    LYS  39           HN       LYS  39  89.785   0.445   0.015
  309    HA   LYS  39           HA       LYS  39  90.641   0.417   2.191
  310    HB2  LYS  39           HB2      LYS  39  91.662  -1.695   1.215
  311    HB3  LYS  39           HB1      LYS  39  93.120  -0.754   0.908
  312    HG2  LYS  39           HG2      LYS  39  93.560  -0.440   3.189
  313    HG3  LYS  39           HG1      LYS  39  91.888  -0.760   3.652
  314    HD2  LYS  39           HD2      LYS  39  93.565  -2.625   4.154
  315    HD3  LYS  39           HD1      LYS  39  92.122  -3.101   3.258
  316    HE2  LYS  39           HE2      LYS  39  93.281  -3.340   1.251
  317    HE3  LYS  39           HE1      LYS  39  94.565  -2.236   1.744
  318    HZ1  LYS  39           HZ1      LYS  39  95.563  -4.285   1.940
  319    HZ2  LYS  39           HZ2      LYS  39  94.152  -5.053   2.491
  320    HZ3  LYS  39           HZ3      LYS  39  95.020  -4.023   3.525
  321    H    SER  40           HN       SER  40  91.211   2.307   3.146
  322    HA   SER  40           HA       SER  40  93.817   3.537   2.429
  323    HG   SER  40           HG       SER  40  90.810   5.744   3.134
  324    HB2  SER  40           HB2      SER  40  92.739   5.789   2.299
  325    HB3  SER  40           HB1      SER  40  92.237   4.711   0.999
  326    H    LYS  41           HN       LYS  41  91.541   5.469   4.146
  327    HA   LYS  41           HA       LYS  41  93.183   5.338   6.542
  328    HB2  LYS  41           HB2      LYS  41  91.212   6.819   7.432
  329    HB3  LYS  41           HB1      LYS  41  92.282   7.473   6.194
  330    HG2  LYS  41           HG2      LYS  41  89.987   5.919   5.160
  331    HG3  LYS  41           HG1      LYS  41  89.561   7.426   5.973
  332    HD2  LYS  41           HD2      LYS  41  91.031   8.694   4.520
  333    HD3  LYS  41           HD1      LYS  41  91.651   7.214   3.788
  334    HE2  LYS  41           HE2      LYS  41  90.003   8.126   2.280
  335    HE3  LYS  41           HE1      LYS  41  89.294   6.700   3.038
  336    HZ1  LYS  41           HZ1      LYS  41  87.851   7.935   4.242
  337    HZ2  LYS  41           HZ2      LYS  41  88.044   9.009   2.940
  338    HZ3  LYS  41           HZ3      LYS  41  88.904   9.258   4.384
  339    HA   PRO  42           HA       PRO  42  90.935   2.259   8.786
  340    HB2  PRO  42           HB2      PRO  42  90.963   3.785  11.286
  341    HB3  PRO  42           HB1      PRO  42  91.902   2.348  10.850
  342    HG2  PRO  42           HG2      PRO  42  92.976   4.822  11.161
  343    HG3  PRO  42           HG1      PRO  42  93.668   3.568  10.122
  344    HD2  PRO  42           HD2      PRO  42  92.072   5.985   9.351
  345    HD3  PRO  42           HD1      PRO  42  93.423   5.204   8.495
  346    HA   PRO  43           HA       PRO  43  86.695   3.442   9.387
  347    HB2  PRO  43           HB2      PRO  43  85.789   1.722  11.268
  348    HB3  PRO  43           HB1      PRO  43  86.323   1.166   9.669
  349    HG2  PRO  43           HG2      PRO  43  87.745   1.056  12.275
  350    HG3  PRO  43           HG1      PRO  43  87.715  -0.121  10.952
  351    HD2  PRO  43           HD2      PRO  43  89.774   1.703  11.409
  352    HD3  PRO  43           HD1      PRO  43  89.464   0.887   9.861
  353    H    LYS  44           HN       LYS  44  85.528   5.006  10.483
  354    HA   LYS  44           HA       LYS  44  86.611   5.938  13.090
  355    HB2  LYS  44           HB2      LYS  44  84.778   7.156  11.019
  356    HB3  LYS  44           HB1      LYS  44  84.927   7.851  12.630
  357    HG2  LYS  44           HG2      LYS  44  87.570   7.408  11.839
