*HEADER    METAL BINDING PROTEIN                   21-JUN-07   2JR7              
*TITLE     SOLUTION STRUCTURE OF HUMAN DESR1                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DPH3 HOMOLOG;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: CSL-TYPE ZINC FINGER-CONTAINING PROTEIN 2, DELGEF-          
*COMPND   5 INTERACTING PROTEIN 1, DELGIP1;                                      
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: DPH3, DESR1, ZCSL2;                                            
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)GOLD;                             
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET22B (+)                                 
*KEYWDS    DESR1, CSL ZINC FINGER, METAL BINDING PROTEIN                         
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    F.WU, J.WU, Y.SHI                                                     
*REVDAT   1   29-MAR-17 2JR7    0                                                


!NOE
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assign (resid 24 and name hb# ) (resid 32 and name he#) 1.8 0.0 3.2
assign (resid 25 and name hd1 ) (resid 24 and name hd#) 1.8 0.0 3.2
assign (resid 25 and name hd2 ) (resid 24 and name hd#) 1.8 0.0 3.2
assign (resid 25 and name hd# ) (resid 24 and name hd#) 1.8 0.0 2.7
assign (resid 25 and name hd1 ) (resid 24 and name he#) 1.8 0.0 3.7
assign (resid 25 and name hd2 ) (resid 24 and name he#) 1.8 0.0 3.7
assign (resid 25 and name hd# ) (resid 24 and name he#) 1.8 0.0 2.7
assign (resid 25 and name hg1 ) (resid 24 and name hd#) 1.8 0.0 4.2
assign (resid 25 and name hg2 ) (resid 24 and name hd#) 1.8 0.0 4.2
assign (resid 26 and name hn ) (resid 32 and name hd#) 1.8 0.0 3.2
assign (resid 26 and name ha ) (resid 32 and name he#) 1.8 0.0 3.2
assign (resid 26 and name hb1 ) (resid 32 and name he#) 1.8 0.0 4.2
assign (resid 26 and name hb2 ) (resid 32 and name he#) 1.8 0.0 4.2
assign (resid 26 and name hb# ) (resid 32 and name he#) 1.8 0.0 3.2
assign (resid 27 and name hd# ) (resid 32 and name hd#) 1.8 0.0 4.2
assign (resid 31 and name hn ) (resid 23 and name hd#) 1.8 0.0 4.2
assign (resid 31 and name ha ) (resid 23 and name hd#) 1.8 0.0 4.2
assign (resid 32 and name hn ) (resid 32 and name hd#) 1.8 0.0 1.7
assign (resid 32 and name ha ) (resid 32 and name hd#) 1.8 0.0 2.2
assign (resid 33 and name hn ) (resid 32 and name hd#) 1.8 0.0 3.2
assign (resid 33 and name ha ) (resid 13 and name hd#) 1.8 0.0 3.7
assign (resid 33 and name ha ) (resid 13 and name he#) 1.8 0.0 3.2
assign (resid 33 and name ha ) (resid 23 and name hd#) 1.8 0.0 2.7
assign (resid 34 and name hn ) (resid 13 and name hd#) 1.8 0.0 3.7
assign (resid 34 and name hg2# ) (resid 22 and name hd#) 1.8 0.0 2.2
assign (resid 34 and name hg2# ) (resid 22 and name he#) 1.8 0.0 4.2
assign (resid 34 and name hg2# ) (resid 13 and name hd#) 1.8 0.0 2.7
assign (resid 34 and name hg2# ) (resid 13 and name he#) 1.8 0.0 2.2
assign (resid 36 and name hn ) (resid 22 and name he#) 1.8 0.0 3.2
assign (resid 36 and name ha ) (resid 22 and name hd#) 1.8 0.0 2.7
assign (resid 36 and name ha ) (resid 22 and name he#) 1.8 0.0 1.2
assign (resid 36 and name ha ) (resid 64 and name he#) 1.8 0.0 3.2
assign (resid 36 and name hb1 ) (resid 15 and name he#) 1.8 0.0 3.2
assign (resid 36 and name hb2 ) (resid 15 and name he#) 1.8 0.0 3.2
assign (resid 36 and name hb# ) (resid 15 and name he#) 1.8 0.0 2.2
assign (resid 36 and name hb1 ) (resid 22 and name he#) 1.8 0.0 3.2
assign (resid 36 and name hb2 ) (resid 22 and name he#) 1.8 0.0 3.2
assign (resid 36 and name hb# ) (resid 22 and name he#) 1.8 0.0 2.7
assign (resid 36 and name hd1 ) (resid 15 and name he#) 1.8 0.0 4.2
assign (resid 36 and name hd2 ) (resid 15 and name he#) 1.8 0.0 4.2
assign (resid 36 and name hd1 ) (resid 22 and name he#) 1.8 0.0 4.2
assign (resid 36 and name hd2 ) (resid 22 and name he#) 1.8 0.0 4.2
assign (resid 36 and name he# ) (resid 15 and name he#) 1.8 0.0 4.2
assign (resid 36 and name he# ) (resid 22 and name he#) 1.8 0.0 4.2
assign (resid 37 and name hn ) (resid 22 and name he#) 1.8 0.0 4.2
assign (resid 39 and name hn ) (resid 22 and name he#) 1.8 0.0 4.2
assign (resid 39 and name ha ) (resid 59 and name he#) 1.8 0.0 2.7
assign (resid 39 and name hb1 ) (resid 59 and name he#) 1.8 0.0 4.2
assign (resid 39 and name hb2 ) (resid 59 and name he#) 1.8 0.0 4.2
assign (resid 39 and name hb# ) (resid 59 and name he#) 1.8 0.0 3.2
assign (resid 39 and name hb1 ) (resid 64 and name he#) 1.8 0.0 2.7
assign (resid 39 and name hb2 ) (resid 64 and name he#) 1.8 0.0 2.7
assign (resid 39 and name hd* ) (resid 59 and name he#) 1.8 0.0 1.2
assign (resid 39 and name hd* ) (resid 64 and name he#) 1.8 0.0 3.2
assign (resid 40 and name hn ) (resid 64 and name he#) 1.8 0.0 2.7
assign (resid 40 and name hg1 ) (resid 64 and name hd#) 1.8 0.0 3.2
assign (resid 40 and name hg2 ) (resid 64 and name hd#) 1.8 0.0 3.2
assign (resid 42 and name hn ) (resid 59 and name he#) 1.8 0.0 4.2
assign (resid 42 and name ha# ) (resid 59 and name he#) 1.8 0.0 3.7
assign (resid 44 and name hn ) (resid 59 and name he#) 1.8 0.0 3.2
assign (resid 44 and name ha ) (resid 59 and name he#) 1.8 0.0 1.2
assign (resid 44 and name hb1 ) (resid 59 and name he#) 1.8 0.0 2.7
assign (resid 44 and name hb2 ) (resid 59 and name he#) 1.8 0.0 2.7
assign (resid 44 and name hb# ) (resid 59 and name he#) 1.8 0.0 1.7
assign (resid 46 and name hn ) (resid 13 and name he#) 1.8 0.0 4.2
assign (resid 46 and name ha ) (resid 13 and name he#) 1.8 0.0 4.2
assign (resid 46 and name hb# ) (resid 13 and name he#) 1.8 0.0 1.7
assign (resid 46 and name hb# ) (resid 32 and name he#) 1.8 0.0 4.2
assign (resid 47 and name hn ) (resid 32 and name hd#) 1.8 0.0 3.2
assign (resid 47 and name ha ) (resid 32 and name hd#) 1.8 0.0 2.2
assign (resid 48 and name hn ) (resid 32 and name hd#) 1.8 0.0 2.2
assign (resid 48 and name ha ) (resid 32 and name hd#) 1.8 0.0 2.7
assign (resid 48 and name hb1 ) (resid 32 and name he#) 1.8 0.0 2.7
assign (resid 48 and name hb2 ) (resid 32 and name he#) 1.8 0.0 2.7
assign (resid 48 and name hb# ) (resid 32 and name he#) 1.8 0.0 2.2
assign (resid 52 and name hn ) (resid 32 and name he#) 1.8 0.0 3.7
assign (resid 53 and name hn ) (resid 32 and name hd#) 1.8 0.0 3.7
assign (resid 54 and name hn ) (resid 4 and name hd#) 1.8 0.0 4.2
assign (resid 54 and name ha ) (resid 32 and name he#) 1.8 0.0 2.7
assign (resid 54 and name hb ) (resid 4 and name hd#) 1.8 0.0 3.2
assign (resid 54 and name hd1# ) (resid 4 and name hd#) 1.8 0.0 1.7
assign (resid 54 and name hg11 ) (resid 4 and name hd#) 1.8 0.0 3.2
assign (resid 54 and name hg12 ) (resid 4 and name hd#) 1.8 0.0 3.2
assign (resid 54 and name hg1# ) (resid 4 and name hd#) 1.8 0.0 2.2
assign (resid 55 and name hn ) (resid 32 and name hd#) 1.8 0.0 3.7
assign (resid 55 and name ha ) (resid 4 and name hd#) 1.8 0.0 2.7
assign (resid 55 and name hd1# ) (resid 13 and name he#) 1.8 0.0 1.7
assign (resid 55 and name hd1# ) (resid 32 and name he#) 1.8 0.0 3.7
assign (resid 55 and name hg11 ) (resid 13 and name he#) 1.8 0.0 3.7
assign (resid 55 and name hg12 ) (resid 13 and name he#) 1.8 0.0 3.7
assign (resid 55 and name hg2# ) (resid 24 and name he#) 1.8 0.0 3.7
assign (resid 55 and name hg2# ) (resid 32 and name he#) 1.8 0.0 2.7
assign (resid 56 and name ha ) (resid 4 and name hd#) 1.8 0.0 2.7
assign (resid 57 and name hn ) (resid 59 and name hd#) 1.8 0.0 3.7
assign (resid 57 and name ha ) (resid 59 and name hd#) 1.8 0.0 3.2
assign (resid 57 and name hb ) (resid 59 and name he#) 1.8 0.0 2.2
assign (resid 57 and name hg* ) (resid 13 and name he#) 1.8 0.0 2.7
assign (resid 57 and name hg* ) (resid 59 and name hd#) 1.8 0.0 2.2
assign (resid 58 and name hn ) (resid 59 and name hd#) 1.8 0.0 3.7
assign (resid 59 and name hn ) (resid 59 and name hd#) 1.8 0.0 1.7
assign (resid 60 and name hn ) (resid 59 and name hd#) 1.8 0.0 2.2
assign (resid 60 and name hn ) (resid 64 and name he#) 1.8 0.0 3.2
assign (resid 61 and name hn ) (resid 59 and name he#) 1.8 0.0 3.2
assign (resid 61 and name ha ) (resid 59 and name he#) 1.8 0.0 1.2
assign (resid 61 and name ha ) (resid 64 and name hd#) 1.8 0.0 3.2
assign (resid 61 and name hb1 ) (resid 59 and name he#) 1.8 0.0 4.2
assign (resid 61 and name hb2 ) (resid 59 and name he#) 1.8 0.0 4.2
assign (resid 61 and name hb# ) (resid 59 and name he#) 1.8 0.0 3.7
assign (resid 61 and name hd# ) (resid 59 and name he#) 1.8 0.0 2.7
assign (resid 61 and name he# ) (resid 59 and name he#) 1.8 0.0 2.7
assign (resid 61 and name hg# ) (resid 59 and name he#) 1.8 0.0 2.2
assign (resid 63 and name hn ) (resid 59 and name hd#) 1.8 0.0 3.7
assign (resid 63 and name hn ) (resid 64 and name hd#) 1.8 0.0 3.2
assign (resid 63 and name hb1 ) (resid 64 and name he#) 1.8 0.0 3.2
assign (resid 63 and name hb2 ) (resid 64 and name he#) 1.8 0.0 3.2
assign (resid 64 and name hn ) (resid 59 and name hd#) 1.8 0.0 2.7
assign (resid 64 and name hn ) (resid 64 and name hd#) 1.8 0.0 1.7
assign (resid 64 and name ha ) (resid 59 and name he#) 1.8 0.0 4.2
assign (resid 64 and name ha ) (resid 64 and name hd#) 1.8 0.0 1.7
assign (resid 64 and name hb# ) (resid 59 and name he#) 1.8 0.0 2.2
assign (resid 64 and name hb1 ) (resid 64 and name hd#) 1.8 0.0 1.2
assign (resid 64 and name hb2 ) (resid 64 and name hd#) 1.8 0.0 1.2
assign (resid 65 and name hn ) (resid 59 and name he#) 1.8 0.0 3.7
assign (resid 65 and name hn ) (resid 64 and name hd#) 1.8 0.0 3.7
assign (resid 4 and name hn ) (resid 4 and name he#) 1.8 0.0 4.2
assign (resid 46 and name hn ) (resid 4 and name he#) 1.8 0.0 3.7
assign (resid 57 and name hn ) (resid 4 and name he#) 1.8 0.0 2.7
assign (resid 45 and name hg1# ) (resid 4 and name hz) 1.8 0.0 1.7
assign (resid 45 and name hg2# ) (resid 4 and name hz) 1.8 0.0 1.7
assign (resid 45 and name hg* ) (resid 4 and name hz) 1.8 0.0 1.2
assign (resid 54 and name hb ) (resid 4 and name he#) 1.8 0.0 2.2
assign (resid 54 and name hg2# ) (resid 4 and name he#) 1.8 0.0 3.7
assign (resid 54 and name hd1# ) (resid 4 and name he#) 1.8 0.0 1.7
assign (resid 56 and name ha ) (resid 4 and name he#) 1.8 0.0 1.7
assign (resid 56 and name he# ) (resid 4 and name he#) 1.8 0.0 3.7
assign (resid 56 and name hg# ) (resid 4 and name he#) 1.8 0.0 2.7

!hydrogen bonds
assign (resid 8 and name hn ) (resid 56 and name o ) 2.00 0.60 0.70
assign (resid 8 and name  n ) (resid 56 and name o ) 3.00 0.60 0.70
assign (resid 10 and name hn ) (resid 58 and name o ) 2.00 0.60 0.70
assign (resid 10 and name  n ) (resid 58 and name o ) 3.00 0.60 0.70
assign (resid 14 and name hn ) (resid 23 and name o ) 2.00 0.60 0.70
assign (resid 14 and name  n ) (resid 23 and name o ) 3.00 0.60 0.70
assign (resid 22 and name hn ) (resid 34 and name o ) 2.00 0.60 0.70
assign (resid 22 and name  n ) (resid 34 and name o ) 3.00 0.60 0.70
assign (resid 24 and name hn ) (resid 32 and name o ) 2.00 0.60 0.70
assign (resid 24 and name  n ) (resid 32 and name o ) 3.00 0.60 0.70
assign (resid 32 and name hn ) (resid 24 and name o ) 2.00 0.60 0.70
assign (resid 32 and name  n ) (resid 24 and name o ) 3.00 0.60 0.70
assign (resid 34 and name hn ) (resid 22 and name o ) 2.00 0.60 0.70
assign (resid 34 and name  n ) (resid 22 and name o ) 3.00 0.60 0.70
assign (resid 46 and name hn ) (resid 55 and name o ) 2.00 0.60 0.70
assign (resid 46 and name  n ) (resid 55 and name o ) 3.00 0.60 0.70
assign (resid 55 and name hn ) (resid 46 and name o ) 2.00 0.60 0.70
assign (resid 55 and name  n ) (resid 46 and name o ) 3.00 0.60 0.70
assign (resid 58 and name hn ) (resid 8 and name o ) 2.00 0.60 0.70
assign (resid 58 and name  n ) (resid 8 and name o ) 3.00 0.60 0.70

!dihedral restraints
assign (resid  5 and name c  ) (resid  6 and name n  )
       (resid  6 and name ca ) (resid  6 and name c  )  1.0 -149.950  21.940   2
assign (resid  6 and name n  ) (resid  6 and name ca )
       (resid  6 and name c  ) (resid  7 and name n  )  1.0  147.450  15.780  2

assign (resid  6 and name c  ) (resid  7 and name n  )
       (resid  7 and name ca ) (resid  7 and name c  )  1.0  -103.850  23.030  2
assign (resid  7 and name n  ) (resid  7 and name ca )
       (resid  7 and name c  ) (resid  8 and name n  )  1.0  125.460  13.120  2

assign (resid  7 and name c  ) (resid  8 and name n  )
       (resid  8 and name ca ) (resid  8 and name c  )  1.0  -124.960  17.400  2
assign (resid  8 and name n  ) (resid  8 and name ca )
       (resid  8 and name c  ) (resid  9 and name n  )  1.0  129.650  11.600  2

assign (resid  8 and name c  ) (resid  9 and name n  )
       (resid  9 and name ca ) (resid  9 and name c  )  1.0  -80.530  14.280  2
assign (resid  9 and name n  ) (resid  9 and name ca )
       (resid  9 and name c  ) (resid 10 and name n  )  1.0  131.360   8.080  2

assign (resid 10 and name c  ) (resid 11 and name n  )
       (resid 11 and name ca ) (resid 11 and name c  )  1.0  -64.300  12.740  2
assign (resid 11 and name n  ) (resid 11 and name ca )
       (resid 11 and name c  ) (resid 12 and name n  )  1.0  -27.540  23.820  2

assign (resid 11 and name c  ) (resid 12 and name n  )
       (resid 12 and name ca ) (resid 12 and name c  )  1.0  -76.910  13.870  2
assign (resid 12 and name n  ) (resid 12 and name ca )
       (resid 12 and name c  ) (resid 13 and name n  )  1.0  -30.760  16.140  2

assign (resid 20 and name c  ) (resid 21 and name n  )
       (resid 21 and name ca ) (resid 21 and name c  )  1.0  -107.490  35.430  2
assign (resid 21 and name n  ) (resid 21 and name ca )
       (resid 21 and name c  ) (resid 22 and name n  )  1.0  160.160  19.290  2

assign (resid 21 and name c  ) (resid 22 and name n  )       
       (resid 22 and name ca ) (resid 22 and name c  )  1.0  -107.540  14.280  2
assign (resid 22 and name n  ) (resid 22 and name ca )       
       (resid 22 and name c  ) (resid 23 and name n  )  1.0  131.860   9.010  2

assign (resid 22 and name c  ) (resid 23 and name n  )       
       (resid 23 and name ca ) (resid 23 and name c  )  1.0 -129.670  19.440   2
assign (resid 23 and name n  ) (resid 23 and name ca )
       (resid 23 and name c  ) (resid 24 and name n  )  1.0 149.170  16.460   2

assign (resid 23 and name c  ) (resid 24 and name n  )       
       (resid 24 and name ca ) (resid 24 and name c  )  1.0  -141.480  13.820  2
assign (resid 24 and name n  ) (resid 24 and name ca )       
       (resid 24 and name c  ) (resid 25 and name n  )  1.0  142.240  10.760  2

assign (resid 24 and name c  ) (resid 25 and name n  )       
       (resid 25 and name ca ) (resid 25 and name c  )  1.0 -75.480  17.300   2
assign (resid 25 and name n  ) (resid 25 and name ca )       
       (resid 25 and name c  ) (resid 26 and name n  )  1.0  135.590  11.540  2

assign (resid 32 and name c  ) (resid 33 and name n  )
       (resid 33 and name ca ) (resid 33 and name c  )  1.0  -143.420  20.870  2
assign (resid 33 and name n  ) (resid 33 and name ca )       
       (resid 33 and name c  ) (resid 34 and name n  )  1.0  154.200  15.000  2