  358    HG3  LYS  44           HG1      LYS  44  86.778   8.008  10.381
  359    HD2  LYS  44           HD2      LYS  44  87.555   9.938  11.577
  360    HD3  LYS  44           HD1      LYS  44  85.808   9.872  11.810
  361    HE2  LYS  44           HE2      LYS  44  87.394  10.246  13.883
  362    HE3  LYS  44           HE1      LYS  44  85.993   9.184  14.028
  363    HZ1  LYS  44           HZ1      LYS  44  87.285   7.312  13.966
  364    HZ2  LYS  44           HZ2      LYS  44  88.328   8.377  14.781
  365    HZ3  LYS  44           HZ3      LYS  44  88.553   8.064  13.127
  366    H    LYS  45           HN       LYS  45  83.304   6.647  12.380
  367    HA   LYS  45           HA       LYS  45  82.138   4.388  13.758
  368    HB2  LYS  45           HB2      LYS  45  83.193   5.418  15.706
  369    HB3  LYS  45           HB1      LYS  45  82.460   6.973  15.311
  370    HG2  LYS  45           HG2      LYS  45  80.256   6.151  15.745
  371    HG3  LYS  45           HG1      LYS  45  80.820   4.481  15.813
  372    HD2  LYS  45           HD2      LYS  45  81.869   4.788  17.895
  373    HD3  LYS  45           HD1      LYS  45  81.905   6.543  17.722
  374    HE2  LYS  45           HE2      LYS  45  79.318   4.989  17.912
  375    HE3  LYS  45           HE1      LYS  45  80.150   5.618  19.334
  376    HZ1  LYS  45           HZ1      LYS  45  79.585   7.716  18.844
  377    HZ2  LYS  45           HZ2      LYS  45  78.362   6.999  17.907
  378    HZ3  LYS  45           HZ3      LYS  45  79.806   7.512  17.175
  379    H    GLY  46           HN       GLY  46  80.745   4.591  11.897
  380    HA2  GLY  46           HA2      GLY  46  78.728   5.236  10.891
  381    HA3  GLY  46           HA1      GLY  46  78.357   6.096  12.383
  382    H    VAL  47           HN       VAL  47  79.890   8.165  12.610
  383    HA   VAL  47           HA       VAL  47  79.098  10.167  10.955
  384    HB   VAL  47           HB       VAL  47  80.665  10.347  12.954
  385   HG11  VAL  47          HG11      VAL  47  82.995  10.127  12.651
  386   HG12  VAL  47          HG12      VAL  47  82.860  10.167  10.893
  387   HG13  VAL  47          HG13      VAL  47  82.335   8.739  11.786
  388   HG21  VAL  47          HG21      VAL  47  80.073  12.337  11.721
  389   HG22  VAL  47          HG22      VAL  47  81.188  11.924  10.418
  390   HG23  VAL  47          HG23      VAL  47  81.814  12.392  12.000
  391    H    GLN  48           HN       GLN  48  79.207  10.559   8.811
  392    HA   GLN  48           HA       GLN  48  80.446   8.900   6.921
  393    HB2  GLN  48           HB2      GLN  48  80.195  10.799   5.335
  394    HB3  GLN  48           HB1      GLN  48  78.742  10.542   6.298
  395    HG2  GLN  48           HG2      GLN  48  78.894  12.763   6.762
  396    HG3  GLN  48           HG1      GLN  48  80.167  12.282   7.884
  397   HE21  GLN  48          HE21      GLN  48  80.053  12.604   4.284
  398   HE22  GLN  48          HE22      GLN  48  81.435  13.586   4.186
  399    H    GLY  49           HN       GLY  49  82.549   8.586   6.391
  400    HA2  GLY  49           HA2      GLY  49  84.584  10.414   7.520
  401    HA3  GLY  49           HA1      GLY  49  84.901   8.832   6.808
  402    H1U  RCY  50           H1U      RCY  50  87.041   5.242   0.439
  403    H1S  RCY  50           H1S      RCY  50  84.160   8.756  -0.979
  404    HB1  RCY  50           HB1      RCY  50  82.445  10.117   2.071
  405    HB2  RCY  50           HB2      RCY  50  83.722   8.907   1.949
  406    HA   RCY  50           HA       RCY  50  85.349  10.602   2.798
  407    HN1  RCY  50           HN1      RCY  50  83.269   9.417   4.409
  408    H    GLY  51           HN       GLY  51  82.404  11.861   1.745
  409    HA2  GLY  51           HA2      GLY  51  82.636  14.408   3.215
  410    HA3  GLY  51           HA1      GLY  51  82.992  14.483   1.489
  411    H    ASP  52           HN       ASP  52  80.651  12.163   2.570
  412    HA   ASP  52           HA       ASP  52  78.575  13.523   1.005
  413    HB2  ASP  52           HB2      ASP  52  78.400  10.996   2.675
  414    HB3  ASP  52           HB1      ASP  52  77.225  11.538   1.477
  415    H    ASP  53           HN       ASP  53  76.253  13.292   2.242
  416    HA   ASP  53           HA       ASP  53  76.231  13.869   5.059
  417    HB2  ASP  53           HB2      ASP  53  77.254  15.974   4.458
  418    HB3  ASP  53           HB1      ASP  53  76.089  16.225   3.158
  419    H    ILE  54           HN       ILE  54  74.658  14.192   1.912
  420    HA   ILE  54           HA       ILE  54  72.044  13.618   3.260
  421    HB   ILE  54           HB       ILE  54  72.241  15.169   0.682
  422   HG12  ILE  54          HG12      ILE  54  71.818  17.126   2.500
  423   HG13  ILE  54          HG11      ILE  54  72.870  16.073   3.447
  424   HG21  ILE  54          HG21      ILE  54  70.037  15.888   1.264
  425   HG22  ILE  54          HG22      ILE  54  70.212  15.311   2.922
  426   HG23  ILE  54          HG23      ILE  54  70.080  14.156   1.595
  427   HD11  ILE  54          HD11      ILE  54  74.309  17.594   2.276
  428   HD12  ILE  54          HD12      ILE  54  73.458  17.326   0.755
  429   HD13  ILE  54          HD13      ILE  54  74.445  16.041   1.452
  430    HA   PRO  55           HA       PRO  55  72.878  10.401   0.054
  431    HB2  PRO  55           HB2      PRO  55  72.647   8.222   1.636
  432    HB3  PRO  55           HB1      PRO  55  74.140   9.180   1.573
  433    HG2  PRO  55           HG2      PRO  55  72.016   9.130   3.644
  434    HG3  PRO  55           HG1      PRO  55  73.765   9.332   3.821
  435    HD2  PRO  55           HD2      PRO  55  71.880  11.409   3.857
  436    HD3  PRO  55           HD1      PRO  55  73.629  11.607   3.613
  437    H    GLY  56           HN       GLY  56  71.365   8.838  -0.871
  438    HA2  GLY  56           HA2      GLY  56  69.242   7.878  -1.251
  439    HA3  GLY  56           HA1      GLY  56  68.760   8.407   0.362
  440    H    MET  57           HN       MET  57  70.123  10.717  -1.866
  441    HA   MET  57           HA       MET  57  67.498  12.113  -1.929
  442    HB2  MET  57           HB2      MET  57  70.358  12.937  -2.263
  443    HB3  MET  57           HB1      MET  57  69.119  13.898  -3.071
  444    HG2  MET  57           HG2      MET  57  68.887  13.156  -0.153
  445    HG3  MET  57           HG1      MET  57  69.763  14.596  -0.674
  446    HE1  MET  57           HE1      MET  57  67.790  16.268   0.758
  447    HE2  MET  57           HE2      MET  57  67.719  14.585   1.275
  448    HE3  MET  57           HE3      MET  57  66.230  15.445   0.888
  449    H    GLU  58           HN       GLU  58  69.654  10.315  -3.964
  450    HA   GLU  58           HA       GLU  58  67.745  10.276  -6.124
  451    HB2  GLU  58           HB2      GLU  58  68.864  12.601  -6.296
  452    HB3  GLU  58           HB1      GLU  58  70.303  11.723  -6.816
  453    HG2  GLU  58           HG2      GLU  58  68.991  10.663  -8.629
  454    HG3  GLU  58           HG1      GLU  58  67.569  11.576  -8.123
  455    H    GLY  59           HN       GLY  59  68.915   8.182  -4.821
  456    HA2  GLY  59           HA2      GLY  59  71.289   7.276  -6.299
  457    HA3  GLY  59           HA1      GLY  59  70.434   6.363  -5.054
  458    H1U  RCY  60           H1U      RCY  60  72.294   1.493  -4.209