assign (resid 33 and name c  ) (resid 34 and name n  )       
       (resid 34 and name ca ) (resid 34 and name c  )  1.0  -132.320  19.390  2
assign (resid 34 and name n  ) (resid 34 and name ca )       
       (resid 34 and name c  ) (resid 35 and name n  )  1.0  130.670   9.590  2

assign (resid 34 and name c  ) (resid 35 and name n  )       
       (resid 35 and name ca ) (resid 35 and name c  )  1.0  -83.580  11.440  2
assign (resid 35 and name n  ) (resid 35 and name ca )       
       (resid 35 and name c  ) (resid 36 and name n  )  1.0  159.970  11.420  2

assign (resid 35 and name c  ) (resid 36 and name n  )       
       (resid 36 and name ca ) (resid 36 and name c  )  1.0  -60.460   4.260  2
assign (resid 36 and name n  ) (resid 36 and name ca )       
       (resid 36 and name c  ) (resid 37 and name n  )  1.0  -35.970   6.990  2

assign (resid 36 and name c  ) (resid 37 and name n  )       
       (resid 37 and name ca ) (resid 37 and name c  )  1.0  -63.630   2.570  2
assign (resid 37 and name n  ) (resid 37 and name ca )       
       (resid 37 and name c  ) (resid 38 and name n  )  1.0  -42.200   5.850  2

assign (resid 37 and name c  ) (resid 38 and name n  )       
       (resid 38 and name ca ) (resid 38 and name c  )  1.0  -63.230   6.640  2
assign (resid 38 and name n  ) (resid 38 and name ca )       
       (resid 38 and name c  ) (resid 39 and name n  )  1.0  -42.410   5.110  2

assign (resid 38 and name c  ) (resid 39 and name n  )       
       (resid 39 and name ca ) (resid 39 and name c  )  1.0  -67.120   6.920  2
assign (resid 39 and name n  ) (resid 39 and name ca )
       (resid 39 and name c  ) (resid 40 and name n  )  1.0  -38.530  12.460  2

assign (resid 39 and name c  ) (resid 40 and name n  )       
       (resid 40 and name ca ) (resid 40 and name c  )  1.0  -64.450   5.400  2
assign (resid 40 and name n  ) (resid 40 and name ca )       
       (resid 40 and name c  ) (resid 41 and name n  )  1.0  -33.770  14.120  2

assign (resid 44 and name c  ) (resid 45 and name n  )
       (resid 45 and name ca ) (resid 45 and name c  )  1.0  -121.530  17.070  2
assign (resid 45 and name n  ) (resid 45 and name ca )       
       (resid 45 and name c  ) (resid 46 and name n  )  1.0  133.680  17.680  2

assign (resid 45 and name c  ) (resid 46 and name n  )       
       (resid 46 and name ca ) (resid 46 and name c  )  1.0  -128.580  15.690  2
assign (resid 46 and name n  ) (resid 46 and name ca )       
       (resid 46 and name c  ) (resid 47 and name n  )  1.0  138.020  11.230  2

assign (resid 46 and name c  ) (resid 47 and name n  )       
       (resid 47 and name ca ) (resid 47 and name c  )  1.0  -114.700  12.360  2
assign (resid 47 and name n  ) (resid 47 and name ca )       
       (resid 47 and name c  ) (resid 48 and name n  )  1.0  127.390   5.310  2

assign (resid 53 and name c  ) (resid 54 and name n  )
       (resid 54 and name ca ) (resid 54 and name c  )  1.0  -128.980  16.760  2
assign (resid 54 and name n  ) (resid 54 and name ca )
       (resid 54 and name c  ) (resid 55 and name n  )  1.0  157.430  13.390  2

assign (resid 54 and name c  ) (resid 55 and name n  )       
       (resid 55 and name ca ) (resid 55 and name c  )  1.0  -129.770  19.520  2
assign (resid 55 and name n  ) (resid 55 and name ca )
       (resid 55 and name c  ) (resid 56 and name n  )  1.0  140.280  19.150  2

assign (resid 55 and name c  ) (resid 56 and name n  )       
       (resid 56 and name ca ) (resid 56 and name c  )  1.0  -115.060  23.620  2
assign (resid 56 and name n  ) (resid 56 and name ca )       
       (resid 56 and name c  ) (resid 57 and name n  )  1.0  124.430  12.030  2

assign (resid 56 and name c  ) (resid 57 and name n  )       
       (resid 57 and name ca ) (resid 57 and name c  )  1.0  -101.120   9.150  2
assign (resid 57 and name n  ) (resid 57 and name ca )       
       (resid 57 and name c  ) (resid 58 and name n  )  1.0  121.350   7.780  2

assign (resid 57 and name c  ) (resid 58 and name n  )       
       (resid 58 and name ca ) (resid 58 and name c  )  1.0  -99.640  12.640  2
assign (resid 58 and name n  ) (resid 58 and name ca )       
       (resid 58 and name c  ) (resid 59 and name n  )  1.0  123.710  12.830  2

assign (resid 60 and name c  ) (resid 61 and name n  )
       (resid 61 and name ca ) (resid 61 and name c  )  1.0  -59.240   3.430  2
assign (resid 61 and name n  ) (resid 61 and name ca )       
       (resid 61 and name c  ) (resid 62 and name n  )  1.0  -28.910  10.980  2

assign (resid 61 and name c  ) (resid 62 and name n  )       
       (resid 62 and name ca ) (resid 62 and name c  )  1.0  -72.700   7.460  2
assign (resid 62 and name n  ) (resid 62 and name ca )
       (resid 62 and name c  ) (resid 63 and name n  )  1.0  -33.110  14.730  2

assign (resid 62 and name c  ) (resid 63 and name n  )       
       (resid 63 and name ca ) (resid 63 and name c  )  1.0  -78.280  18.910  2
assign (resid 63 and name n  ) (resid 63 and name ca )       
       (resid 63 and name c  ) (resid 64 and name n  )  1.0  -30.750  17.360  2

!Zinc finger restraints
assign (resid  85 and  name ZN )(resid  26 and  name SG ) 2.30 0.00 0.30
assign (resid  85 and  name ZN )(resid  28 and  name SG ) 2.30 0.00 0.30
assign (resid  85 and  name ZN )(resid  48 and  name SG ) 2.30 0.00 0.30
assign (resid  85 and  name ZN )(resid  51 and  name SG ) 2.30 0.00 0.30
assign (resid  26 and  name SG )(resid  28 and  name SG ) 3.60 0.00 0.30
assign (resid  26 and  name SG )(resid  48 and  name SG ) 3.60 0.00 0.30
assign (resid  26 and  name SG )(resid  51 and  name SG ) 3.60 0.00 0.30
assign (resid  28 and  name SG )(resid  48 and  name SG ) 3.60 0.00 0.30
assign (resid  28 and  name SG )(resid  51 and  name SG ) 3.60 0.00 0.30
assign (resid  48 and  name SG )(resid  51 and  name SG ) 3.60 0.00 0.3

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1HT      MET   1  10.154  11.265  16.792
    2    H2   MET   1           2HT      MET   1  10.351  10.184  18.112
    3    H3   MET   1           3HT      MET   1   8.793  10.453  17.443
    4    HA   MET   1           HA       MET   1   9.454   8.416  16.635
    5    HB2  MET   1           2HB      MET   1   9.703  10.747  14.780
    6    HB3  MET   1           1HB      MET   1  10.083   9.148  14.156
    7    HG2  MET   1           2HG      MET   1   7.866   9.317  13.627
    8    HG3  MET   1           1HG      MET   1   7.783   8.501  15.187
    9    HE1  MET   1           2HE      MET   1   4.980  10.472  16.551
   10    HE2  MET   1           3HE      MET   1   6.118   9.162  16.864
   11    HE3  MET   1           1HE      MET   1   5.197   9.191  15.359
   12    H    ALA   2           H        ALA   2  11.020   6.973  15.842
   13    HA   ALA   2           HA       ALA   2  13.794   7.956  15.812
   14    HB1  ALA   2           1HB      ALA   2  14.535   6.514  17.387
   15    HB2  ALA   2           2HB      ALA   2  13.359   5.268  16.963
   16    HB3  ALA   2           3HB      ALA   2  12.870   6.644  17.951
   17    H    VAL   3           H        VAL   3  11.712   5.143  15.083
   18    HA   VAL   3           HA       VAL   3  13.274   4.754  12.620
   19    HB   VAL   3           HB       VAL   3  12.739   2.275  12.873
   20   HG11  VAL   3          1HG1      VAL   3  14.821   1.946  13.686
   21   HG12  VAL   3          2HG1      VAL   3  14.547   2.961  15.103
   22   HG13  VAL   3          3HG1      VAL   3  14.919   3.701  13.546
   23   HG21  VAL   3          3HG2      VAL   3  12.666   2.572  15.802
   24   HG22  VAL   3          1HG2      VAL   3  11.845   1.414  14.757
   25   HG23  VAL   3          2HG2      VAL   3  11.189   3.038  14.960
   26    H    PHE   4           H        PHE   4  11.994   5.265  10.967
   27    HA   PHE   4           HA       PHE   4  10.218   5.411   9.564
   28    HB2  PHE   4           2HB      PHE   4  10.049   2.792  10.805
   29    HB3  PHE   4           1HB      PHE   4   8.463   3.394  10.353
   30    HD1  PHE   4           1HD      PHE   4  11.813   3.688   8.732
   31    HD2  PHE   4           2HD      PHE   4   7.791   2.332   8.438
   32    HE1  PHE   4           1HE      PHE   4  12.225   2.979   6.411
   33    HE2  PHE   4           2HE      PHE   4   8.196   1.622   6.118
   34    HZ   PHE   4           HZ       PHE   4  10.414   1.942   5.103
   35    H    HIS   5           H        HIS   5   7.673   5.487   9.553
   36    HA   HIS   5           HA       HIS   5   6.931   7.267  11.741
   37    HB2  HIS   5           2HB      HIS   5   6.531   7.933   9.361
   38    HB3  HIS   5           1HB      HIS   5   5.386   6.604   9.224
   39    HD1  HIS   5           1HD      HIS   5   3.081   6.903  10.321
   40    HD2  HIS   5           2HD      HIS   5   5.633  10.136  10.863
   41    HE1  HIS   5           1HE      HIS   5   1.638   8.754  11.220
   42    HE2  HIS   5           2HE      HIS   5   3.224  10.668  11.634
   43    H    ASP   6           H        ASP   6   5.271   4.648   9.961
   44    HA   ASP   6           HA       ASP   6   4.599   3.185  12.291
   45    HB2  ASP   6           2HB      ASP   6   2.689   5.251  11.371
   46    HB3  ASP   6           1HB      ASP   6   1.993   3.663  11.676
   47    H    GLU   7           H        GLU   7   3.979   1.136  11.751
   48    HA   GLU   7           HA       GLU   7   3.910   0.489   8.922
   49    HB2  GLU   7           2HB      GLU   7   3.628  -1.447  11.221
   50    HB3  GLU   7           1HB      GLU   7   4.129  -1.797   9.574
   51    HG2  GLU   7           2HG      GLU   7   6.190  -1.757  10.430
   52    HG3  GLU   7           1HG      GLU   7   6.020  -0.006  10.318
   53    H    VAL   8           H        VAL   8   2.142  -0.069   7.767
   54    HA   VAL   8           HA       VAL   8  -0.373  -0.551   9.220
   55    HB   VAL   8           HB       VAL   8  -0.215   1.089   6.692
   56   HG11  VAL   8          1HG1      VAL   8  -2.550   1.726   7.885
   57   HG12  VAL   8          2HG1      VAL   8  -2.379   0.048   8.396
   58   HG13  VAL   8          3HG1      VAL   8  -2.376   0.451   6.679
   59   HG21  VAL   8          3HG2      VAL   8  -1.012   2.865   8.546
   60   HG22  VAL   8          1HG2      VAL   8   0.670   2.661   8.058
   61   HG23  VAL   8          2HG2      VAL   8   0.076   1.880   9.523
   62    H    GLU   9           H        GLU   9  -1.736  -2.053   8.355
   63    HA   GLU   9           HA       GLU   9  -0.636  -4.012   6.634
   64    HB2  GLU   9           2HB      GLU   9  -3.320  -3.572   7.889
   65    HB3  GLU   9           1HB      GLU   9  -3.141  -4.801   6.645
   66    HG2  GLU   9           2HG      GLU   9  -1.216  -5.703   8.058
   67    HG3  GLU   9           1HG      GLU   9  -1.840  -4.667   9.341
   68    H    ILE  10           H        ILE  10  -0.983  -4.480   4.521
   69    HA   ILE  10           HA       ILE  10  -1.508  -2.434   2.706
   70    HB   ILE  10           HB       ILE  10  -0.232  -4.485   2.177
   71   HG12  ILE  10          2HG1      ILE  10  -1.755  -4.867  -0.071
   72   HG13  ILE  10          1HG1      ILE  10  -2.314  -3.292   0.479
   73   HG21  ILE  10          1HG2      ILE  10  -1.143  -6.573   1.949
   74   HG22  ILE  10          2HG2      ILE  10  -2.757  -5.956   1.603
   75   HG23  ILE  10          3HG2      ILE  10  -2.141  -5.934   3.255
   76   HD11  ILE  10          3HD1      ILE  10  -0.222  -3.630  -1.140
   77   HD12  ILE  10          1HD1      ILE  10   0.605  -3.691   0.415
   78   HD13  ILE  10          2HD1      ILE  10  -0.364  -2.282  -0.012
   79    H    GLU  11           H        GLU  11  -3.712  -4.683   4.241
   80    HA   GLU  11           HA       GLU  11  -5.892  -4.492   2.492
   81    HB2  GLU  11           2HB      GLU  11  -5.782  -4.911   5.481
   82    HB3  GLU  11           1HB      GLU  11  -7.263  -5.033   4.541
   83    HG2  GLU  11           2HG      GLU  11  -6.330  -6.857   3.251
   84    HG3  GLU  11           1HG      GLU  11  -4.798  -6.707   4.111
   85    H    ASP  12           H        ASP  12  -4.714  -2.314   4.976
   86    HA   ASP  12           HA       ASP  12  -7.027  -0.634   5.036
   87    HB2  ASP  12           2HB      ASP  12  -5.076  -0.897   6.774
   88    HB3  ASP  12           1HB      ASP  12  -4.292   0.336   5.793
   89    H    PHE  13           H        PHE  13  -4.054  -0.734   3.176
   90    HA   PHE  13           HA       PHE  13  -4.098   1.847   2.076
   91    HB2  PHE  13           2HB      PHE  13  -2.855  -0.759   1.320
   92    HB3  PHE  13           1HB      PHE  13  -2.893   0.517   0.111
   93    HD1  PHE  13           2HD      PHE  13  -2.059   0.158   3.741
   94    HD2  PHE  13           1HD      PHE  13  -1.034   1.823  -0.040
   95    HE1  PHE  13           2HE      PHE  13  -0.034   1.148   4.728
   96    HE2  PHE  13           1HE      PHE  13   0.992   2.812   0.940
   97    HZ   PHE  13           HZ       PHE  13   1.495   2.475   3.326
   98    H    GLN  14           H        GLN  14  -4.346   2.179  -0.395
   99    HA   GLN  14           HA       GLN  14  -6.950   1.067  -1.209
  100    HB2  GLN  14           2HB      GLN  14  -6.492   3.647  -0.782
  101    HB3  GLN  14           1HB      GLN  14  -5.867   3.569  -2.423
  102    HG2  GLN  14           2HG      GLN  14  -8.220   2.304  -2.758
  103    HG3  GLN  14           1HG      GLN  14  -8.634   3.396  -1.437
  104   HE21  GLN  14          1HE2      GLN  14  -7.466   5.678  -1.901
  105   HE22  GLN  14          2HE2      GLN  14  -7.879   6.333  -3.445
  106    H    TYR  15           H        TYR  15  -6.618  -0.547  -2.636
  107    HA   TYR  15           HA       TYR  15  -4.342  -0.763  -4.300
  108    HB2  TYR  15           2HB      TYR  15  -5.639  -2.734  -3.658
  109    HB3  TYR  15           1HB      TYR  15  -7.038  -2.125  -4.536
  110    HD1  TYR  15           2HD      TYR  15  -3.424  -2.872  -5.195
  111    HD2  TYR  15           1HD      TYR  15  -7.430  -3.038  -6.620
  112    HE1  TYR  15           2HE      TYR  15  -2.649  -4.033  -7.217
  113    HE2  TYR  15           1HE      TYR  15  -6.667  -4.198  -8.647
  114    HH   TYR  15           HH       TYR  15  -4.521  -5.734  -9.199
  115    H    ASP  16           H        ASP  16  -3.938  -0.089  -6.334
  116    HA   ASP  16           HA       ASP  16  -6.022   1.507  -7.665
  117    HB2  ASP  16           2HB      ASP  16  -3.695   2.489  -6.878
  118    HB3  ASP  16           1HB      ASP  16  -3.124   1.762  -8.374
  119    H    GLU  17           H        GLU  17  -7.001   0.049  -8.982
  120    HA   GLU  17           HA       GLU  17  -5.778  -2.065 -10.348
  121    HB2  GLU  17           2HB      GLU  17  -7.817  -1.848 -11.905
  122    HB3  GLU  17           1HB      GLU  17  -8.100  -2.216 -10.209
  123    HG2  GLU  17           2HG      GLU  17  -9.063  -0.197  -9.787
  124    HG3  GLU  17           1HG      GLU  17  -8.123   0.639 -11.022
  125    H    ASP  18           H        ASP  18  -5.938   1.323 -11.126
  126    HA   ASP  18           HA       ASP  18  -5.628   1.414 -13.843
  127    HB2  ASP  18           2HB      ASP  18  -5.705   3.331 -12.102
  128    HB3  ASP  18           1HB      ASP  18  -3.950   3.174 -12.076
  129    H    SER  19           H        SER  19  -2.977   1.083 -11.464
  130    HA   SER  19           HA       SER  19  -1.424  -0.381 -13.445
  131    HB2  SER  19           2HB      SER  19  -0.859   2.033 -13.773
  132    HB3  SER  19           1HB      SER  19  -0.284   2.085 -12.107
  133    HG   SER  19           HG       SER  19   1.529   1.342 -12.837
  134    H    GLU  20           H        GLU  20  -2.691  -1.083 -10.925
  135    HA   GLU  20           HA       GLU  20  -2.303  -2.151  -8.958
  136    HB2  GLU  20           2HB      GLU  20   0.320  -2.932 -10.229
  137    HB3  GLU  20           1HB      GLU  20  -0.578  -3.817  -9.005
  138    HG2  GLU  20           2HG      GLU  20  -1.904  -4.795 -10.510
  139    HG3  GLU  20           1HG      GLU  20  -2.100  -3.314 -11.445
  140    H    THR  21           H        THR  21  -2.089   0.017  -7.945
  141    HA   THR  21           HA       THR  21   0.504   0.212  -6.586
  142    HB   THR  21           HB       THR  21  -0.971   2.666  -7.559
  143    HG1  THR  21           1HG      THR  21   1.131   1.216  -8.781
  144   HG21  THR  21          3HG2      THR  21   1.008   3.876  -7.076
  145   HG22  THR  21          1HG2      THR  21   1.903   2.398  -6.723
  146   HG23  THR  21          2HG2      THR  21   0.611   2.928  -5.644
  147    H    TYR  22           H        TYR  22   0.402   0.935  -4.445
  148    HA   TYR  22           HA       TYR  22  -2.328   1.166  -3.352
  149    HB2  TYR  22           2HB      TYR  22   0.163   0.141  -1.975
  150    HB3  TYR  22           1HB      TYR  22  -1.432   0.265  -1.245
  151    HD1  TYR  22           1HD      TYR  22   0.471  -1.431  -3.942
  152    HD2  TYR  22           2HD      TYR  22  -3.004  -1.475  -1.487
  153    HE1  TYR  22           1HE      TYR  22  -0.058  -3.688  -4.744
  154    HE2  TYR  22           2HE      TYR  22  -3.543  -3.738  -2.284
  155    HH   TYR  22           HH       TYR  22  -1.817  -5.764  -3.378
  156    H    PHE  23           H        PHE  23  -2.821   2.830  -1.971
  157    HA   PHE  23           HA       PHE  23  -0.670   4.757  -1.390
  158    HB2  PHE  23           2HB      PHE  23  -3.477   5.463  -2.268
  159    HB3  PHE  23           1HB      PHE  23  -2.199   6.605  -1.867
  160    HD1  PHE  23           1HD      PHE  23  -3.048   3.859  -4.224
  161    HD2  PHE  23           2HD      PHE  23  -0.763   7.380  -3.522
  162    HE1  PHE  23           1HE      PHE  23  -2.305   3.838  -6.566
  163    HE2  PHE  23           2HE      PHE  23  -0.018   7.366  -5.866
  164    HZ   PHE  23           HZ       PHE  23  -0.787   5.593  -7.392
  165    H    TYR  24           H        TYR  24  -0.930   6.053   0.484
  166    HA   TYR  24           HA       TYR  24  -3.002   5.119   2.359
  167    HB2  TYR  24           2HB      TYR  24  -0.604   4.238   2.760
  168    HB3  TYR  24           1HB      TYR  24  -0.244   5.879   3.289
  169    HD1  TYR  24           2HD      TYR  24  -2.641   3.087   3.905
  170    HD2  TYR  24           1HD      TYR  24  -0.613   6.468   5.507
  171    HE1  TYR  24           2HE      TYR  24  -3.533   2.562   6.130
  172    HE2  TYR  24           1HE      TYR  24  -1.501   5.948   7.740
  173    HH   TYR  24           HH       TYR  24  -4.002   3.697   8.249
  174    HA   PRO  25           HA       PRO  25  -3.905   9.448   2.767
  175    HB2  PRO  25           2HB      PRO  25  -5.317   9.356   5.091
  176    HB3  PRO  25           1HB      PRO  25  -5.978   8.845   3.533
  177    HG2  PRO  25           2HG      PRO  25  -4.833   7.182   5.745
  178    HG3  PRO  25           1HG      PRO  25  -6.280   6.893   4.759
  179    HD2  PRO  25           2HD      PRO  25  -3.930   5.644   4.287
  180    HD3  PRO  25           1HD      PRO  25  -5.057   6.069   2.985
  181    H    CYS  26           H        CYS  26  -2.528  10.976   3.395
  182    HA   CYS  26           HA       CYS  26  -1.047  10.606   5.906
  183    HB2  CYS  26           2HB      CYS  26  -0.113  11.167   3.369
  184    HB3  CYS  26           1HB      CYS  26  -0.127  12.750   4.140
  185    HA   PRO  27           HA       PRO  27  -3.283  13.971   7.718
  186    HB2  PRO  27           2HB      PRO  27  -1.482  14.742   9.605
  187    HB3  PRO  27           1HB      PRO  27  -2.475  13.288   9.750
  188    HG2  PRO  27           2HG      PRO  27   0.374  13.559   8.868
  189    HG3  PRO  27           1HG      PRO  27  -0.355  12.351   9.940
  190    HD2  PRO  27           2HD      PRO  27   0.199  11.836   7.346
  191    HD3  PRO  27           1HD      PRO  27  -1.188  11.107   8.186
  192    H    CYS  28           H        CYS  28  -0.181  14.394   6.219
  193    HA   CYS  28           HA       CYS  28   0.061  17.200   6.594
  194    HB2  CYS  28           2HB      CYS  28   1.778  17.097   4.867
  195    HB3  CYS  28           1HB      CYS  28   1.974  15.762   5.996
  196    H    GLY  29           H        GLY  29  -1.593  15.194   4.230
  197    HA2  GLY  29           2HA      GLY  29  -3.579  16.660   3.375
  198    HA3  GLY  29           1HA      GLY  29  -2.269  17.548   2.613
  199    H    ASP  30           H        ASP  30  -0.634  15.332   1.925
  200    HA   ASP  30           HA       ASP  30  -2.126  14.355  -0.381
  201    HB2  ASP  30           2HB      ASP  30   0.394  15.320  -0.161
  202    HB3  ASP  30           1HB      ASP  30   0.716  13.595  -0.015
  203    H    ASN  31           H        ASN  31  -0.901  11.987  -0.985
  204    HA   ASN  31           HA       ASN  31  -1.343  10.245   1.335
  205    HB2  ASN  31           2HB      ASN  31  -2.438   9.646  -1.419
  206    HB3  ASN  31           1HB      ASN  31  -2.701   8.722   0.057
  207   HD21  ASN  31          1HD2      ASN  31  -4.594   9.038   0.988
  208   HD22  ASN  31          2HD2      ASN  31  -5.568  10.459   0.861
  209    H    PHE  32           H        PHE  32   0.018   8.541   1.502
  210    HA   PHE  32           HA       PHE  32   2.436   8.487   0.074
  211    HB2  PHE  32           2HB      PHE  32   1.070   6.579   1.947
  212    HB3  PHE  32           1HB      PHE  32   2.538   6.084   1.114
  213    HD1  PHE  32           2HD      PHE  32   4.577   7.658   1.348
  214    HD2  PHE  32           1HD      PHE  32   1.216   7.721   3.958
  215    HE1  PHE  32           2HE      PHE  32   5.942   8.752   3.077
  216    HE2  PHE  32           1HE      PHE  32   2.579   8.817   5.689
  217    HZ   PHE  32           HZ       PHE  32   4.945   9.333   5.248
  218    H    SER  33           H        SER  33   3.274   6.572  -1.185
  219    HA   SER  33           HA       SER  33   1.240   5.101  -2.669
  220    HB2  SER  33           2HB      SER  33   2.194   5.766  -4.858
  221    HB3  SER  33           1HB      SER  33   1.494   7.131  -3.991
  222    HG   SER  33           HG       SER  33   3.653   7.428  -4.971
  223    H    ILE  34           H        ILE  34   1.894   3.138  -3.395
  224    HA   ILE  34           HA       ILE  34   4.706   2.458  -3.559
  225    HB   ILE  34           HB       ILE  34   4.274   2.077  -1.190
  226   HG12  ILE  34          2HG1      ILE  34   4.337  -0.648  -2.467
  227   HG13  ILE  34          1HG1      ILE  34   5.673   0.479  -2.671
  228   HG21  ILE  34          1HG2      ILE  34   1.742   1.474  -1.864
  229   HG22  ILE  34          2HG2      ILE  34   2.477   1.025  -0.325
  230   HG23  ILE  34          3HG2      ILE  34   2.394  -0.149  -1.639
  231   HD11  ILE  34          3HD1      ILE  34   4.786   0.065   0.097
  232   HD12  ILE  34          1HD1      ILE  34   6.412   0.178  -0.578
  233   HD13  ILE  34          2HD1      ILE  34   5.510  -1.332  -0.698
  234    H    THR  35           H        THR  35   4.984   1.182  -5.279
  235    HA   THR  35           HA       THR  35   2.761   0.145  -6.738
  236    HB   THR  35           HB       THR  35   4.736  -0.980  -8.061
  237    HG1  THR  35           1HG      THR  35   6.655  -0.515  -7.370
  238   HG21  THR  35          3HG2      THR  35   5.236   1.089  -9.234
  239   HG22  THR  35          1HG2      THR  35   4.492   2.018  -7.931
  240   HG23  THR  35          2HG2      THR  35   3.507   0.938  -8.918
  241    H    LYS  36           H        LYS  36   2.263  -2.030  -7.235
  242    HA   LYS  36           HA       LYS  36   2.296  -3.819  -5.071
  243    HB2  LYS  36           2HB      LYS  36   0.615  -3.909  -6.863
  244    HB3  LYS  36           1HB      LYS  36   1.851  -4.414  -8.005
  245    HG2  LYS  36           2HG      LYS  36   1.022  -6.454  -7.518
  246    HG3  LYS  36           1HG      LYS  36   2.165  -6.339  -6.181
  247    HD2  LYS  36           2HD      LYS  36   0.425  -5.612  -4.687
  248    HD3  LYS  36           1HD      LYS  36  -0.733  -5.526  -6.017