  459    H1S  RCY  60           H1S      RCY  60  71.168   1.901  -8.062
  460    HB1  RCY  60           HB1      RCY  60  67.469   2.618  -7.912
  461    HB2  RCY  60           HB2      RCY  60  68.715   3.048  -6.741
  462    HA   RCY  60           HA       RCY  60  67.843   5.190  -8.624
  463    HN1  RCY  60           HN1      RCY  60  68.222   5.552  -5.716
  464    H    GLY  61           HN       GLY  61  66.532   6.234  -5.984
  465    HA2  GLY  61           HA2      GLY  61  63.838   5.963  -6.737
  466    HA3  GLY  61           HA1      GLY  61  64.155   4.668  -5.579
  467    H    THR  62           HN       THR  62  66.303   6.667  -4.492
  468    HA   THR  62           HA       THR  62  66.412   8.326  -2.838
  469    HB   THR  62           HB       THR  62  63.508   8.990  -3.170
  470    HG1  THR  62           HG1      THR  62  63.849   9.047  -5.247
  471   HG21  THR  62          HG21      THR  62  64.396  11.276  -2.944
  472   HG22  THR  62          HG22      THR  62  66.042  10.642  -2.947
  473   HG23  THR  62          HG23      THR  62  64.950  10.256  -1.616
  474    H    ASP  63           HN       ASP  63  63.297   6.572  -2.827
  475    HA   ASP  63           HA       ASP  63  62.982   6.649   0.026
  476    HB2  ASP  63           HB2      ASP  63  61.911   4.670  -2.011
  477    HB3  ASP  63           HB1      ASP  63  61.354   4.805  -0.343
  478    H    ILE  64           HN       ILE  64  64.999   6.016   0.963
  479    HA   ILE  64           HA       ILE  64  66.583   4.482   1.779
  480    HB   ILE  64           HB       ILE  64  64.070   2.916   1.354
  481   HG12  ILE  64          HG12      ILE  64  64.474   2.399   3.752
  482   HG13  ILE  64          HG11      ILE  64  66.011   3.260   3.664
  483   HG21  ILE  64          HG21      ILE  64  66.791   1.651   1.780
  484   HG22  ILE  64          HG22      ILE  64  65.660   1.327   0.467
  485   HG23  ILE  64          HG23      ILE  64  65.268   0.827   2.112
  486   HD11  ILE  64          HD11      ILE  64  64.869   5.339   3.116
  487   HD12  ILE  64          HD12      ILE  64  64.160   4.668   4.585
  488   HD13  ILE  64          HD13      ILE  64  63.317   4.504   3.044
  489    H    THR  65           HN       THR  65  65.777   4.789  -1.359
  490    HA   THR  65           HA       THR  65  66.585   3.880  -3.371
  491    HB   THR  65           HB       THR  65  69.060   3.810  -1.621
  492    HG1  THR  65           HG1      THR  65  68.486   5.707  -3.598
  493   HG21  THR  65          HG21      THR  65  69.897   4.230  -4.201
  494   HG22  THR  65          HG22      THR  65  68.580   3.080  -4.433
  495   HG23  THR  65          HG23      THR  65  69.932   2.670  -3.378
  496    H    VAL  66           HN       VAL  66  65.176   1.979  -2.109
  497    HA   VAL  66           HA       VAL  66  64.842  -0.333  -2.180
  498    HB   VAL  66           HB       VAL  66  67.628  -0.698  -3.272
  499   HG11  VAL  66          HG11      VAL  66  66.246  -2.685  -2.762
  500   HG12  VAL  66          HG12      VAL  66  66.518  -2.526  -4.497
  501   HG13  VAL  66          HG13      VAL  66  64.967  -2.057  -3.801
  502   HG21  VAL  66          HG21      VAL  66  65.256   0.611  -4.555
  503   HG22  VAL  66          HG22      VAL  66  66.273  -0.440  -5.541
  504   HG23  VAL  66          HG23      VAL  66  66.971   0.973  -4.748
  505    H    ILE  67           HN       ILE  67  68.348   0.065  -1.498
  506    HA   ILE  67           HA       ILE  67  67.828  -1.117   1.194
  507    HB   ILE  67           HB       ILE  67  69.968  -1.988  -0.768
  508   HG12  ILE  67          HG12      ILE  67  67.489  -2.872  -0.789