  249    HE2  LYS  36           2HE      LYS  36   0.651  -8.059  -5.148
  250    HE3  LYS  36           1HE      LYS  36  -0.937  -7.559  -4.566
  251    HZ1  LYS  36           3HZ      LYS  36  -1.602  -7.486  -6.985
  252    HZ2  LYS  36           1HZ      LYS  36  -1.326  -9.026  -6.341
  253    HZ3  LYS  36           2HZ      LYS  36  -0.161  -8.300  -7.327
  254    H    GLU  37           H        GLU  37   4.388  -3.548  -7.903
  255    HA   GLU  37           HA       GLU  37   5.805  -5.950  -7.612
  256    HB2  GLU  37           2HB      GLU  37   5.812  -4.208  -9.541
  257    HB3  GLU  37           1HB      GLU  37   7.096  -3.435  -8.624
  258    HG2  GLU  37           2HG      GLU  37   7.916  -6.043  -8.688
  259    HG3  GLU  37           1HG      GLU  37   7.144  -5.850 -10.260
  260    H    ASP  38           H        ASP  38   6.271  -2.768  -6.140
  261    HA   ASP  38           HA       ASP  38   8.787  -3.158  -4.994
  262    HB2  ASP  38           2HB      ASP  38   6.445  -1.407  -4.393
  263    HB3  ASP  38           1HB      ASP  38   7.680  -1.568  -3.149
  264    H    LEU  39           H        LEU  39   5.558  -3.833  -3.670
  265    HA   LEU  39           HA       LEU  39   6.455  -4.854  -1.192
  266    HB2  LEU  39           2HB      LEU  39   3.905  -5.570  -2.635
  267    HB3  LEU  39           1HB      LEU  39   4.214  -5.703  -0.914
  268    HG   LEU  39           HG       LEU  39   4.422  -3.014  -2.191
  269   HD11  LEU  39          1HD1      LEU  39   1.826  -4.359  -1.469
  270   HD12  LEU  39          2HD1      LEU  39   2.342  -3.870  -3.082
  271   HD13  LEU  39          3HD1      LEU  39   2.023  -2.648  -1.850
  272   HD21  LEU  39          3HD2      LEU  39   3.294  -3.843   0.472
  273   HD22  LEU  39          1HD2      LEU  39   3.802  -2.234  -0.041
  274   HD23  LEU  39          2HD2      LEU  39   5.004  -3.500   0.207
  275    H    GLU  40           H        GLU  40   5.889  -6.361  -4.337
  276    HA   GLU  40           HA       GLU  40   6.085  -9.052  -3.482
  277    HB2  GLU  40           2HB      GLU  40   6.617  -7.777  -6.165
  278    HB3  GLU  40           1HB      GLU  40   6.625  -9.515  -5.894
  279    HG2  GLU  40           2HG      GLU  40   4.285  -9.396  -5.166
  280    HG3  GLU  40           1HG      GLU  40   4.287  -7.664  -5.487
  281    H    ASN  41           H        ASN  41   8.500  -6.628  -4.214
  282    HA   ASN  41           HA       ASN  41  10.652  -8.590  -4.245
  283    HB2  ASN  41           2HB      ASN  41  10.374  -5.724  -4.955
  284    HB3  ASN  41           1HB      ASN  41  11.951  -6.240  -4.365
  285   HD21  ASN  41          1HD2      ASN  41  11.967  -5.333  -6.812
  286   HD22  ASN  41          2HD2      ASN  41  12.069  -6.599  -7.982
  287    H    GLY  42           H        GLY  42   9.377  -6.045  -2.163
  288    HA2  GLY  42           2HA      GLY  42   9.890  -6.805   0.274
  289    HA3  GLY  42           1HA      GLY  42  11.544  -6.509  -0.239
  290    H    GLU  43           H        GLU  43  10.172  -4.251  -1.977
  291    HA   GLU  43           HA       GLU  43  10.829  -2.133  -0.222
  292    HB2  GLU  43           2HB      GLU  43   9.561  -2.276  -2.944
  293    HB3  GLU  43           1HB      GLU  43   9.647  -0.748  -2.081
  294    HG2  GLU  43           2HG      GLU  43  11.961  -2.480  -2.908
  295    HG3  GLU  43           1HG      GLU  43  11.493  -0.931  -3.606
  296    H    ASP  44           H        ASP  44   9.478  -2.681   1.587
  297    HA   ASP  44           HA       ASP  44   6.609  -2.171   1.285
  298    HB2  ASP  44           2HB      ASP  44   6.566  -2.871   3.740
  299    HB3  ASP  44           1HB      ASP  44   6.992  -4.115   2.573
  300    H    VAL  45           H        VAL  45   8.309   0.032   0.904
  301    HA   VAL  45           HA       VAL  45   7.611   1.655   3.251
  302    HB   VAL  45           HB       VAL  45  10.031   1.332   3.209
  303   HG11  VAL  45          1HG1      VAL  45  10.449   2.937   0.775
  304   HG12  VAL  45          2HG1      VAL  45   9.869   1.293   0.516
  305   HG13  VAL  45          3HG1      VAL  45  11.364   1.567   1.407
  306   HG21  VAL  45          3HG2      VAL  45   9.124   3.431   4.054
  307   HG22  VAL  45          1HG2      VAL  45   9.215   4.131   2.438
  308   HG23  VAL  45          2HG2      VAL  45  10.693   3.681   3.289
  309    H    ALA  46           H        ALA  46   6.533   3.488   2.884
  310    HA   ALA  46           HA       ALA  46   6.121   4.292   0.081
  311    HB1  ALA  46           1HB      ALA  46   4.208   3.509   1.869
  312    HB2  ALA  46           2HB      ALA  46   3.923   4.514   0.450
  313    HB3  ALA  46           3HB      ALA  46   4.165   5.265   2.027
  314    H    THR  47           H        THR  47   6.533   6.356  -0.502
  315    HA   THR  47           HA       THR  47   7.376   8.207   1.628
  316    HB   THR  47           HB       THR  47   8.447   8.437  -1.160
  317    HG1  THR  47           1HG      THR  47   9.381   6.626   0.816
  318   HG21  THR  47          3HG2      THR  47  10.262   8.754   1.087
  319   HG22  THR  47          1HG2      THR  47   8.900   9.874   1.126
  320   HG23  THR  47          2HG2      THR  47   9.955   9.815  -0.288
  321    H    CYS  48           H        CYS  48   6.451  10.161   1.697
  322    HA   CYS  48           HA       CYS  48   4.335  10.737  -0.205
  323    HB2  CYS  48           2HB      CYS  48   4.533  11.115   2.497
  324    HB3  CYS  48           1HB      CYS  48   4.903  12.725   1.893
  325    HA   PRO  49           HA       PRO  49   6.855  13.566  -2.519
  326    HB2  PRO  49           2HB      PRO  49   4.926  14.748  -3.984
  327    HB3  PRO  49           1HB      PRO  49   5.439  13.080  -4.266
  328    HG2  PRO  49           2HG      PRO  49   3.043  14.103  -2.796
  329    HG3  PRO  49           1HG      PRO  49   3.167  12.740  -3.919
  330    HD2  PRO  49           2HD      PRO  49   3.137  12.466  -1.200
  331    HD3  PRO  49           1HD      PRO  49   3.925  11.313  -2.298
  332    H    SER  50           H        SER  50   4.676  14.505  -0.101
  333    HA   SER  50           HA       SER  50   5.343  17.346  -0.444
  334    HB2  SER  50           2HB      SER  50   3.034  15.976   0.928
  335    HB3  SER  50           1HB      SER  50   3.428  17.668   1.231
  336    HG   SER  50           HG       SER  50   2.590  16.447  -1.173
  337    H    CYS  51           H        CYS  51   4.575  15.218   2.338
  338    HA   CYS  51           HA       CYS  51   6.299  16.713   4.065
  339    HB2  CYS  51           2HB      CYS  51   5.700  15.108   5.780
  340    HB3  CYS  51           1HB      CYS  51   4.261  15.583   4.885
  341    H    SER  52           H        SER  52   6.689  13.871   2.088
  342    HA   SER  52           HA       SER  52   8.496  12.598   1.570
  343    HB2  SER  52           2HB      SER  52  10.180  14.594   3.093
  344    HB3  SER  52           1HB      SER  52  10.694  13.523   1.792
  345    HG   SER  52           HG       SER  52   9.541  15.980   1.657
  346    H    LEU  53           H        LEU  53   6.994  11.890   3.810
  347    HA   LEU  53           HA       LEU  53   8.903  11.080   5.865
  348    HB2  LEU  53           2HB      LEU  53   5.924  11.174   5.657
  349    HB3  LEU  53           1HB      LEU  53   6.649  10.056   6.795
  350    HG   LEU  53           HG       LEU  53   7.404  12.958   6.832
  351   HD11  LEU  53          1HD1      LEU  53   4.813  12.324   7.003
  352   HD12  LEU  53          2HD1      LEU  53   5.553  13.616   7.948
  353   HD13  LEU  53          3HD1      LEU  53   5.289  12.031   8.676
  354   HD21  LEU  53          3HD2      LEU  53   8.789  11.495   8.143
  355   HD22  LEU  53          1HD2      LEU  53   7.374  10.749   8.885
  356   HD23  LEU  53          2HD2      LEU  53   7.767  12.432   9.233
  357    H    ILE  54           H        ILE  54   8.217   8.732   6.763
  358    HA   ILE  54           HA       ILE  54   8.116   6.895   4.461
  359    HB   ILE  54           HB       ILE  54   9.704   5.409   5.765
  360   HG12  ILE  54          2HG1      ILE  54  10.201   7.994   7.265
  361   HG13  ILE  54          1HG1      ILE  54   9.514   6.522   7.943
  362   HG21  ILE  54          1HG2      ILE  54  11.707   6.587   4.973
  363   HG22  ILE  54          2HG2      ILE  54  10.748   8.049   4.746
  364   HG23  ILE  54          3HG2      ILE  54  10.409   6.614   3.778
  365   HD11  ILE  54          3HD1      ILE  54  11.694   6.392   8.638
  366   HD12  ILE  54          1HD1      ILE  54  12.322   7.122   7.161
  367   HD13  ILE  54          2HD1      ILE  54  11.750   5.454   7.146
  368    H    ILE  55           H        ILE  55   7.012   4.978   4.768
  369    HA   ILE  55           HA       ILE  55   5.947   4.371   7.419
  370    HB   ILE  55           HB       ILE  55   3.662   4.008   6.516
  371   HG12  ILE  55          2HG1      ILE  55   4.307   5.784   4.198
  372   HG13  ILE  55          1HG1      ILE  55   4.659   4.066   4.065
  373   HG21  ILE  55          1HG2      ILE  55   4.123   5.996   7.794
  374   HG22  ILE  55          2HG2      ILE  55   3.018   6.390   6.478
  375   HG23  ILE  55          3HG2      ILE  55   4.722   6.824   6.357
  376   HD11  ILE  55          3HD1      ILE  55   2.184   3.820   4.893
  377   HD12  ILE  55          1HD1      ILE  55   2.555   4.133   3.198
  378   HD13  ILE  55          2HD1      ILE  55   2.045   5.454   4.247
  379    H    LYS  56           H        LYS  56   5.493   2.209   7.758
  380    HA   LYS  56           HA       LYS  56   6.590   0.408   5.747
  381    HB2  LYS  56           2HB      LYS  56   6.863   0.474   8.466
  382    HB3  LYS  56           1HB      LYS  56   5.618  -0.753   8.268
  383    HG2  LYS  56           2HG      LYS  56   8.218  -0.818   6.766
  384    HG3  LYS  56           1HG      LYS  56   8.000  -1.569   8.347
  385    HD2  LYS  56           2HD      LYS  56   5.960  -2.729   7.230
  386    HD3  LYS  56           1HD      LYS  56   6.758  -2.285   5.719
  387    HE2  LYS  56           2HE      LYS  56   8.790  -3.447   6.470
  388    HE3  LYS  56           1HE      LYS  56   7.954  -3.928   7.946
  389    HZ1  LYS  56           3HZ      LYS  56   8.064  -5.423   5.740
  390    HZ2  LYS  56           1HZ      LYS  56   6.602  -4.613   5.471
  391    HZ3  LYS  56           2HZ      LYS  56   6.816  -5.528   6.878
  392    H    VAL  57           H        VAL  57   5.536  -1.074   4.656
  393    HA   VAL  57           HA       VAL  57   2.619  -1.162   4.992
  394    HB   VAL  57           HB       VAL  57   3.805  -2.209   2.484
  395   HG11  VAL  57          1HG1      VAL  57   1.414  -2.160   2.813
  396   HG12  VAL  57          2HG1      VAL  57   1.849  -1.003   1.554
  397   HG13  VAL  57          3HG1      VAL  57   1.472  -0.438   3.181
  398   HG21  VAL  57          3HG2      VAL  57   3.630   0.368   1.746
  399   HG22  VAL  57          1HG2      VAL  57   5.139  -0.393   2.243
  400   HG23  VAL  57          2HG2      VAL  57   4.221   0.578   3.394
  401    H    ILE  58           H        ILE  58   1.914  -2.930   5.976
  402    HA   ILE  58           HA       ILE  58   3.501  -5.381   5.901
  403    HB   ILE  58           HB       ILE  58   0.958  -4.883   7.450
  404   HG12  ILE  58          2HG1      ILE  58   2.673  -3.230   8.077
  405   HG13  ILE  58          1HG1      ILE  58   2.381  -4.378   9.380
  406   HG21  ILE  58          1HG2      ILE  58   1.511  -6.792   8.711
  407   HG22  ILE  58          2HG2      ILE  58   3.147  -6.852   8.057
  408   HG23  ILE  58          3HG2      ILE  58   1.771  -7.251   7.028
  409   HD11  ILE  58          3HD1      ILE  58   4.686  -4.505   7.448
  410   HD12  ILE  58          1HD1      ILE  58   4.410  -5.566   8.829
  411   HD13  ILE  58          2HD1      ILE  58   4.758  -3.856   9.086
  412    H    TYR  59           H        TYR  59   2.904  -7.212   4.866
  413    HA   TYR  59           HA       TYR  59   0.206  -7.608   3.904
  414    HB2  TYR  59           2HB      TYR  59   1.030  -7.886   1.508
  415    HB3  TYR  59           1HB      TYR  59   0.932  -6.230   2.100
  416    HD1  TYR  59           2HD      TYR  59   2.979  -4.992   2.661
  417    HD2  TYR  59           1HD      TYR  59   3.151  -8.884   0.950
  418    HE1  TYR  59           2HE      TYR  59   5.338  -4.640   2.107
  419    HE2  TYR  59           1HE      TYR  59   5.517  -8.544   0.395
  420    HH   TYR  59           HH       TYR  59   7.366  -7.205   0.916
  421    H    ASP  60           H        ASP  60   0.264  -9.657   2.354
  422    HA   ASP  60           HA       ASP  60   1.693 -11.708   3.851
  423    HB2  ASP  60           2HB      ASP  60  -0.824 -11.762   3.126
  424    HB3  ASP  60           1HB      ASP  60  -0.179 -12.294   1.577
  425    H    LYS  61           H        LYS  61   3.754 -11.949   3.188
  426    HA   LYS  61           HA       LYS  61   4.728 -11.452   0.603
  427    HB2  LYS  61           2HB      LYS  61   5.829 -13.167   2.829
  428    HB3  LYS  61           1HB      LYS  61   6.702 -12.847   1.337
  429    HG2  LYS  61           2HG      LYS  61   5.694 -10.478   2.771
  430    HG3  LYS  61           1HG      LYS  61   6.973 -11.391   3.574
  431    HD2  LYS  61           2HD      LYS  61   7.978 -11.282   1.077
  432    HD3  LYS  61           1HD      LYS  61   7.051  -9.780   1.094
  433    HE2  LYS  61           2HE      LYS  61   9.376  -9.440   1.809
  434    HE3  LYS  61           1HE      LYS  61   8.225  -9.045   3.085
  435    HZ1  LYS  61           3HZ      LYS  61   8.852 -10.838   4.332
  436    HZ2  LYS  61           1HZ      LYS  61  10.327 -10.490   3.580
  437    HZ3  LYS  61           2HZ      LYS  61   9.360 -11.752   3.003
  438    H    ASP  62           H        ASP  62   3.317 -14.325   2.041
  439    HA   ASP  62           HA       ASP  62   4.124 -16.190   0.074
  440    HB2  ASP  62           2HB      ASP  62   2.916 -16.455   2.450
  441    HB3  ASP  62           1HB      ASP  62   1.492 -16.546   1.419
  442    H    GLN  63           H        GLN  63   1.422 -13.946   0.291
  443    HA   GLN  63           HA       GLN  63   0.086 -14.987  -2.040
  444    HB2  GLN  63           2HB      GLN  63  -0.330 -12.548  -0.321
  445    HB3  GLN  63           1HB      GLN  63  -1.266 -12.829  -1.783
  446    HG2  GLN  63           2HG      GLN  63  -1.191 -15.100   0.066
  447    HG3  GLN  63           1HG      GLN  63  -1.965 -13.653   0.707
  448   HE21  GLN  63          1HE2      GLN  63  -3.688 -12.694  -0.608
  449   HE22  GLN  63          2HE2      GLN  63  -4.690 -13.739  -1.550
  450    H    PHE  64           H        PHE  64   1.997 -12.076  -1.283
  451    HA   PHE  64           HA       PHE  64   1.855 -10.916  -3.847
  452    HB2  PHE  64           2HB      PHE  64   3.636 -10.563  -1.471
  453    HB3  PHE  64           1HB      PHE  64   4.114  -9.835  -3.001
  454    HD1  PHE  64           2HD      PHE  64   1.248 -10.039  -0.637
  455    HD2  PHE  64           1HD      PHE  64   3.273  -7.761  -3.607
  456    HE1  PHE  64           2HE      PHE  64  -0.256  -8.144  -0.201
  457    HE2  PHE  64           1HE      PHE  64   1.772  -5.862  -3.176
  458    HZ   PHE  64           HZ       PHE  64   0.004  -6.052  -1.472
  459    H    VAL  65           H        VAL  65   4.237 -13.120  -2.398
  460    HA   VAL  65           HA       VAL  65   5.822 -13.186  -4.830
  461    HB   VAL  65           HB       VAL  65   6.108 -14.926  -2.371
  462   HG11  VAL  65          1HG1      VAL  65   8.438 -14.235  -4.037
  463   HG12  VAL  65          2HG1      VAL  65   7.249 -15.297  -4.787
  464   HG13  VAL  65          3HG1      VAL  65   8.004 -15.759  -3.264
  465   HG21  VAL  65          3HG2      VAL  65   6.248 -12.399  -2.003
  466   HG22  VAL  65          1HG2      VAL  65   7.731 -12.465  -2.954
  467   HG23  VAL  65          2HG2      VAL  65   7.608 -13.374  -1.448
  468    H    SER  66           H        SER  66   4.199 -13.962  -6.272
  469    HA   SER  66           HA       SER  66   3.522 -16.809  -5.912
  470    HB2  SER  66           2HB      SER  66   2.022 -14.502  -7.057
  471    HB3  SER  66           1HB      SER  66   1.779 -16.082  -7.798
  472    HG   SER  66           HG       SER  66   0.404 -15.402  -5.905
  473    H    GLY  67           H        GLY  67   5.323 -17.723  -6.879
  474    HA2  GLY  67           2HA      GLY  67   6.392 -16.821  -9.364
  475    HA3  GLY  67           1HA      GLY  67   6.766 -18.340  -8.565
  476    H    GLU  68           H        GLU  68   4.724 -19.892  -8.612
  477    HA   GLU  68           HA       GLU  68   3.645 -19.850 -11.355
  478    HB2  GLU  68           2HB      GLU  68   5.025 -22.027  -9.851
  479    HB3  GLU  68           1HB      GLU  68   3.731 -22.472 -10.954
  480    HG2  GLU  68           2HG      GLU  68   4.871 -21.634 -12.819
  481    HG3  GLU  68           1HG      GLU  68   6.003 -20.723 -11.822
  482    H    THR  69           H        THR  69   2.341 -18.837  -9.009
  483    HA   THR  69           HA       THR  69  -0.021 -20.568  -9.025
  484    HB   THR  69           HB       THR  69   1.139 -19.369  -6.499
  485    HG1  THR  69           1HG      THR  69   1.153 -22.024  -7.486
  486   HG21  THR  69          3HG2      THR  69  -0.563 -21.293  -5.679
  487   HG22  THR  69          1HG2      THR  69  -1.416 -20.675  -7.093
  488   HG23  THR  69          2HG2      THR  69  -0.968 -19.580  -5.785
  489    H    VAL  70           H        VAL  70  -1.381 -19.233 -10.109
  490    HA   VAL  70           HA       VAL  70  -1.402 -16.384  -9.556
  491    HB   VAL  70           HB       VAL  70  -1.636 -17.144 -11.873
  492   HG11  VAL  70          1HG1      VAL  70  -3.145 -18.637 -12.616
  493   HG12  VAL  70          2HG1      VAL  70  -4.424 -18.021 -11.571
  494   HG13  VAL  70          3HG1      VAL  70  -3.216 -19.130 -10.925
  495   HG21  VAL  70          3HG2      VAL  70  -3.568 -15.420 -10.511
  496   HG22  VAL  70          1HG2      VAL  70  -4.102 -15.992 -12.091