  509   HG13  ILE  67          HG11      ILE  67  68.822  -4.023  -0.891
  510   HG21  ILE  67          HG21      ILE  67  69.588  -2.515   2.182
  511   HG22  ILE  67          HG22      ILE  67  71.041  -1.960   1.350
  512   HG23  ILE  67          HG23      ILE  67  70.491  -3.624   1.150
  513   HD11  ILE  67          HD11      ILE  67  68.576  -4.708   1.330
  514   HD12  ILE  67          HD12      ILE  67  66.901  -4.435   0.850
  515   HD13  ILE  67          HD13      ILE  67  67.755  -3.220   1.801
  516    H1U  RCY  68           H1U      RCY  68  74.960   1.580   0.126
  517    H1S  RCY  68           H1S      RCY  68  70.970   4.069  -0.536
  518    HB1  RCY  68           HB1      RCY  68  69.973   3.895   3.304
  519    HB2  RCY  68           HB2      RCY  68  68.414   3.117   3.051
  520    HA   RCY  68           HA       RCY  68  70.988   1.951   1.963
  521    HN1  RCY  68           HN1      RCY  68  68.286   0.727   2.383
  522    HA   PRO  69           HA       PRO  69  72.389   0.369   5.828
  523    HB2  PRO  69           HB2      PRO  69  73.259   2.806   7.014
  524    HB3  PRO  69           HB1      PRO  69  74.241   1.669   6.075
  525    HG2  PRO  69           HG2      PRO  69  72.977   4.199   5.241
  526    HG3  PRO  69           HG1      PRO  69  74.442   3.408   4.637
  527    HD2  PRO  69           HD2      PRO  69  72.132   3.429   3.210
  528    HD3  PRO  69           HD1      PRO  69  73.262   2.055   3.150
  529    H    TRP  70           HN       TRP  70  69.877   2.629   5.594
  530    HA   TRP  70           HA       TRP  70  69.324   2.862   8.457
  531    HD1  TRP  70           HD1      TRP  70  70.793   4.248   7.458
  532    HE1  TRP  70           HE1      TRP  70  71.507   6.689   7.042
  533    HE3  TRP  70           HE3      TRP  70  66.306   6.254   6.077
  534    HZ2  TRP  70           HZ2      TRP  70  70.328   9.170   6.230
  535    HZ3  TRP  70           HZ3      TRP  70  66.129   8.652   5.489
  536    HH2  TRP  70           HH2      TRP  70  68.129  10.112   5.563
  537    HB2  TRP  70           HB2      TRP  70  67.605   3.495   6.037
  538    HB3  TRP  70           HB1      TRP  70  67.206   3.917   7.700
  539    H    GLU  71           HN       GLU  71  68.398   0.756   5.806
  540    HA   GLU  71           HA       GLU  71  66.364  -0.593   7.502
  541    HB2  GLU  71           HB2      GLU  71  67.127  -0.724   4.589
  542    HB3  GLU  71           HB1      GLU  71  66.204  -2.038   5.317
  543    HG2  GLU  71           HG2      GLU  71  65.332   0.817   5.704
  544    HG3  GLU  71           HG1      GLU  71  64.906  -0.049   4.227
  545    H    ALA  72           HN       ALA  72  69.370  -1.338   5.726
  546    HA   ALA  72           HA       ALA  72  69.535  -4.014   6.865
  547    HB1  ALA  72           HB1      ALA  72  71.815  -2.484   5.604
  548    HB2  ALA  72           HB2      ALA  72  70.538  -3.214   4.631
  549    HB3  ALA  72           HB3      ALA  72  71.564  -4.229   5.646
  550    H1U  RCY  73           H1U      RCY  73  73.151  -2.652   2.997
  551    H1S  RCY  73           H1S      RCY  73  72.347  -5.092   6.528
  552    HB1  RCY  73           HB1      RCY  73  73.680  -4.743  10.329
  553    HB2  RCY  73           HB2      RCY  73  74.893  -3.611   9.732
  554    HA   RCY  73           HA       RCY  73  72.211  -3.023  10.224
  555    HN1  RCY  73           HN1      RCY  73  72.428  -3.846   7.424
  556    H    ASN  74           HN       ASN  74  72.171  -0.794  10.445
  557    HA   ASN  74           HA       ASN  74  73.418   1.136   8.847
  558    HB2  ASN  74           HB2      ASN  74  73.260   1.323  11.867