  497   HG23  VAL  70          2HG2      VAL  70  -2.580 -15.113 -11.938
  498    HA   PRO  71           HA       PRO  71  -4.420 -16.930  -6.272
  499    HB2  PRO  71           2HB      PRO  71  -4.573 -13.978  -6.529
  500    HB3  PRO  71           1HB      PRO  71  -4.240 -14.968  -5.105
  501    HG2  PRO  71           2HG      PRO  71  -2.293 -13.596  -6.301
  502    HG3  PRO  71           1HG      PRO  71  -1.995 -15.215  -5.639
  503    HD2  PRO  71           2HD      PRO  71  -2.423 -14.373  -8.481
  504    HD3  PRO  71           1HD      PRO  71  -1.279 -15.559  -7.817
  505    H    ALA  72           H        ALA  72  -6.672 -15.978  -5.832
  506    HA   ALA  72           HA       ALA  72  -8.109 -15.613  -8.379
  507    HB1  ALA  72           1HB      ALA  72  -9.596 -17.231  -7.896
  508    HB2  ALA  72           2HB      ALA  72  -9.584 -16.884  -6.167
  509    HB3  ALA  72           3HB      ALA  72  -8.288 -17.842  -6.884
  510    HA   PRO  73           HA       PRO  73 -10.045 -12.006  -6.722
  511    HB2  PRO  73           2HB      PRO  73 -12.476 -12.092  -7.913
  512    HB3  PRO  73           1HB      PRO  73 -10.992 -11.728  -8.802
  513    HG2  PRO  73           2HG      PRO  73 -12.485 -14.317  -8.587
  514    HG3  PRO  73           1HG      PRO  73 -11.778 -13.550 -10.022
  515    HD2  PRO  73           2HD      PRO  73 -10.550 -15.565  -8.702
  516    HD3  PRO  73           1HD      PRO  73  -9.648 -14.269  -9.514
  517    H    SER  74           H        SER  74 -11.575 -11.237  -5.221
  518    HA   SER  74           HA       SER  74 -13.484 -13.112  -4.083
  519    HB2  SER  74           2HB      SER  74 -11.374 -11.802  -2.352
  520    HB3  SER  74           1HB      SER  74 -12.648 -12.893  -1.812
  521    HG   SER  74           HG       SER  74 -10.231 -13.531  -2.636
  522    H    ALA  75           H        ALA  75 -15.104 -11.728  -4.789
  523    HA   ALA  75           HA       ALA  75 -16.625 -10.045  -4.639
  524    HB1  ALA  75           1HB      ALA  75 -16.545  -8.678  -2.460
  525    HB2  ALA  75           2HB      ALA  75 -15.264  -9.788  -1.979
  526    HB3  ALA  75           3HB      ALA  75 -16.872 -10.406  -2.350
  527    H    ASN  76           H        ASN  76 -16.735  -7.492  -4.116
  528    HA   ASN  76           HA       ASN  76 -14.294  -6.228  -5.149
  529    HB2  ASN  76           2HB      ASN  76 -15.613  -4.842  -6.681
  530    HB3  ASN  76           1HB      ASN  76 -15.796  -6.552  -7.053
  531   HD21  ASN  76          1HD2      ASN  76 -17.549  -4.461  -7.848
  532   HD22  ASN  76          2HD2      ASN  76 -19.088  -4.770  -7.128
  533    H    LYS  77           H        LYS  77 -14.100  -3.958  -4.704
  534    HA   LYS  77           HA       LYS  77 -15.875  -2.973  -2.573
  535    HB2  LYS  77           2HB      LYS  77 -13.777  -1.937  -1.550
  536    HB3  LYS  77           1HB      LYS  77 -13.992  -3.669  -1.346
  537    HG2  LYS  77           2HG      LYS  77 -12.191  -4.181  -2.612
  538    HG3  LYS  77           1HG      LYS  77 -12.432  -2.816  -3.706
  539    HD2  LYS  77           2HD      LYS  77 -11.681  -2.137  -0.932
  540    HD3  LYS  77           1HD      LYS  77 -10.443  -2.951  -1.891
  541    HE2  LYS  77           2HE      LYS  77 -10.494  -1.252  -3.553
  542    HE3  LYS  77           1HE      LYS  77 -11.943  -0.526  -2.860
  543    HZ1  LYS  77           3HZ      LYS  77  -9.624   0.504  -2.393
  544    HZ2  LYS  77           1HZ      LYS  77  -9.506  -0.713  -1.223
  545    HZ3  LYS  77           2HZ      LYS  77 -10.764   0.414  -1.149
  546    H    GLU  78           H        GLU  78 -16.633  -0.986  -2.924
  547    HA   GLU  78           HA       GLU  78 -15.111   0.823  -4.670
  548    HB2  GLU  78           2HB      GLU  78 -17.268  -0.442  -5.634
  549    HB3  GLU  78           1HB      GLU  78 -18.078   0.907  -4.851
  550    HG2  GLU  78           2HG      GLU  78 -17.086   2.478  -6.233
  551    HG3  GLU  78           1HG      GLU  78 -15.781   1.390  -6.700
  552    H    LEU  79           H        LEU  79 -14.421   1.890  -2.758
  553    HA   LEU  79           HA       LEU  79 -16.484   3.648  -1.614
  554    HB2  LEU  79           2HB      LEU  79 -15.436   3.479   0.588
  555    HB3  LEU  79           1HB      LEU  79 -16.033   1.926   0.038
  556    HG   LEU  79           HG       LEU  79 -13.170   2.561  -0.475
  557   HD11  LEU  79          1HD1      LEU  79 -12.431   2.247   1.677
  558   HD12  LEU  79          2HD1      LEU  79 -13.917   1.443   2.186
  559   HD13  LEU  79          3HD1      LEU  79 -13.895   3.191   1.955
  560   HD21  LEU  79          3HD2      LEU  79 -12.909   0.280  -0.501
  561   HD22  LEU  79          1HD2      LEU  79 -14.570   0.425  -1.071
  562   HD23  LEU  79          2HD2      LEU  79 -14.248   0.002   0.610
  563    H    VAL  80           H        VAL  80 -14.620   4.144  -3.759
  564    HA   VAL  80           HA       VAL  80 -12.494   5.768  -2.670
  565    HB   VAL  80           HB       VAL  80 -13.384   5.592  -5.552
  566   HG11  VAL  80          1HG1      VAL  80 -11.063   6.782  -4.130
  567   HG12  VAL  80          2HG1      VAL  80 -11.942   7.358  -5.547
  568   HG13  VAL  80          3HG1      VAL  80 -10.776   6.044  -5.706
  569   HG21  VAL  80          3HG2      VAL  80 -12.840   3.407  -5.291
  570   HG22  VAL  80          1HG2      VAL  80 -11.835   3.711  -3.873
  571   HG23  VAL  80          2HG2      VAL  80 -11.204   4.035  -5.487
  572    H    LYS  81           H        LYS  81 -13.766   7.265  -1.451
  573    HA   LYS  81           HA       LYS  81 -14.723   9.500  -3.082
  574    HB2  LYS  81           2HB      LYS  81 -16.325   7.951  -1.093
  575    HB3  LYS  81           1HB      LYS  81 -16.572   9.687  -1.186
  576    HG2  LYS  81           2HG      LYS  81 -16.870   9.282  -3.718
  577    HG3  LYS  81           1HG      LYS  81 -17.107   7.595  -3.252
  578    HD2  LYS  81           2HD      LYS  81 -19.085   8.022  -2.186
  579    HD3  LYS  81           1HD      LYS  81 -18.627   9.672  -1.764
  580    HE2  LYS  81           2HE      LYS  81 -20.131  10.172  -3.381
  581    HE3  LYS  81           1HE      LYS  81 -18.729   9.931  -4.423
  582    HZ1  LYS  81           3HZ      LYS  81 -19.548   7.497  -4.475
  583    HZ2  LYS  81           1HZ      LYS  81 -20.343   8.649  -5.427
  584    HZ3  LYS  81           2HZ      LYS  81 -21.026   8.144  -3.965
  585    H    LEU  82           H        LEU  82 -12.277   9.121  -1.618
  586    HA   LEU  82           HA       LEU  82 -12.554  10.772   0.770
  587    HB2  LEU  82           2HB      LEU  82 -11.043   8.653   0.462
  588    HB3  LEU  82           1HB      LEU  82  -9.935   9.785  -0.289
  589    HG   LEU  82           HG       LEU  82 -11.011  10.469   2.406
  590   HD11  LEU  82          1HD1      LEU  82 -10.416   8.376   3.078
  591   HD12  LEU  82          2HD1      LEU  82  -8.847   9.172   3.193
  592   HD13  LEU  82          3HD1      LEU  82  -9.229   8.175   1.789
  593   HD21  LEU  82          3HD2      LEU  82  -9.596  12.067   1.282
  594   HD22  LEU  82          1HD2      LEU  82  -8.360  10.837   1.014
  595   HD23  LEU  82          2HD2      LEU  82  -8.724  11.380   2.652
  596    H    GLU  83           H        GLU  83 -12.888  12.854   0.170
  597    HA   GLU  83           HA       GLU  83 -11.050  14.049  -1.787
  598    HB2  GLU  83           2HB      GLU  83 -13.741  14.223  -1.710
  599    HB3  GLU  83           1HB      GLU  83 -13.327  15.634  -0.749
  600    HG2  GLU  83           2HG      GLU  83 -12.561  16.780  -2.516
  601    HG3  GLU  83           1HG      GLU  83 -11.802  15.363  -3.239
  602    H    HIS  84           H        HIS  84  -9.774  15.779  -1.288
  603    HA   HIS  84           HA       HIS  84  -9.561  16.439   1.572
  604    HB2  HIS  84           2HB      HIS  84  -7.233  17.149   1.029
  605    HB3  HIS  84           1HB      HIS  84  -7.530  15.444   0.720
  606    HD1  HIS  84           1HD      HIS  84  -6.733  18.659  -0.992
  607    HD2  HIS  84           2HD      HIS  84  -7.454  14.690  -1.993
  608    HE1  HIS  84           1HE      HIS  84  -6.021  18.431  -3.394
  609    HE2  HIS  84           2HE      HIS  84  -6.565  16.047  -4.006
  Start of MODEL    2
    1    H1   MET   1           1HT      MET   1  12.962  11.741   8.504
    2    H2   MET   1           2HT      MET   1  13.791  10.875   9.731
    3    H3   MET   1           3HT      MET   1  12.824  10.035   8.589
    4    HA   MET   1           HA       MET   1  14.330  11.019   6.856
    5    HB2  MET   1           2HB      MET   1  15.281  12.520   8.801
    6    HB3  MET   1           1HB      MET   1  16.324  11.133   9.089
    7    HG2  MET   1           2HG      MET   1  16.168  12.029   6.294
    8    HG3  MET   1           1HG      MET   1  16.907  13.170   7.416
    9    HE1  MET   1           2HE      MET   1  20.133  11.837   5.926
   10    HE2  MET   1           3HE      MET   1  18.918  13.113   5.959
   11    HE3  MET   1           1HE      MET   1  18.700  11.715   4.906
   12    H    ALA   2           H        ALA   2  14.770   9.013   9.752
   13    HA   ALA   2           HA       ALA   2  15.750   6.857   8.002
   14    HB1  ALA   2           1HB      ALA   2  16.871   7.844  10.578
   15    HB2  ALA   2           2HB      ALA   2  17.699   7.315   9.113
   16    HB3  ALA   2           3HB      ALA   2  16.985   6.125  10.202
   17    H    VAL   3           H        VAL   3  14.511   7.378  11.326
   18    HA   VAL   3           HA       VAL   3  13.452   4.778  11.608
   19    HB   VAL   3           HB       VAL   3  12.102   5.746  13.488
   20   HG11  VAL   3          1HG1      VAL   3  14.245   6.569  14.734
   21   HG12  VAL   3          2HG1      VAL   3  15.062   6.041  13.263
   22   HG13  VAL   3          3HG1      VAL   3  14.113   4.891  14.205
   23   HG21  VAL   3          3HG2      VAL   3  12.056   7.979  14.000
   24   HG22  VAL   3          1HG2      VAL   3  12.127   8.075  12.241
   25   HG23  VAL   3          2HG2      VAL   3  13.590   8.311  13.197
   26    H    PHE   4           H        PHE   4  11.447   3.918  11.261
   27    HA   PHE   4           HA       PHE   4   9.800   5.200   9.292
   28    HB2  PHE   4           2HB      PHE   4   9.890   2.541  10.617
   29    HB3  PHE   4           1HB      PHE   4   8.328   3.058   9.992
   30    HD1  PHE   4           2HD      PHE   4  11.895   3.000   8.872
   31    HD2  PHE   4           1HD      PHE   4   7.804   2.390   7.869
   32    HE1  PHE   4           2HE      PHE   4  12.560   2.272   6.619
   33    HE2  PHE   4           1HE      PHE   4   8.463   1.659   5.614
   34    HZ   PHE   4           HZ       PHE   4  10.842   1.599   4.986
   35    H    HIS   5           H        HIS   5   7.796   6.096   9.517
   36    HA   HIS   5           HA       HIS   5   7.110   7.258  11.990
   37    HB2  HIS   5           2HB      HIS   5   6.484   8.177   9.753
   38    HB3  HIS   5           1HB      HIS   5   5.314   6.873   9.583
   39    HD1  HIS   5           1HD      HIS   5   5.904  10.094  11.371
   40    HD2  HIS   5           2HD      HIS   5   2.978   7.158  11.108
   41    HE1  HIS   5           1HE      HIS   5   3.871  11.071  12.480
   42    HE2  HIS   5           2HE      HIS   5   2.154   9.226  12.421
   43    H    ASP   6           H        ASP   6   5.129   4.932  10.132
   44    HA   ASP   6           HA       ASP   6   4.704   3.254  12.418
   45    HB2  ASP   6           2HB      ASP   6   2.661   5.274  11.626
   46    HB3  ASP   6           1HB      ASP   6   2.082   3.666  12.047
   47    H    GLU   7           H        GLU   7   3.956   1.239  11.845
   48    HA   GLU   7           HA       GLU   7   3.852   0.696   8.991
   49    HB2  GLU   7           2HB      GLU   7   3.624  -1.317  11.231
   50    HB3  GLU   7           1HB      GLU   7   4.076  -1.616   9.560
   51    HG2  GLU   7           2HG      GLU   7   6.166  -1.595  10.338
   52    HG3  GLU   7           1HG      GLU   7   5.989   0.158  10.318
   53    H    VAL   8           H        VAL   8   2.075   0.102   7.862
   54    HA   VAL   8           HA       VAL   8  -0.430  -0.311   9.356
   55    HB   VAL   8           HB       VAL   8  -0.250   1.258   6.780
   56   HG11  VAL   8          1HG1      VAL   8  -2.384   0.006   7.452
   57   HG12  VAL   8          2HG1      VAL   8  -2.527   1.715   7.048
   58   HG13  VAL   8          3HG1      VAL   8  -2.525   1.207   8.736
   59   HG21  VAL   8          3HG2      VAL   8  -0.753   2.425   9.506
   60   HG22  VAL   8          1HG2      VAL   8  -0.423   3.270   7.994
   61   HG23  VAL   8          2HG2      VAL   8   0.856   2.355   8.790
   62    H    GLU   9           H        GLU   9  -1.828  -1.818   8.552
   63    HA   GLU   9           HA       GLU   9  -0.777  -3.846   6.879
   64    HB2  GLU   9           2HB      GLU   9  -3.477  -3.322   8.086
   65    HB3  GLU   9           1HB      GLU   9  -3.263  -4.624   6.927
   66    HG2  GLU   9           2HG      GLU   9  -1.520  -5.593   8.373
   67    HG3  GLU   9           1HG      GLU   9  -1.817  -4.314   9.549
   68    H    ILE  10           H        ILE  10  -1.143  -4.356   4.775
   69    HA   ILE  10           HA       ILE  10  -1.645  -2.338   2.922
   70    HB   ILE  10           HB       ILE  10  -0.398  -4.410   2.418
   71   HG12  ILE  10          2HG1      ILE  10  -1.439  -4.789   0.132
   72   HG13  ILE  10          1HG1      ILE  10  -2.720  -3.689   0.628
   73   HG21  ILE  10          1HG2      ILE  10  -3.128  -5.685   2.438
   74   HG22  ILE  10          2HG2      ILE  10  -1.764  -6.061   3.489
   75   HG23  ILE  10          3HG2      ILE  10  -1.679  -6.436   1.768
   76   HD11  ILE  10          3HD1      ILE  10  -0.022  -2.639   1.025
   77   HD12  ILE  10          1HD1      ILE  10  -1.446  -1.885   0.309
   78   HD13  ILE  10          2HD1      ILE  10  -0.443  -2.966  -0.656
   79    H    GLU  11           H        GLU  11  -3.867  -4.502   4.537
   80    HA   GLU  11           HA       GLU  11  -6.059  -4.359   2.807
   81    HB2  GLU  11           2HB      GLU  11  -5.743  -4.829   5.743
   82    HB3  GLU  11           1HB      GLU  11  -7.356  -4.565   5.096
   83    HG2  GLU  11           2HG      GLU  11  -5.741  -6.528   3.629
   84    HG3  GLU  11           1HG      GLU  11  -6.146  -6.974   5.286
   85    H    ASP  12           H        ASP  12  -4.858  -2.075   5.196
   86    HA   ASP  12           HA       ASP  12  -7.160  -0.375   5.147
   87    HB2  ASP  12           2HB      ASP  12  -4.389  -0.181   6.261
   88    HB3  ASP  12           1HB      ASP  12  -5.354   1.286   6.122
   89    H    PHE  13           H        PHE  13  -4.226  -0.631   3.261
   90    HA   PHE  13           HA       PHE  13  -4.224   1.937   2.093
   91    HB2  PHE  13           2HB      PHE  13  -3.042  -0.716   1.345
   92    HB3  PHE  13           1HB      PHE  13  -2.991   0.611   0.192
   93    HD1  PHE  13           1HD      PHE  13  -2.232  -0.023   3.798
   94    HD2  PHE  13           2HD      PHE  13  -1.122   1.931   0.183
   95    HE1  PHE  13           1HE      PHE  13  -0.206   0.846   4.892
   96    HE2  PHE  13           2HE      PHE  13   0.904   2.802   1.270
   97    HZ   PHE  13           HZ       PHE  13   1.364   2.259   3.629
   98    H    GLN  14           H        GLN  14  -4.451   2.134  -0.413
   99    HA   GLN  14           HA       GLN  14  -7.054   0.981  -1.183
  100    HB2  GLN  14           2HB      GLN  14  -6.914   3.498  -0.746
  101    HB3  GLN  14           1HB      GLN  14  -5.936   3.590  -2.203
  102    HG2  GLN  14           2HG      GLN  14  -7.705   3.404  -3.548
  103    HG3  GLN  14           1HG      GLN  14  -8.435   2.130  -2.573
  104   HE21  GLN  14          1HE2      GLN  14 -10.237   2.629  -1.540
  105   HE22  GLN  14          2HE2      GLN  14 -10.785   4.225  -1.165
  106    H    TYR  15           H        TYR  15  -6.774  -0.564  -2.677
  107    HA   TYR  15           HA       TYR  15  -4.459  -0.806  -4.286
  108    HB2  TYR  15           2HB      TYR  15  -5.838  -2.751  -3.704
  109    HB3  TYR  15           1HB      TYR  15  -7.175  -2.099  -4.644
  110    HD1  TYR  15           2HD      TYR  15  -3.623  -3.183  -5.002
  111    HD2  TYR  15           1HD      TYR  15  -7.414  -2.721  -6.878
  112    HE1  TYR  15           2HE      TYR  15  -2.770  -4.343  -6.993
  113    HE2  TYR  15           1HE      TYR  15  -6.572  -3.880  -8.877
  114    HH   TYR  15           HH       TYR  15  -3.901  -5.733  -8.943
  115    H    ASP  16           H        ASP  16  -3.913   0.254  -6.057
  116    HA   ASP  16           HA       ASP  16  -5.958   1.790  -7.490
  117    HB2  ASP  16           2HB      ASP  16  -3.720   2.769  -6.552
  118    HB3  ASP  16           1HB      ASP  16  -3.009   2.049  -7.992
  119    H    GLU  17           H        GLU  17  -6.864   0.217  -8.803
  120    HA   GLU  17           HA       GLU  17  -5.532  -1.730 -10.281
  121    HB2  GLU  17           2HB      GLU  17  -7.563  -1.616 -11.803
  122    HB3  GLU  17           1HB      GLU  17  -7.874  -1.935 -10.104
  123    HG2  GLU  17           2HG      GLU  17  -8.680   0.249  -9.737
  124    HG3  GLU  17           1HG      GLU  17  -8.049   0.824 -11.279
  125    H    ASP  18           H        ASP  18  -5.886   1.673 -10.900
  126    HA   ASP  18           HA       ASP  18  -5.558   1.933 -13.598
  127    HB2  ASP  18           2HB      ASP  18  -4.102   3.616 -11.549
  128    HB3  ASP  18           1HB      ASP  18  -4.517   4.087 -13.190
  129    H    SER  19           H        SER  19  -2.893   1.619 -11.232
  130    HA   SER  19           HA       SER  19  -1.264   0.388 -13.330
  131    HB2  SER  19           2HB      SER  19  -0.419   2.796 -11.703
  132    HB3  SER  19           1HB      SER  19   0.690   1.820 -12.664
  133    HG   SER  19           HG       SER  19  -0.704   3.847 -13.497
  134    H    GLU  20           H        GLU  20  -2.605  -0.568 -10.846