  559    HB3  ASN  74           HB1      ASN  74  73.218   2.648  10.703
  560   HD21  ASN  74          HD21      ASN  74  71.385  -0.401  11.364
  561   HD22  ASN  74          HD22      ASN  74  69.863   0.277  11.037
  562    H    HIS  75           HN       HIS  75  74.774  -0.532  11.701
  563    HA   HIS  75           HA       HIS  75  77.288   0.683  11.816
  564    HD1  HIS  75           HD1      HIS  75  77.384   0.606  14.528
  565    HD2  HIS  75           HD2      HIS  75  79.874  -2.337  12.935
  566    HE1  HIS  75           HE1      HIS  75  79.588   0.790  15.762
  567    HE2  HIS  75           HE2      HIS  75  81.113  -0.996  14.802
  568    HB2  HIS  75           HB2      HIS  75  76.159  -1.398  13.119
  569    HB3  HIS  75           HB1      HIS  75  77.242  -2.295  12.056
  570    H1U  RCY  76           H1U      RCY  76  75.301   3.425   4.433
  571    H1S  RCY  76           H1S      RCY  76  78.151   3.242   8.105
  572    HB1  RCY  76           HB1      RCY  76  78.294   0.265   7.589
  573    HB2  RCY  76           HB2      RCY  76  79.854  -0.084   6.846
  574    HA   RCY  76           HA       RCY  76  79.383  -1.754   8.565
  575    HN1  RCY  76           HN1      RCY  76  79.361   0.079  10.836
  576    H    GLU  77           HN       GLU  77  81.017  -2.207  10.501
  577    HA   GLU  77           HA       GLU  77  83.417  -0.612  10.621
  578    HB2  GLU  77           HB2      GLU  77  82.675  -3.399  11.488
  579    HB3  GLU  77           HB1      GLU  77  84.363  -2.888  11.536
  580    HG2  GLU  77           HG2      GLU  77  83.740  -0.950  12.933
  581    HG3  GLU  77           HG1      GLU  77  82.052  -1.462  12.890
  582    H    LEU  78           HN       LEU  78  85.175  -0.640   9.268
  583    HA   LEU  78           HA       LEU  78  84.983  -2.071   6.764
  584    HG   LEU  78           HG       LEU  78  87.445   0.085   5.352
  585    HB2  LEU  78           HB2      LEU  78  86.273   0.194   7.544
  586    HB3  LEU  78           HB1      LEU  78  87.617  -0.943   7.575
  587   HD11  LEU  78          HD11      LEU  78  86.446  -2.779   5.293
  588   HD12  LEU  78          HD12      LEU  78  88.125  -2.313   5.569
  589   HD13  LEU  78          HD13      LEU  78  87.354  -1.957   4.024
  590   HD21  LEU  78          HD21      LEU  78  85.477   0.342   4.225
  591   HD22  LEU  78          HD22      LEU  78  84.749   0.118   5.815
  592   HD23  LEU  78          HD23      LEU  78  84.883  -1.247   4.707
  593    H    HIS  79           HN       HIS  79  84.902  -3.966   8.820
  594    HA   HIS  79           HA       HIS  79  86.684  -5.942   7.991
  595    HD1  HIS  79           HD1      HIS  79  90.077  -3.393   8.776
  596    HD2  HIS  79           HD2      HIS  79  88.656  -7.074   7.423
  597    HE1  HIS  79           HE1      HIS  79  91.628  -4.116   6.909
  598    HE2  HIS  79           HE2      HIS  79  90.774  -6.356   6.076
  599    HB2  HIS  79           HB2      HIS  79  87.912  -4.016   9.874
  600    HB3  HIS  79           HB1      HIS  79  88.117  -5.705  10.330
  601    H    GLU  80           HN       GLU  80  84.339  -6.602   8.512
  602    HA   GLU  80           HA       GLU  80  84.332  -8.263  10.853
  603    HB2  GLU  80           HB2      GLU  80  83.950  -6.271  12.124
  604    HB3  GLU  80           HB1      GLU  80  82.769  -5.675  10.958
  605    HG2  GLU  80           HG2      GLU  80  82.278  -8.323  12.276
  606    HG3  GLU  80           HG1      GLU  80  81.964  -6.849  13.193
  607    H    LEU  81           HN       LEU  81  82.014  -6.395   8.859
  608    HA   LEU  81           HA       LEU  81  80.239  -8.723   8.665
  609    HG   LEU  81           HG       LEU  81  81.392  -5.701   7.269
  610    HB2  LEU  81           HB2      LEU  81  78.857  -7.210   7.253
  611    HB3  LEU  81           HB1      LEU  81  79.259  -6.493   8.813
  612   HD11  LEU  81          HD11      LEU  81  78.941  -5.352   5.533
  613   HD12  LEU  81          HD12      LEU  81  80.081  -6.676   5.291
  614   HD13  LEU  81          HD13      LEU  81  80.621  -5.006   5.124
  615   HD21  LEU  81          HD21      LEU  81  80.021  -3.511   7.092
  616   HD22  LEU  81          HD22      LEU  81  80.320  -4.154   8.707
  617   HD23  LEU  81          HD23      LEU  81  78.752  -4.397   7.937
  618    H    ALA  82           HN       ALA  82  82.447  -6.943   6.523
  619    HA   ALA  82           HA       ALA  82  81.773  -8.411   4.146
  620    HB1  ALA  82           HB1      ALA  82  83.719  -7.413   3.176
  621    HB2  ALA  82           HB2      ALA  82  84.470  -7.180   4.755
  622    HB3  ALA  82           HB3      ALA  82  83.069  -6.212   4.293
  623    H    GLN  83           HN       GLN  83  84.049  -9.499   3.133
  624    HA   GLN  83           HA       GLN  83  85.533 -11.319   3.253
  625    HB2  GLN  83           HB2      GLN  83  85.954 -10.264   5.630
  626    HB3  GLN  83           HB1      GLN  83  85.006 -11.639   6.196
  627    HG2  GLN  83           HG2      GLN  83  86.579 -13.076   4.727
  628    HG3  GLN  83           HG1      GLN  83  87.627 -11.657   4.702
  629   HE21  GLN  83          HE21      GLN  83  86.087 -14.013   6.911
  630   HE22  GLN  83          HE22      GLN  83  87.170 -13.760   8.193
  631    H    TYR  84           HN       TYR  84  82.969 -11.818   2.416
  632    HA   TYR  84           HA       TYR  84  82.692 -14.611   3.026
  633    HD1  TYR  84           HD1      TYR  84  79.276 -15.280   2.991
  634    HD2  TYR  84           HD2      TYR  84  82.168 -15.257   6.168
  635    HE1  TYR  84           HE1      TYR  84  78.662 -17.613   3.568
  636    HE2  TYR  84           HE2      TYR  84  81.553 -17.589   6.745
  637    HH   TYR  84           HH       TYR  84  80.348 -19.636   5.079
  638    HB2  TYR  84           HB2      TYR  84  81.614 -13.232   5.040
  639    HB3  TYR  84           HB1      TYR  84  80.244 -13.146   3.931
  640    H    GLY  85           HN       GLY  85  80.864 -11.729   1.901
  641    HA2  GLY  85           HA2      GLY  85  80.504 -13.007  -0.700
  642    HA3  GLY  85           HA1      GLY  85  79.009 -12.901   0.228
  643    H    ILE  86           HN       ILE  86  80.308 -10.314   1.431
  644    HA   ILE  86           HA       ILE  86  80.082  -8.018   0.997
  645    HB   ILE  86           HB       ILE  86  80.536  -8.775  -1.901
  646   HG12  ILE  86          HG12      ILE  86  82.615  -8.252   0.247
  647   HG13  ILE  86          HG11      ILE  86  82.211  -9.851  -0.378
  648   HG21  ILE  86          HG21      ILE  86  81.526  -6.547  -2.032
  649   HG22  ILE  86          HG22      ILE  86  81.294  -6.312  -0.299
  650   HG23  ILE  86          HG23      ILE  86  79.897  -6.418  -1.370
  651   HD11  ILE  86          HD11      ILE  86  83.211  -7.536  -2.062
  652   HD12  ILE  86          HD12      ILE  86  82.878  -9.171  -2.633
  653   HD13  ILE  86          HD13      ILE  86  84.205  -8.883  -1.508
  654    H1U  RCY  87           H1U      RCY  87  77.296  -0.985   3.052
  655    H1S  RCY  87           H1S      RCY  87  75.643  -3.325  -0.881
  656    HB1  RCY  87           HB1      RCY  87  76.604  -5.328   0.863
  657    HB2  RCY  87           HB2      RCY  87  75.385  -6.362   1.605
  658    HA   RCY  87           HA       RCY  87  75.729  -8.093   0.095
  659    HN1  RCY  87           HN1      RCY  87  78.146  -6.987   1.027