  135    HA   GLU  20           HA       GLU  20  -2.216  -1.889  -9.034
  136    HB2  GLU  20           2HB      GLU  20   0.396  -2.508 -10.416
  137    HB3  GLU  20           1HB      GLU  20  -0.460  -3.523  -9.263
  138    HG2  GLU  20           2HG      GLU  20  -1.844  -4.346 -10.821
  139    HG3  GLU  20           1HG      GLU  20  -2.021  -2.791 -11.633
  140    H    THR  21           H        THR  21  -1.948   0.297  -7.921
  141    HA   THR  21           HA       THR  21   0.584   0.249  -6.441
  142    HB   THR  21           HB       THR  21  -0.687   2.831  -7.374
  143    HG1  THR  21           1HG      THR  21   0.794   2.890  -8.984
  144   HG21  THR  21          3HG2      THR  21   2.151   2.488  -6.510
  145   HG22  THR  21          1HG2      THR  21   0.875   2.753  -5.323
  146   HG23  THR  21          2HG2      THR  21   1.172   3.952  -6.581
  147    H    TYR  22           H        TYR  22   0.439   1.024  -4.282
  148    HA   TYR  22           HA       TYR  22  -2.330   1.267  -3.294
  149    HB2  TYR  22           2HB      TYR  22   0.059   0.231  -1.756
  150    HB3  TYR  22           1HB      TYR  22  -1.615   0.247  -1.217
  151    HD1  TYR  22           2HD      TYR  22   0.617  -1.188  -3.827
  152    HD2  TYR  22           1HD      TYR  22  -3.005  -1.591  -1.628
  153    HE1  TYR  22           2HE      TYR  22   0.294  -3.427  -4.779
  154    HE2  TYR  22           1HE      TYR  22  -3.335  -3.834  -2.576
  155    HH   TYR  22           HH       TYR  22  -1.499  -5.684  -3.610
  156    H    PHE  23           H        PHE  23  -2.857   2.925  -1.928
  157    HA   PHE  23           HA       PHE  23  -0.704   4.818  -1.244
  158    HB2  PHE  23           2HB      PHE  23  -3.501   5.538  -2.147
  159    HB3  PHE  23           1HB      PHE  23  -2.241   6.676  -1.684
  160    HD1  PHE  23           1HD      PHE  23  -2.874   3.907  -4.102
  161    HD2  PHE  23           2HD      PHE  23  -0.927   7.613  -3.332
  162    HE1  PHE  23           1HE      PHE  23  -2.088   3.972  -6.429
  163    HE2  PHE  23           2HE      PHE  23  -0.138   7.684  -5.659
  164    HZ   PHE  23           HZ       PHE  23  -0.717   5.863  -7.212
  165    H    TYR  24           H        TYR  24  -1.035   6.121   0.633
  166    HA   TYR  24           HA       TYR  24  -3.130   5.170   2.466
  167    HB2  TYR  24           2HB      TYR  24  -0.862   4.126   2.932
  168    HB3  TYR  24           1HB      TYR  24  -0.303   5.740   3.360
  169    HD1  TYR  24           2HD      TYR  24  -3.284   3.605   4.138
  170    HD2  TYR  24           1HD      TYR  24  -0.205   6.140   5.626
  171    HE1  TYR  24           2HE      TYR  24  -4.136   3.288   6.421
  172    HE2  TYR  24           1HE      TYR  24  -1.050   5.829   7.915
  173    HH   TYR  24           HH       TYR  24  -3.053   3.436   8.831
  174    HA   PRO  25           HA       PRO  25  -3.998   9.521   2.858
  175    HB2  PRO  25           2HB      PRO  25  -5.116   8.728   5.488
  176    HB3  PRO  25           1HB      PRO  25  -5.885   9.585   4.149
  177    HG2  PRO  25           2HG      PRO  25  -6.485   7.039   4.662
  178    HG3  PRO  25           1HG      PRO  25  -6.356   7.630   2.995
  179    HD2  PRO  25           2HD      PRO  25  -4.405   6.018   4.591
  180    HD3  PRO  25           1HD      PRO  25  -4.853   5.875   2.878
  181    H    CYS  26           H        CYS  26  -2.571  11.024   3.443
  182    HA   CYS  26           HA       CYS  26  -0.999  10.612   5.891
  183    HB2  CYS  26           2HB      CYS  26  -0.159  11.186   3.317
  184    HB3  CYS  26           1HB      CYS  26  -0.096  12.751   4.120
  185    HA   PRO  27           HA       PRO  27  -3.102  13.997   7.820
  186    HB2  PRO  27           2HB      PRO  27  -1.190  14.737   9.615
  187    HB3  PRO  27           1HB      PRO  27  -2.213  13.311   9.815
  188    HG2  PRO  27           2HG      PRO  27   0.595  13.502   8.798
  189    HG3  PRO  27           1HG      PRO  27  -0.116  12.315   9.906
  190    HD2  PRO  27           2HD      PRO  27   0.303  11.776   7.295
  191    HD3  PRO  27           1HD      PRO  27  -1.072  11.099   8.194
  192    H    CYS  28           H        CYS  28  -0.060  14.381   6.195
  193    HA   CYS  28           HA       CYS  28   0.245  17.183   6.557
  194    HB2  CYS  28           2HB      CYS  28   1.874  17.041   4.739
  195    HB3  CYS  28           1HB      CYS  28   2.105  15.719   5.878
  196    H    GLY  29           H        GLY  29  -1.520  15.204   4.249
  197    HA2  GLY  29           2HA      GLY  29  -3.525  16.688   3.469
  198    HA3  GLY  29           1HA      GLY  29  -2.235  17.564   2.659
  199    H    ASP  30           H        ASP  30  -0.631  15.383   1.894
  200    HA   ASP  30           HA       ASP  30  -2.187  14.391  -0.351
  201    HB2  ASP  30           2HB      ASP  30   0.386  15.276  -0.138
  202    HB3  ASP  30           1HB      ASP  30   0.627  13.535  -0.066
  203    H    ASN  31           H        ASN  31  -0.905  11.994  -0.910
  204    HA   ASN  31           HA       ASN  31  -1.398  10.277   1.417
  205    HB2  ASN  31           2HB      ASN  31  -2.505   9.674  -1.335
  206    HB3  ASN  31           1HB      ASN  31  -2.765   8.751   0.140
  207   HD21  ASN  31          1HD2      ASN  31  -3.389  11.862  -1.403
  208   HD22  ASN  31          2HD2      ASN  31  -4.853  12.192  -0.546
  209    H    PHE  32           H        PHE  32  -0.056   8.545   1.571
  210    HA   PHE  32           HA       PHE  32   2.365   8.508   0.157
  211    HB2  PHE  32           2HB      PHE  32   0.997   6.638   2.042
  212    HB3  PHE  32           1HB      PHE  32   2.407   6.060   1.162
  213    HD1  PHE  32           1HD      PHE  32   4.537   7.494   1.312
  214    HD2  PHE  32           2HD      PHE  32   1.266   7.840   4.013
  215    HE1  PHE  32           1HE      PHE  32   6.019   8.550   2.967
  216    HE2  PHE  32           2HE      PHE  32   2.744   8.899   5.672
  217    HZ   PHE  32           HZ       PHE  32   5.124   9.254   5.149
  218    H    SER  33           H        SER  33   3.225   6.587  -1.082
  219    HA   SER  33           HA       SER  33   1.225   5.153  -2.645
  220    HB2  SER  33           2HB      SER  33   2.371   5.838  -4.789
  221    HB3  SER  33           1HB      SER  33   1.461   7.119  -3.991
  222    HG   SER  33           HG       SER  33   3.287   8.125  -3.475
  223    H    ILE  34           H        ILE  34   1.892   3.198  -3.371
  224    HA   ILE  34           HA       ILE  34   4.707   2.508  -3.478
  225    HB   ILE  34           HB       ILE  34   4.216   2.095  -1.121
  226   HG12  ILE  34          2HG1      ILE  34   4.263  -0.647  -2.327
  227   HG13  ILE  34          1HG1      ILE  34   5.585   0.466  -2.666
  228   HG21  ILE  34          1HG2      ILE  34   2.111   0.144  -2.043
  229   HG22  ILE  34          2HG2      ILE  34   1.770   1.755  -1.416
  230   HG23  ILE  34          3HG2      ILE  34   2.537   0.551  -0.381
  231   HD11  ILE  34          3HD1      ILE  34   4.880   0.288   0.160
  232   HD12  ILE  34          1HD1      ILE  34   6.456   0.228  -0.628
  233   HD13  ILE  34          2HD1      ILE  34   5.458  -1.222  -0.543
  234    H    THR  35           H        THR  35   5.013   1.248  -5.217
  235    HA   THR  35           HA       THR  35   2.797   0.262  -6.723
  236    HB   THR  35           HB       THR  35   4.483  -0.642  -8.261
  237    HG1  THR  35           1HG      THR  35   6.445   0.274  -6.438
  238   HG21  THR  35          3HG2      THR  35   4.861   1.351  -9.135
  239   HG22  THR  35          1HG2      THR  35   5.917   1.807  -7.796
  240   HG23  THR  35          2HG2      THR  35   4.175   2.057  -7.674
  241    H    LYS  36           H        LYS  36   2.237  -1.875  -7.222
  242    HA   LYS  36           HA       LYS  36   2.279  -3.690  -5.065
  243    HB2  LYS  36           2HB      LYS  36   0.570  -3.551  -6.948
  244    HB3  LYS  36           1HB      LYS  36   1.729  -4.423  -7.941
  245    HG2  LYS  36           2HG      LYS  36   0.946  -5.557  -5.299
  246    HG3  LYS  36           1HG      LYS  36  -0.167  -5.691  -6.662
  247    HD2  LYS  36           2HD      LYS  36   2.566  -6.389  -7.382
  248    HD3  LYS  36           1HD      LYS  36   1.933  -7.401  -6.084
  249    HE2  LYS  36           2HE      LYS  36   1.468  -8.403  -8.243
  250    HE3  LYS  36           1HE      LYS  36  -0.032  -7.914  -7.459
  251    HZ1  LYS  36           3HZ      LYS  36  -0.199  -7.246  -9.698
  252    HZ2  LYS  36           1HZ      LYS  36   1.354  -6.577  -9.712
  253    HZ3  LYS  36           2HZ      LYS  36   0.119  -5.829  -8.832
  254    H    GLU  37           H        GLU  37   4.260  -3.428  -7.973
  255    HA   GLU  37           HA       GLU  37   5.560  -5.912  -7.829
  256    HB2  GLU  37           2HB      GLU  37   5.602  -4.131  -9.704
  257    HB3  GLU  37           1HB      GLU  37   6.923  -3.410  -8.793
  258    HG2  GLU  37           2HG      GLU  37   7.696  -6.021  -8.924
  259    HG3  GLU  37           1HG      GLU  37   6.873  -5.807 -10.468
  260    H    ASP  38           H        ASP  38   6.240  -2.816  -6.263
  261    HA   ASP  38           HA       ASP  38   8.772  -3.346  -5.217
  262    HB2  ASP  38           2HB      ASP  38   6.522  -1.537  -4.490
  263    HB3  ASP  38           1HB      ASP  38   7.735  -1.825  -3.250
  264    H    LEU  39           H        LEU  39   5.563  -4.115  -3.945
  265    HA   LEU  39           HA       LEU  39   6.374  -5.143  -1.463
  266    HB2  LEU  39           2HB      LEU  39   3.997  -6.070  -3.069
  267    HB3  LEU  39           1HB      LEU  39   4.198  -6.156  -1.331
  268    HG   LEU  39           HG       LEU  39   4.024  -3.559  -2.858
  269   HD11  LEU  39          1HD1      LEU  39   1.930  -4.566  -3.196
  270   HD12  LEU  39          2HD1      LEU  39   1.708  -3.486  -1.819
  271   HD13  LEU  39          3HD1      LEU  39   1.887  -5.221  -1.560
  272   HD21  LEU  39          3HD2      LEU  39   4.026  -2.478  -0.845
  273   HD22  LEU  39          1HD2      LEU  39   5.082  -3.836  -0.462
  274   HD23  LEU  39          2HD2      LEU  39   3.390  -3.869   0.031
  275    H    GLU  40           H        GLU  40   5.828  -6.797  -4.585
  276    HA   GLU  40           HA       GLU  40   6.358  -9.400  -3.696
  277    HB2  GLU  40           2HB      GLU  40   6.817  -8.175  -6.418
  278    HB3  GLU  40           1HB      GLU  40   6.894  -9.899  -6.076
  279    HG2  GLU  40           2HG      GLU  40   4.537  -9.800  -5.313
  280    HG3  GLU  40           1HG      GLU  40   4.487  -8.113  -5.825
  281    H    ASN  41           H        ASN  41   8.546  -6.771  -4.373
  282    HA   ASN  41           HA       ASN  41  10.871  -8.525  -4.430
  283    HB2  ASN  41           2HB      ASN  41  10.363  -5.650  -5.006
  284    HB3  ASN  41           1HB      ASN  41  11.975  -6.089  -4.452
  285   HD21  ASN  41          1HD2      ASN  41  13.370  -6.890  -5.869
  286   HD22  ASN  41          2HD2      ASN  41  12.988  -7.364  -7.485
  287    H    GLY  42           H        GLY  42   9.367  -6.142  -2.292
  288    HA2  GLY  42           2HA      GLY  42   9.754  -6.861   0.133
  289    HA3  GLY  42           1HA      GLY  42  11.454  -6.670  -0.272
  290    H    GLU  43           H        GLU  43   9.923  -4.332  -2.011
  291    HA   GLU  43           HA       GLU  43  10.774  -2.246  -0.249
  292    HB2  GLU  43           2HB      GLU  43   9.557  -2.366  -2.980
  293    HB3  GLU  43           1HB      GLU  43   9.546  -0.841  -2.108
  294    HG2  GLU  43           2HG      GLU  43  11.990  -2.468  -2.758
  295    HG3  GLU  43           1HG      GLU  43  11.453  -1.021  -3.614
  296    H    ASP  44           H        ASP  44   9.394  -2.866   1.540
  297    HA   ASP  44           HA       ASP  44   6.539  -2.336   1.315
  298    HB2  ASP  44           2HB      ASP  44   8.207  -3.107   3.725
  299    HB3  ASP  44           1HB      ASP  44   6.452  -3.037   3.672
  300    H    VAL  45           H        VAL  45   8.317  -0.093   0.842
  301    HA   VAL  45           HA       VAL  45   7.584   1.597   3.139
  302    HB   VAL  45           HB       VAL  45  10.013   1.251   3.123
  303   HG11  VAL  45          1HG1      VAL  45   9.952   1.090   0.488
  304   HG12  VAL  45          2HG1      VAL  45  11.402   1.614   1.346
  305   HG13  VAL  45          3HG1      VAL  45  10.333   2.807   0.611
  306   HG21  VAL  45          3HG2      VAL  45   9.797   4.067   2.221
  307   HG22  VAL  45          1HG2      VAL  45  10.510   3.396   3.688
  308   HG23  VAL  45          2HG2      VAL  45   8.759   3.568   3.556
  309    H    ALA  46           H        ALA  46   6.514   3.426   2.727
  310    HA   ALA  46           HA       ALA  46   6.155   4.200  -0.094
  311    HB1  ALA  46           1HB      ALA  46   4.173   5.228   1.785
  312    HB2  ALA  46           2HB      ALA  46   4.215   3.468   1.702
  313    HB3  ALA  46           3HB      ALA  46   3.953   4.412   0.237
  314    H    THR  47           H        THR  47   6.436   6.322  -0.682
  315    HA   THR  47           HA       THR  47   7.337   8.160   1.439
  316    HB   THR  47           HB       THR  47   8.361   8.237  -1.395
  317    HG1  THR  47           1HG      THR  47   9.374   6.762   0.802
  318   HG21  THR  47          3HG2      THR  47   9.914   9.070   1.001
  319   HG22  THR  47          1HG2      THR  47   8.679  10.148   0.353
  320   HG23  THR  47          2HG2      THR  47  10.020   9.630  -0.667
  321    H    CYS  48           H        CYS  48   6.397  10.108   1.522
  322    HA   CYS  48           HA       CYS  48   4.248  10.664  -0.345
  323    HB2  CYS  48           2HB      CYS  48   4.480  11.056   2.343
  324    HB3  CYS  48           1HB      CYS  48   4.858  12.664   1.735
  325    HA   PRO  49           HA       PRO  49   6.696  13.489  -2.745
  326    HB2  PRO  49           2HB      PRO  49   4.722  14.689  -4.134
  327    HB3  PRO  49           1HB      PRO  49   5.210  13.016  -4.439
  328    HG2  PRO  49           2HG      PRO  49   2.886  14.055  -2.865
  329    HG3  PRO  49           1HG      PRO  49   2.946  12.704  -4.009
  330    HD2  PRO  49           2HD      PRO  49   3.023  12.386  -1.301
  331    HD3  PRO  49           1HD      PRO  49   3.778  11.253  -2.439
  332    H    SER  50           H        SER  50   4.612  14.438  -0.247
  333    HA   SER  50           HA       SER  50   5.296  17.275  -0.609
  334    HB2  SER  50           2HB      SER  50   3.411  17.747   0.936
  335    HB3  SER  50           1HB      SER  50   2.893  16.893  -0.517
  336    HG   SER  50           HG       SER  50   2.604  15.067   0.643
  337    H    CYS  51           H        CYS  51   4.558  15.184   2.204
  338    HA   CYS  51           HA       CYS  51   6.335  16.647   3.893
  339    HB2  CYS  51           2HB      CYS  51   5.776  15.014   5.605
  340    HB3  CYS  51           1HB      CYS  51   4.318  15.517   4.758
  341    H    SER  52           H        SER  52   6.675  13.797   1.906
  342    HA   SER  52           HA       SER  52   8.461  12.507   1.362
  343    HB2  SER  52           2HB      SER  52   9.547  14.810   1.192
  344    HB3  SER  52           1HB      SER  52  10.218  14.504   2.792
  345    HG   SER  52           HG       SER  52  11.136  13.683   0.444
  346    H    LEU  53           H        LEU  53   7.041  11.796   3.616
  347    HA   LEU  53           HA       LEU  53   9.011  11.028   5.638
  348    HB2  LEU  53           2HB      LEU  53   6.036  11.201   5.534
  349    HB3  LEU  53           1HB      LEU  53   6.748  10.035   6.632
  350    HG   LEU  53           HG       LEU  53   7.696  12.868   6.718
  351   HD11  LEU  53          1HD1      LEU  53   5.831  12.977   8.605
  352   HD12  LEU  53          2HD1      LEU  53   5.012  11.880   7.492
  353   HD13  LEU  53          3HD1      LEU  53   5.521  13.477   6.943
  354   HD21  LEU  53          3HD2      LEU  53   8.940  11.619   8.183
  355   HD22  LEU  53          1HD2      LEU  53   7.618  10.502   8.526
  356   HD23  LEU  53          2HD2      LEU  53   7.615  12.116   9.236
  357    H    ILE  54           H        ILE  54   8.282   8.690   6.597
  358    HA   ILE  54           HA       ILE  54   8.123   6.840   4.309
  359    HB   ILE  54           HB       ILE  54   9.707   5.331   5.525
  360   HG12  ILE  54          2HG1      ILE  54  10.271   7.806   7.177
  361   HG13  ILE  54          1HG1      ILE  54   9.454   6.362   7.764
  362   HG21  ILE  54          1HG2      ILE  54  11.495   6.188   4.418
  363   HG22  ILE  54          2HG2      ILE  54  11.237   7.821   5.032
  364   HG23  ILE  54          3HG2      ILE  54  10.240   7.205   3.714
  365   HD11  ILE  54          3HD1      ILE  54  12.096   5.924   6.551
  366   HD12  ILE  54          1HD1      ILE  54  11.371   5.215   7.993
  367   HD13  ILE  54          2HD1      ILE  54  12.077   6.829   8.065
  368    H    ILE  55           H        ILE  55   7.002   4.946   4.625
  369    HA   ILE  55           HA       ILE  55   5.899   4.378   7.274
  370    HB   ILE  55           HB       ILE  55   3.630   4.004   6.306
  371   HG12  ILE  55          2HG1      ILE  55   4.247   5.814   4.032
  372   HG13  ILE  55          1HG1      ILE  55   4.780   4.144   3.879
  373   HG21  ILE  55          1HG2      ILE  55   4.698   6.819   6.173
  374   HG22  ILE  55          2HG2      ILE  55   4.078   5.991   7.601
  375   HG23  ILE  55          3HG2      ILE  55   2.993   6.382   6.267
  376   HD11  ILE  55          3HD1      ILE  55   2.744   3.565   3.260
  377   HD12  ILE  55          1HD1      ILE  55   2.200   5.230   3.461
  378   HD13  ILE  55          2HD1      ILE  55   2.113   4.105   4.815
  379    H    LYS  56           H        LYS  56   5.408   2.215   7.631
  380    HA   LYS  56           HA       LYS  56   6.524   0.380   5.656
  381    HB2  LYS  56           2HB      LYS  56   6.842   0.480   8.348
  382    HB3  LYS  56           1HB      LYS  56   5.536  -0.690   8.225
  383    HG2  LYS  56           2HG      LYS  56   8.027  -0.976   6.589
  384    HG3  LYS  56           1HG      LYS  56   7.947  -1.549   8.256
  385    HD2  LYS  56           2HD      LYS  56   5.954  -2.902   7.631
  386    HD3  LYS  56           1HD      LYS  56   6.194  -2.410   5.955
  387    HE2  LYS  56           2HE      LYS  56   7.974  -3.776   5.667
  388    HE3  LYS  56           1HE      LYS  56   8.554  -3.542   7.316
  389    HZ1  LYS  56           3HZ      LYS  56   7.826  -5.803   6.997
  390    HZ2  LYS  56           1HZ      LYS  56   6.298  -5.289   6.482
  391    HZ3  LYS  56           2HZ      LYS  56   6.783  -5.031   8.082
  392    H    VAL  57           H        VAL  57   5.451  -1.097   4.566
  393    HA   VAL  57           HA       VAL  57   2.534  -1.143   4.893
  394    HB   VAL  57           HB       VAL  57   3.732  -2.266   2.426
  395   HG11  VAL  57          1HG1      VAL  57   1.403  -0.478   3.067
  396   HG12  VAL  57          2HG1      VAL  57   1.353  -2.200   2.689
  397   HG13  VAL  57          3HG1      VAL  57   1.810  -1.035   1.446
  398   HG21  VAL  57          3HG2      VAL  57   4.161   0.541   3.274
  399   HG22  VAL  57          1HG2      VAL  57   3.601   0.289   1.620
  400   HG23  VAL  57          2HG2      VAL  57   5.095  -0.467   2.170
  401    H    ILE  58           H        ILE  58   1.807  -2.868   5.947
  402    HA   ILE  58           HA       ILE  58   3.325  -5.365   5.890
  403    HB   ILE  58           HB       ILE  58   0.843  -4.781   7.504
  404   HG12  ILE  58          2HG1      ILE  58   2.605  -3.133   8.032
  405   HG13  ILE  58          1HG1      ILE  58   2.304  -4.227   9.377
  406   HG21  ILE  58          1HG2      ILE  58   1.650  -7.169   7.113
  407   HG22  ILE  58          2HG2      ILE  58   1.384  -6.669   8.782
  408   HG23  ILE  58          3HG2      ILE  58   3.022  -6.748   8.136
  409   HD11  ILE  58          3HD1      ILE  58   4.670  -3.825   9.116
  410   HD12  ILE  58          1HD1      ILE  58   4.604  -4.377   7.443
  411   HD13  ILE  58          2HD1      ILE  58   4.298  -5.511   8.759
  412    H    TYR  59           H        TYR  59   2.640  -7.205   4.921
  413    HA   TYR  59           HA       TYR  59  -0.097  -7.599   4.109
  414    HB2  TYR  59           2HB      TYR  59   0.456  -7.830   1.679
  415    HB3  TYR  59           1HB      TYR  59   0.615  -6.177   2.273
  416    HD1  TYR  59           2HD      TYR  59   2.516  -9.205   1.336
  417    HD2  TYR  59           1HD      TYR  59   2.697  -5.039   2.185
  418    HE1  TYR  59           2HE      TYR  59   4.839  -9.149   0.547
  419    HE2  TYR  59           1HE      TYR  59   5.023  -4.971   1.401
  420    HH   TYR  59           HH       TYR  59   6.902  -6.496   1.076
  421    H    ASP  60           H        ASP  60  -0.005  -9.678   2.460
  422    HA   ASP  60           HA       ASP  60   1.376 -11.700   4.020
  423    HB2  ASP  60           2HB      ASP  60  -1.067 -11.837   3.196
  424    HB3  ASP  60           1HB      ASP  60  -0.374 -12.241   1.627
  425    H    LYS  61           H        LYS  61   3.523 -11.576   3.475
  426    HA   LYS  61           HA       LYS  61   4.573 -11.240   0.906
  427    HB2  LYS  61           2HB      LYS  61   5.699 -12.521   3.387
  428    HB3  LYS  61           1HB      LYS  61   6.627 -12.403   1.897
  429    HG2  LYS  61           2HG      LYS  61   5.776  -9.845   2.179
  430    HG3  LYS  61           1HG      LYS  61   5.947 -10.341   3.864
  431    HD2  LYS  61           2HD      LYS  61   8.109  -9.809   3.607
  432    HD3  LYS  61           1HD      LYS  61   8.234 -11.334   2.729
  433    HE2  LYS  61           2HE      LYS  61   7.745  -8.605   1.539
  434    HE3  LYS  61           1HE      LYS  61   9.232  -9.544   1.433
  435    HZ1  LYS  61           3HZ      LYS  61   8.256 -10.034  -0.559
  436    HZ2  LYS  61           1HZ      LYS  61   6.678  -9.945   0.044
  437    HZ3  LYS  61           2HZ      LYS  61   7.634 -11.297   0.377
  438    H    ASP  62           H        ASP  62   3.332 -14.096   2.505
  439    HA   ASP  62           HA       ASP  62   4.498 -16.034   0.813
  440    HB2  ASP  62           2HB      ASP  62   3.126 -16.252   3.078
  441    HB3  ASP  62           1HB      ASP  62   1.781 -16.492   1.967
  442    H    GLN  63           H        GLN  63   1.558 -14.095   0.579
  443    HA   GLN  63           HA       GLN  63   0.601 -15.469  -1.766
  444    HB2  GLN  63           2HB      GLN  63  -0.283 -13.126  -0.147
  445    HB3  GLN  63           1HB      GLN  63  -0.882 -13.268  -1.793
  446    HG2  GLN  63           2HG      GLN  63  -1.078 -15.738  -0.248
  447    HG3  GLN  63           1HG      GLN  63  -2.016 -14.400   0.411
  448   HE21  GLN  63          1HE2      GLN  63  -3.751 -13.596  -0.739
  449   HE22  GLN  63          2HE2      GLN  63  -4.413 -14.400  -2.116
  450    H    PHE  64           H        PHE  64   2.436 -12.534  -1.099
  451    HA   PHE  64           HA       PHE  64   2.311 -11.541  -3.779
  452    HB2  PHE  64           2HB      PHE  64   3.795 -10.791  -1.298
  453    HB3  PHE  64           1HB      PHE  64   4.379 -10.177  -2.841
  454    HD1  PHE  64           2HD      PHE  64   1.388 -10.321  -0.653
  455    HD2  PHE  64           1HD      PHE  64   3.359  -8.345  -3.865
  456    HE1  PHE  64           2HE      PHE  64  -0.294  -8.527  -0.576
  457    HE2  PHE  64           1HE      PHE  64   1.683  -6.549  -3.795
  458    HZ   PHE  64           HZ       PHE  64  -0.148  -6.637  -2.149
  459    H    VAL  65           H        VAL  65   4.762 -13.315  -1.904
  460    HA   VAL  65           HA       VAL  65   6.597 -13.391  -4.129
  461    HB   VAL  65           HB       VAL  65   6.738 -14.982  -1.561
  462   HG11  VAL  65          1HG1      VAL  65   8.774 -14.323  -3.685
  463   HG12  VAL  65          2HG1      VAL  65   8.203 -15.917  -3.187
  464   HG13  VAL  65          3HG1      VAL  65   9.196 -14.954  -2.092
  465   HG21  VAL  65          3HG2      VAL  65   6.612 -12.439  -1.336
  466   HG22  VAL  65          1HG2      VAL  65   8.199 -12.414  -2.107
  467   HG23  VAL  65          2HG2      VAL  65   7.975 -13.255  -0.573
  468    H    SER  66           H        SER  66   5.202 -14.367  -5.694
  469    HA   SER  66           HA       SER  66   5.108 -17.297  -5.435
  470    HB2  SER  66           2HB      SER  66   2.839 -16.253  -5.156
  471    HB3  SER  66           1HB      SER  66   2.982 -15.633  -6.801
  472    HG   SER  66           HG       SER  66   2.570 -18.234  -5.904
  473    H    GLY  67           H        GLY  67   7.093 -15.543  -6.710
  474    HA2  GLY  67           2HA      GLY  67   6.709 -15.573  -9.536
  475    HA3  GLY  67           1HA      GLY  67   8.230 -15.299  -8.699
  476    H    GLU  68           H        GLU  68   8.405 -17.720  -7.284
  477    HA   GLU  68           HA       GLU  68   9.022 -19.548  -9.493
  478    HB2  GLU  68           2HB      GLU  68  10.663 -18.716  -7.582
  479    HB3  GLU  68           1HB      GLU  68   9.946 -20.057  -6.701
  480    HG2  GLU  68           2HG      GLU  68  10.905 -21.629  -8.028
  481    HG3  GLU  68           1HG      GLU  68  10.908 -20.587  -9.450
  482    H    THR  69           H        THR  69   6.299 -19.253  -8.483
  483    HA   THR  69           HA       THR  69   5.830 -22.050  -7.768
  484    HB   THR  69           HB       THR  69   4.432 -19.746  -6.394
  485    HG1  THR  69           1HG      THR  69   6.298 -19.736  -5.367
  486   HG21  THR  69          3HG2      THR  69   4.185 -21.991  -4.827
  487   HG22  THR  69          1HG2      THR  69   3.924 -22.595  -6.464
  488   HG23  THR  69          2HG2      THR  69   2.933 -21.277  -5.841
  489    H    VAL  70           H        VAL  70   4.837 -22.714  -9.577
  490    HA   VAL  70           HA       VAL  70   3.221 -23.022 -11.136
  491    HB   VAL  70           HB       VAL  70   1.705 -20.970  -9.533
  492   HG11  VAL  70          1HG1      VAL  70   0.866 -21.221 -11.850
  493   HG12  VAL  70          2HG1      VAL  70  -0.293 -21.758 -10.635
  494   HG13  VAL  70          3HG1      VAL  70   0.639 -22.945 -11.548
  495   HG21  VAL  70          3HG2      VAL  70   0.475 -23.136  -8.820
  496   HG22  VAL  70          1HG2      VAL  70   2.022 -22.735  -8.073
  497   HG23  VAL  70          2HG2      VAL  70   1.948 -23.944  -9.355
  498    HA   PRO  71           HA       PRO  71   4.243 -20.078 -14.291
  499    HB2  PRO  71           2HB      PRO  71   1.692 -20.910 -15.566
  500    HB3  PRO  71           1HB      PRO  71   3.336 -20.933 -16.213
  501    HG2  PRO  71           2HG      PRO  71   2.132 -23.192 -15.477
  502    HG3  PRO  71           1HG      PRO  71   3.860 -22.937 -15.172
  503    HD2  PRO  71           2HD      PRO  71   1.552 -22.758 -13.280
  504    HD3  PRO  71           1HD      PRO  71   3.178 -23.419 -13.015
  505    H    ALA  72           H        ALA  72   3.595 -18.058 -15.155
  506    HA   ALA  72           HA       ALA  72   1.005 -16.952 -14.594
  507    HB1  ALA  72           1HB      ALA  72   1.885 -16.691 -12.388
  508    HB2  ALA  72           2HB      ALA  72   1.878 -15.102 -13.154
  509    HB3  ALA  72           3HB      ALA  72   3.386 -16.004 -13.009
  510    HA   PRO  73           HA       PRO  73   2.148 -14.409 -18.033
  511    HB2  PRO  73           2HB      PRO  73   0.530 -12.258 -17.648
  512    HB3  PRO  73           1HB      PRO  73  -0.069 -13.822 -18.214
  513    HG2  PRO  73           2HG      PRO  73  -0.128 -12.652 -15.460
  514    HG3  PRO  73           1HG      PRO  73  -1.391 -13.548 -16.324
  515    HD2  PRO  73           2HD      PRO  73   0.190 -14.692 -14.443
  516    HD3  PRO  73           1HD      PRO  73  -0.453 -15.593 -15.830
  517    H    SER  74           H        SER  74   3.200 -12.430 -18.630
  518    HA   SER  74           HA       SER  74   4.727 -11.266 -16.418
  519    HB2  SER  74           2HB      SER  74   5.204 -11.357 -19.400
  520    HB3  SER  74           1HB      SER  74   6.185 -10.382 -18.305
  521    HG   SER  74           HG       SER  74   6.017 -13.164 -18.560
  522    H    ALA  75           H        ALA  75   2.765 -10.030 -15.827
  523    HA   ALA  75           HA       ALA  75   1.725  -8.022 -15.598
  524    HB1  ALA  75           1HB      ALA  75   4.190  -7.297 -16.267
  525    HB2  ALA  75           2HB      ALA  75   2.883  -6.128 -16.080
  526    HB3  ALA  75           3HB      ALA  75   3.347  -6.684 -17.688
  527    H    ASN  76           H        ASN  76   0.262  -6.521 -16.695
  528    HA   ASN  76           HA       ASN  76  -0.713  -7.631 -19.243
  529    HB2  ASN  76           2HB      ASN  76  -2.116  -6.747 -16.777
  530    HB3  ASN  76           1HB      ASN  76  -2.899  -6.387 -18.314
  531   HD21  ASN  76          1HD2      ASN  76  -3.937  -7.977 -19.373
  532   HD22  ASN  76          2HD2      ASN  76  -3.981  -9.627 -18.867
  533    H    LYS  77           H        LYS  77  -1.424  -6.233 -20.851
  534    HA   LYS  77           HA       LYS  77  -0.815  -3.380 -20.455
  535    HB2  LYS  77           2HB      LYS  77   0.780  -4.978 -21.924
  536    HB3  LYS  77           1HB      LYS  77  -0.389  -4.532 -23.159
  537    HG2  LYS  77           2HG      LYS  77   1.303  -2.654 -21.520
  538    HG3  LYS  77           1HG      LYS  77   1.491  -3.033 -23.234
  539    HD2  LYS  77           2HD      LYS  77  -1.059  -2.214 -23.251
  540    HD3  LYS  77           1HD      LYS  77  -0.470  -1.278 -21.874
  541    HE2  LYS  77           2HE      LYS  77   0.101   0.200 -23.482
  542    HE3  LYS  77           1HE      LYS  77   1.525  -0.831 -23.615
  543    HZ1  LYS  77           3HZ      LYS  77   0.717  -1.838 -25.523
  544    HZ2  LYS  77           1HZ      LYS  77   0.252  -0.226 -25.738
  545    HZ3  LYS  77           2HZ      LYS  77  -0.884  -1.374 -25.234
  546    H    GLU  78           H        GLU  78  -3.003  -2.869 -20.179
  547    HA   GLU  78           HA       GLU  78  -4.489  -2.681 -22.665
  548    HB2  GLU  78           2HB      GLU  78  -5.065  -4.858 -21.243
  549    HB3  GLU  78           1HB      GLU  78  -6.069  -3.715 -20.360
  550    HG2  GLU  78           2HG      GLU  78  -7.157  -3.087 -22.489
  551    HG3  GLU  78           1HG      GLU  78  -6.208  -4.331 -23.304
  552    H    LEU  79           H        LEU  79  -5.075  -0.624 -22.797
  553    HA   LEU  79           HA       LEU  79  -6.365   0.672 -20.543
  554    HB2  LEU  79           2HB      LEU  79  -4.899   2.672 -20.693
  555    HB3  LEU  79           1HB      LEU  79  -4.087   1.244 -20.078
  556    HG   LEU  79           HG       LEU  79  -3.862   1.808 -22.994
  557   HD11  LEU  79          1HD1      LEU  79  -3.477   3.931 -21.450
  558   HD12  LEU  79          2HD1      LEU  79  -2.447   3.579 -22.838
  559   HD13  LEU  79          3HD1      LEU  79  -1.911   3.154 -21.212
  560   HD21  LEU  79          3HD2      LEU  79  -1.596   1.078 -21.219
  561   HD22  LEU  79          1HD2      LEU  79  -1.968   0.548 -22.860
  562   HD23  LEU  79          2HD2      LEU  79  -2.850  -0.131 -21.493
  563    H    VAL  80           H        VAL  80  -7.270  -0.209 -23.125
  564    HA   VAL  80           HA       VAL  80  -7.801   2.352 -24.470
  565    HB   VAL  80           HB       VAL  80  -6.722   0.676 -25.900
  566   HG11  VAL  80          1HG1      VAL  80  -7.620  -1.333 -24.771
  567   HG12  VAL  80          2HG1      VAL  80  -7.818  -1.384 -26.522
  568   HG13  VAL  80          3HG1      VAL  80  -9.195  -1.003 -25.489
  569   HG21  VAL  80          3HG2      VAL  80  -9.542   0.881 -26.880
  570   HG22  VAL  80          1HG2      VAL  80  -8.030   1.059 -27.771
  571   HG23  VAL  80          2HG2      VAL  80  -8.561   2.332 -26.672
  572    H    LYS  81           H        LYS  81  -9.794   3.169 -24.441
  573    HA   LYS  81           HA       LYS  81 -12.007   3.451 -24.022
  574    HB2  LYS  81           2HB      LYS  81 -12.132   0.514 -24.734
  575    HB3  LYS  81           1HB      LYS  81 -13.529   1.569 -24.575
  576    HG2  LYS  81           2HG      LYS  81 -11.397   2.430 -26.440
  577    HG3  LYS  81           1HG      LYS  81 -12.372   1.037 -26.911
  578    HD2  LYS  81           2HD      LYS  81 -14.356   2.636 -26.175
  579    HD3  LYS  81           1HD      LYS  81 -13.166   3.884 -26.546
  580    HE2  LYS  81           2HE      LYS  81 -14.639   3.319 -28.461
  581    HE3  LYS  81           1HE      LYS  81 -12.927   3.071 -28.794
  582    HZ1  LYS  81           3HZ      LYS  81 -14.472   0.789 -27.802
  583    HZ2  LYS  81           1HZ      LYS  81 -13.176   0.825 -28.889
  584    HZ3  LYS  81           2HZ      LYS  81 -14.724   1.272 -29.403
  585    H    LEU  82           H        LEU  82 -11.639   3.904 -21.814
  586    HA   LEU  82           HA       LEU  82 -11.995   1.709 -19.915
  587    HB2  LEU  82           2HB      LEU  82 -10.964   4.502 -19.746
  588    HB3  LEU  82           1HB      LEU  82 -11.641   3.780 -18.300
  589    HG   LEU  82           HG       LEU  82  -9.179   3.571 -18.437
  590   HD11  LEU  82          1HD1      LEU  82  -9.920   1.958 -17.028
  591   HD12  LEU  82          2HD1      LEU  82  -9.290   0.912 -18.300
  592   HD13  LEU  82          3HD1      LEU  82 -11.017   1.260 -18.219
  593   HD21  LEU  82          3HD2      LEU  82  -9.304   3.242 -21.002
  594   HD22  LEU  82          1HD2      LEU  82  -9.545   1.541 -20.607
  595   HD23  LEU  82          2HD2      LEU  82  -8.077   2.368 -20.086
  596    H    GLU  83           H        GLU  83 -13.859   1.325 -18.905
  597    HA   GLU  83           HA       GLU  83 -16.033   3.283 -19.193
  598    HB2  GLU  83           2HB      GLU  83 -17.567   1.414 -18.822
  599    HB3  GLU  83           1HB      GLU  83 -16.472   1.067 -20.154
  600    HG2  GLU  83           2HG      GLU  83 -15.062  -0.203 -18.465
  601    HG3  GLU  83           1HG      GLU  83 -16.438  -0.066 -17.374
  602    H    HIS  84           H        HIS  84 -17.689   3.160 -17.341
  603    HA   HIS  84           HA       HIS  84 -16.447   2.727 -14.729
  604    HB2  HIS  84           2HB      HIS  84 -16.224   5.183 -15.628
  605    HB3  HIS  84           1HB      HIS  84 -17.920   5.303 -15.169
  606    HD1  HIS  84           1HD      HIS  84 -18.456   5.472 -12.686
  607    HD2  HIS  84           2HD      HIS  84 -14.424   4.824 -13.457
  608    HE1  HIS  84           1HE      HIS  84 -17.284   5.837 -10.491
  609    HE2  HIS  84           2HE      HIS  84 -14.859   5.342 -10.961
  Start of MODEL    3
    1    H1   MET   1           1HT      MET   1  12.897  10.718  15.876
    2    H2   MET   1           2HT      MET   1  13.537   9.129  15.778
    3    H3   MET   1           3HT      MET   1  12.380   9.662  14.628
    4    HA   MET   1           HA       MET   1  13.867  11.196  13.709
    5    HB2  MET   1           2HB      MET   1  15.445  10.485  16.153
    6    HB3  MET   1           1HB      MET   1  16.301  11.022  14.713
    7    HG2  MET   1           2HG      MET   1  15.032  13.096  14.711
    8    HG3  MET   1           1HG      MET   1  14.133  12.559  16.129
    9    HE1  MET   1           2HE      MET   1  17.196  15.080  15.479
   10    HE2  MET   1           3HE      MET   1  17.191  13.617  14.494
   11    HE3  MET   1           1HE      MET   1  18.436  13.849  15.721
   12    H    ALA   2           H        ALA   2  14.470  10.344  11.838
   13    HA   ALA   2           HA       ALA   2  15.133   8.861  10.250
   14    HB1  ALA   2           1HB      ALA   2  17.150   8.467  12.419
   15    HB2  ALA   2           2HB      ALA   2  17.339   9.208  10.830
   16    HB3  ALA   2           3HB      ALA   2  17.201   7.456  10.974
   17    H    VAL   3           H        VAL   3  12.934   8.026  11.853
   18    HA   VAL   3           HA       VAL   3  13.232   5.110  11.611
   19    HB   VAL   3           HB       VAL   3  11.710   4.818  13.562
   20   HG11  VAL   3          1HG1      VAL   3  14.384   5.036  13.558
   21   HG12  VAL   3          2HG1      VAL   3  13.443   4.650  14.998
   22   HG13  VAL   3          3HG1      VAL   3  13.983   6.305  14.716
   23   HG21  VAL   3          3HG2      VAL   3  11.710   6.842  15.168
   24   HG22  VAL   3          1HG2      VAL   3  10.568   6.823  13.824
   25   HG23  VAL   3          2HG2      VAL   3  12.037   7.791  13.718
   26    H    PHE   4           H        PHE   4  11.251   3.971  11.154
   27    HA   PHE   4           HA       PHE   4   9.623   5.241   9.243
   28    HB2  PHE   4           2HB      PHE   4   9.622   2.600  10.619
   29    HB3  PHE   4           1HB      PHE   4   8.129   3.096   9.833
   30    HD1  PHE   4           1HD      PHE   4  11.741   3.406   8.899
   31    HD2  PHE   4           2HD      PHE   4   7.865   1.993   7.856
   32    HE1  PHE   4           1HE      PHE   4  12.616   2.608   6.742
   33    HE2  PHE   4           2HE      PHE   4   8.730   1.194   5.699
   34    HZ   PHE   4           HZ       PHE   4  11.108   1.500   5.137
   35    H    HIS   5           H        HIS   5   7.613   6.149   9.325
   36    HA   HIS   5           HA       HIS   5   6.730   7.364  11.685
   37    HB2  HIS   5           2HB      HIS   5   6.174   8.135   9.382
   38    HB3  HIS   5           1HB      HIS   5   5.075   6.769   9.219
   39    HD1  HIS   5           1HD      HIS   5   5.467   9.280  12.057
   40    HD2  HIS   5           2HD      HIS   5   2.606   7.852   9.404
   41    HE1  HIS   5           1HE      HIS   5   3.324  10.425  12.700
   42    HE2  HIS   5           2HE      HIS   5   1.623   9.605  11.030
   43    H    ASP   6           H        ASP   6   5.008   4.795   9.892
   44    HA   ASP   6           HA       ASP   6   4.492   3.299  12.279
   45    HB2  ASP   6           2HB      ASP   6   2.452   5.176  11.232
   46    HB3  ASP   6           1HB      ASP   6   1.875   3.559  11.622
   47    H    GLU   7           H        GLU   7   3.241   1.324  11.841
   48    HA   GLU   7           HA       GLU   7   3.602   0.457   9.052
   49    HB2  GLU   7           2HB      GLU   7   3.244  -1.277  11.503
   50    HB3  GLU   7           1HB      GLU   7   3.693  -1.810   9.890
   51    HG2  GLU   7           2HG      GLU   7   5.849  -1.275  10.173
   52    HG3  GLU   7           1HG      GLU   7   5.478   0.198  11.067
   53    H    VAL   8           H        VAL   8   1.897  -0.215   7.851
   54    HA   VAL   8           HA       VAL   8  -0.665  -0.707   9.192
   55    HB   VAL   8           HB       VAL   8  -0.468   1.046   6.742
   56   HG11  VAL   8          1HG1      VAL   8  -2.764   1.367   6.933
   57   HG12  VAL   8          2HG1      VAL   8  -2.802   0.813   8.607
   58   HG13  VAL   8          3HG1      VAL   8  -2.567  -0.346   7.300
   59   HG21  VAL   8          3HG2      VAL   8  -0.949   1.911   9.593
   60   HG22  VAL   8          1HG2      VAL   8  -0.930   2.947   8.166
   61   HG23  VAL   8          2HG2      VAL   8   0.551   2.155   8.700
   62    H    GLU   9           H        GLU   9  -1.967  -2.202   8.224
   63    HA   GLU   9           HA       GLU   9  -0.774  -4.058   6.452
   64    HB2  GLU   9           2HB      GLU   9  -3.589  -3.727   7.479
   65    HB3  GLU   9           1HB      GLU   9  -3.150  -5.009   6.359
   66    HG2  GLU   9           2HG      GLU   9  -1.602  -5.939   7.947
   67    HG3  GLU   9           1HG      GLU   9  -1.866  -4.590   9.049
   68    H    ILE  10           H        ILE  10  -1.038  -4.423   4.310
   69    HA   ILE  10           HA       ILE  10  -1.515  -2.309   2.579
   70    HB   ILE  10           HB       ILE  10  -0.235  -4.352   2.013
   71   HG12  ILE  10          2HG1      ILE  10  -1.637  -4.598  -0.318
   72   HG13  ILE  10          1HG1      ILE  10  -2.240  -3.060   0.288
   73   HG21  ILE  10          1HG2      ILE  10  -2.848  -5.694   1.396
   74   HG22  ILE  10          2HG2      ILE  10  -2.042  -5.896   2.952
   75   HG23  ILE  10          3HG2      ILE  10  -1.232  -6.396   1.466
   76   HD11  ILE  10          3HD1      ILE  10  -0.038  -3.334  -1.220
   77   HD12  ILE  10          1HD1      ILE  10   0.673  -3.394   0.392
   78   HD13  ILE  10          2HD1      ILE  10  -0.302  -2.005  -0.092
   79    H    GLU  11           H        GLU  11  -3.779  -4.632   3.915
   80    HA   GLU  11           HA       GLU  11  -5.896  -4.333   2.107
   81    HB2  GLU  11           2HB      GLU  11  -5.889  -4.931   5.066
   82    HB3  GLU  11           1HB      GLU  11  -7.342  -4.978   4.079
   83    HG2  GLU  11           2HG      GLU  11  -5.786  -6.575   2.611
   84    HG3  GLU  11           1HG      GLU  11  -5.059  -6.847   4.194
   85    H    ASP  12           H        ASP  12  -4.827  -2.308   4.769
   86    HA   ASP  12           HA       ASP  12  -7.142  -0.642   4.850
   87    HB2  ASP  12           2HB      ASP  12  -5.033  -0.996   6.515
   88    HB3  ASP  12           1HB      ASP  12  -4.554   0.501   5.720
   89    H    PHE  13           H        PHE  13  -4.180  -0.647   2.988
   90    HA   PHE  13           HA       PHE  13  -4.245   2.019   2.059
   91    HB2  PHE  13           2HB      PHE  13  -2.962  -0.512   1.066
   92    HB3  PHE  13           1HB      PHE  13  -2.897   0.953   0.097
   93    HD1  PHE  13           1HD      PHE  13  -2.255  -0.130   3.620
   94    HD2  PHE  13           2HD      PHE  13  -1.055   2.291   0.329
   95    HE1  PHE  13           1HE      PHE  13  -0.285   0.617   4.890
   96    HE2  PHE  13           2HE      PHE  13   0.913   3.042   1.595
   97    HZ   PHE  13           HZ       PHE  13   1.302   2.206   3.878
   98    H    GLN  14           H        GLN  14  -4.461   2.486  -0.382
   99    HA   GLN  14           HA       GLN  14  -7.052   1.417  -1.269
  100    HB2  GLN  14           2HB      GLN  14  -6.335   4.009  -0.918
  101    HB3  GLN  14           1HB      GLN  14  -5.922   3.799  -2.614
  102    HG2  GLN  14           2HG      GLN  14  -8.056   4.402  -2.936
  103    HG3  GLN  14           1HG      GLN  14  -8.379   2.702  -2.596
  104   HE21  GLN  14          1HE2      GLN  14  -8.334   2.380  -0.021
  105   HE22  GLN  14          2HE2      GLN  14  -9.422   3.434   0.808
  106    H    TYR  15           H        TYR  15  -6.713  -0.279  -2.578
  107    HA   TYR  15           HA       TYR  15  -4.453  -0.606  -4.252
  108    HB2  TYR  15           2HB      TYR  15  -5.707  -2.536  -3.478
  109    HB3  TYR  15           1HB      TYR  15  -7.158  -1.964  -4.292
  110    HD1  TYR  15           1HD      TYR  15  -3.816  -3.426  -4.790
  111    HD2  TYR  15           2HD      TYR  15  -7.480  -2.320  -6.642
  112    HE1  TYR  15           1HE      TYR  15  -3.176  -4.696  -6.791
  113    HE2  TYR  15           2HE      TYR  15  -6.855  -3.586  -8.653
  114    HH   TYR  15           HH       TYR  15  -4.318  -5.807  -8.712
  115    H    ASP  16           H        ASP  16  -4.293  -0.513  -6.534
  116    HA   ASP  16           HA       ASP  16  -6.343   1.148  -7.847
  117    HB2  ASP  16           2HB      ASP  16  -3.937   2.140  -7.228
  118    HB3  ASP  16           1HB      ASP  16  -3.520   1.377  -8.758
  119    H    GLU  17           H        GLU  17  -6.816   0.716  -9.979
  120    HA   GLU  17           HA       GLU  17  -5.951  -1.914 -10.931
  121    HB2  GLU  17           2HB      GLU  17  -7.827  -1.462 -12.667
  122    HB3  GLU  17           1HB      GLU  17  -8.272  -1.861 -11.015
  123    HG2  GLU  17           2HG      GLU  17  -9.106   0.204 -10.589
  124    HG3  GLU  17           1HG      GLU  17  -7.980   1.008 -11.680
  125    H    ASP  18           H        ASP  18  -5.755   1.478 -11.749
  126    HA   ASP  18           HA       ASP  18  -5.159   1.447 -14.426
  127    HB2  ASP  18           2HB      ASP  18  -5.167   3.379 -12.557
  128    HB3  ASP  18           1HB      ASP  18  -3.427   3.182 -12.746
  129    H    SER  19           H        SER  19  -2.790   1.084 -11.769
  130    HA   SER  19           HA       SER  19  -1.187  -0.637 -13.483
  131    HB2  SER  19           2HB      SER  19   0.076   1.791 -12.193
  132    HB3  SER  19           1HB      SER  19   0.852   0.626 -13.262
  133    HG   SER  19           HG       SER  19  -0.754   2.780 -13.864
  134    H    GLU  20           H        GLU  20  -2.741  -0.923 -10.965
  135    HA   GLU  20           HA       GLU  20  -2.587  -1.901  -8.913
  136    HB2  GLU  20           2HB      GLU  20   0.036  -2.977  -9.944
  137    HB3  GLU  20           1HB      GLU  20  -0.957  -3.662  -8.666
  138    HG2  GLU  20           2HG      GLU  20  -2.313  -4.705 -10.107
  139    HG3  GLU  20           1HG      GLU  20  -2.338  -3.345 -11.228
  140    H    THR  21           H        THR  21  -2.338   0.140  -7.847
  141    HA   THR  21           HA       THR  21   0.272   0.385  -6.534
  142    HB   THR  21           HB       THR  21  -1.269   2.825  -7.421
  143    HG1  THR  21           1HG      THR  21   0.730   1.380  -8.800
  144   HG21  THR  21          3HG2      THR  21   0.635   4.065  -6.950
  145   HG22  THR  21          1HG2      THR  21   1.671   2.640  -6.910
  146   HG23  THR  21          2HG2      THR  21   0.526   2.933  -5.602
  147    H    TYR  22           H        TYR  22   0.206   1.035  -4.395
  148    HA   TYR  22           HA       TYR  22  -2.491   1.214  -3.217
  149    HB2  TYR  22           2HB      TYR  22   0.093   0.293  -1.936
  150    HB3  TYR  22           1HB      TYR  22  -1.470   0.379  -1.130
  151    HD1  TYR  22           1HD      TYR  22   0.490  -1.385  -3.699
  152    HD2  TYR  22           2HD      TYR  22  -3.139  -1.307  -1.482
  153    HE1  TYR  22           1HE      TYR  22  -0.010  -3.669  -4.452
  154    HE2  TYR  22           2HE      TYR  22  -3.650  -3.594  -2.227
  155    HH   TYR  22           HH       TYR  22  -1.881  -5.674  -3.121
  156    H    PHE  23           H        PHE  23  -3.046   2.944  -1.996
  157    HA   PHE  23           HA       PHE  23  -0.949   4.936  -1.425
  158    HB2  PHE  23           2HB      PHE  23  -3.813   5.553  -2.178
  159    HB3  PHE  23           1HB      PHE  23  -2.523   6.718  -1.901
  160    HD1  PHE  23           1HD      PHE  23  -3.518   3.904  -4.114
  161    HD2  PHE  23           2HD      PHE  23  -1.200   7.446  -3.672
  162    HE1  PHE  23           1HE      PHE  23  -2.940   3.818  -6.502
  163    HE2  PHE  23           2HE      PHE  23  -0.618   7.367  -6.061
  164    HZ   PHE  23           HZ       PHE  23  -1.489   5.551  -7.479
  165    H    TYR  24           H        TYR  24  -1.429   6.402   0.375
  166    HA   TYR  24           HA       TYR  24  -3.408   5.430   2.292
  167    HB2  TYR  24           2HB      TYR  24  -0.983   4.432   2.606
  168    HB3  TYR  24           1HB      TYR  24  -0.665   6.001   3.339
  169    HD1  TYR  24           2HD      TYR  24  -3.313   3.355   3.480
  170    HD2  TYR  24           1HD      TYR  24  -0.886   6.112   5.631
  171    HE1  TYR  24           2HE      TYR  24  -4.299   2.568   5.589
  172    HE2  TYR  24           1HE      TYR  24  -1.867   5.332   7.746
  173    HH   TYR  24           HH       TYR  24  -3.001   3.202   8.584
  174    HA   PRO  25           HA       PRO  25  -3.967   9.794   2.841
  175    HB2  PRO  25           2HB      PRO  25  -5.343   9.769   5.183
  176    HB3  PRO  25           1HB      PRO  25  -6.064   9.313   3.635
  177    HG2  PRO  25           2HG      PRO  25  -4.989   7.563   5.812
  178    HG3  PRO  25           1HG      PRO  25  -6.469   7.376   4.853
  179    HD2  PRO  25           2HD      PRO  25  -4.207   5.986   4.330
  180    HD3  PRO  25           1HD      PRO  25  -5.341   6.477   3.056
  181    H    CYS  26           H        CYS  26  -2.462  11.204   3.472
  182    HA   CYS  26           HA       CYS  26  -0.868  10.628   5.857
  183    HB2  CYS  26           2HB      CYS  26  -0.165  11.518   3.321
  184    HB3  CYS  26           1HB      CYS  26  -0.069  12.969   4.313
  185    HA   PRO  27           HA       PRO  27  -2.901  13.741   8.248
  186    HB2  PRO  27           2HB      PRO  27  -0.877  14.421   9.943
  187    HB3  PRO  27           1HB      PRO  27  -1.812  12.930  10.092
  188    HG2  PRO  27           2HG      PRO  27   0.887  13.360   8.871
  189    HG3  PRO  27           1HG      PRO  27   0.328  12.043   9.919
  190    HD2  PRO  27           2HD      PRO  27   0.544  11.763   7.243
  191    HD3  PRO  27           1HD      PRO  27  -0.713  10.934   8.185
  192    H    CYS  28           H        CYS  28  -0.016  14.429   6.433
  193    HA   CYS  28           HA       CYS  28   0.037  17.239   7.010
  194    HB2  CYS  28           2HB      CYS  28   1.722  17.362   5.225
  195    HB3  CYS  28           1HB      CYS  28   2.082  16.062   6.354
  196    H    GLY  29           H        GLY  29  -1.270  15.211   4.419
  197    HA2  GLY  29           2HA      GLY  29  -3.455  16.517   3.683
  198    HA3  GLY  29           1HA      GLY  29  -2.233  17.555   2.965
  199    H    ASP  30           H        ASP  30  -0.395  15.608   2.128
  200    HA   ASP  30           HA       ASP  30  -1.686  14.698  -0.278
  201    HB2  ASP  30           2HB      ASP  30   1.043  15.069   0.695
  202    HB3  ASP  30           1HB      ASP  30   0.864  13.585  -0.234
  203    H    ASN  31           H        ASN  31  -0.728  12.312  -0.969
  204    HA   ASN  31           HA       ASN  31  -1.398  10.470   1.228
  205    HB2  ASN  31           2HB      ASN  31  -2.304  10.021  -1.619
  206    HB3  ASN  31           1HB      ASN  31  -2.790   9.138  -0.175
  207   HD21  ASN  31          1HD2      ASN  31  -3.434  11.092   1.575
  208   HD22  ASN  31          2HD2      ASN  31  -4.763  12.017   0.978
  209    H    PHE  32           H        PHE  32  -0.133   8.706   1.423
  210    HA   PHE  32           HA       PHE  32   2.343   8.560   0.074
  211    HB2  PHE  32           2HB      PHE  32   0.856   6.772   1.962
  212    HB3  PHE  32           1HB      PHE  32   2.266   6.136   1.126
  213    HD1  PHE  32           1HD      PHE  32   4.424   7.605   1.289
  214    HD2  PHE  32           2HD      PHE  32   1.134   7.858   3.979
  215    HE1  PHE  32           1HE      PHE  32   5.895   8.603   2.990
  216    HE2  PHE  32           2HE      PHE  32   2.600   8.862   5.681
  217    HZ   PHE  32           HZ       PHE  32   4.982   9.235   5.188
  218    H    SER  33           H        SER  33   3.128   6.601  -1.144
  219    HA   SER  33           HA       SER  33   1.102   5.140  -2.627
  220    HB2  SER  33           2HB      SER  33   2.223   5.785  -4.829
  221    HB3  SER  33           1HB      SER  33   1.215   7.018  -4.073
  222    HG   SER  33           HG       SER  33   3.752   7.209  -4.764
  223    H    ILE  34           H        ILE  34   1.773   3.182  -3.347
  224    HA   ILE  34           HA       ILE  34   4.594   2.539  -3.534
  225    HB   ILE  34           HB       ILE  34   4.178   2.152  -1.154
  226   HG12  ILE  34          2HG1      ILE  34   4.262  -0.640  -2.127
  227   HG13  ILE  34          1HG1      ILE  34   5.426   0.457  -2.866
  228   HG21  ILE  34          1HG2      ILE  34   2.452   0.959  -0.279
  229   HG22  ILE  34          2HG2      ILE  34   2.310  -0.089  -1.690
  230   HG23  ILE  34          3HG2      ILE  34   1.666   1.552  -1.742
  231   HD11  ILE  34          3HD1      ILE  34   5.618  -0.867  -0.404
  232   HD12  ILE  34          1HD1      ILE  34   5.417   0.846  -0.037
  233   HD13  ILE  34          2HD1      ILE  34   6.729   0.320  -1.090
  234    H    THR  35           H        THR  35   4.889   1.258  -5.231
  235    HA   THR  35           HA       THR  35   2.679   0.206  -6.702
  236    HB   THR  35           HB       THR  35   4.532  -0.780  -8.147
  237    HG1  THR  35           1HG      THR  35   6.601  -0.264  -7.661
  238   HG21  THR  35          3HG2      THR  35   4.946   1.184  -9.243
  239   HG22  THR  35          1HG2      THR  35   5.106   2.112  -7.750
  240   HG23  THR  35          2HG2      THR  35   3.510   1.614  -8.314
  241    H    LYS  36           H        LYS  36   2.165  -1.951  -7.169
  242    HA   LYS  36           HA       LYS  36   2.292  -3.759  -5.023
  243    HB2  LYS  36           2HB      LYS  36   0.522  -3.838  -6.719
  244    HB3  LYS  36           1HB      LYS  36   1.695  -4.312  -7.939
  245    HG2  LYS  36           2HG      LYS  36   0.939  -6.374  -7.455
  246    HG3  LYS  36           1HG      LYS  36   2.108  -6.263  -6.140
  247    HD2  LYS  36           2HD      LYS  36   0.428  -5.691  -4.571
  248    HD3  LYS  36           1HD      LYS  36  -0.759  -5.399  -5.843
  249    HE2  LYS  36           2HE      LYS  36  -0.046  -7.989  -6.324
  250    HE3  LYS  36           1HE      LYS  36   0.067  -7.906  -4.567
  251    HZ1  LYS  36           3HZ      LYS  36  -2.166  -7.452  -4.357
  252    HZ2  LYS  36           1HZ      LYS  36  -2.171  -8.509  -5.678
  253    HZ3  LYS  36           2HZ      LYS  36  -2.319  -6.844  -5.928
  254    H    GLU  37           H        GLU  37   4.264  -3.452  -7.939
  255    HA   GLU  37           HA       GLU  37   5.690  -5.862  -7.734
  256    HB2  GLU  37           2HB      GLU  37   5.627  -4.124  -9.655
  257    HB3  GLU  37           1HB      GLU  37   6.925  -3.328  -8.777
  258    HG2  GLU  37           2HG      GLU  37   8.277  -4.626  -9.977
  259    HG3  GLU  37           1HG      GLU  37   7.813  -5.899  -8.849
  260    H    ASP  38           H        ASP  38   6.209  -2.705  -6.233
  261    HA   ASP  38           HA       ASP  38   8.781  -3.070  -5.214
  262    HB2  ASP  38           2HB      ASP  38   6.439  -1.386  -4.461
  263    HB3  ASP  38           1HB      ASP  38   7.711  -1.572  -3.260
  264    H    LEU  39           H        LEU  39   5.640  -3.854  -3.759
  265    HA   LEU  39           HA       LEU  39   6.596  -4.856  -1.326
  266    HB2  LEU  39           2HB      LEU  39   4.132  -5.772  -2.804
  267    HB3  LEU  39           1HB      LEU  39   4.432  -5.908  -1.082
  268    HG   LEU  39           HG       LEU  39   4.303  -3.230  -2.439
  269   HD11  LEU  39          1HD1      LEU  39   1.935  -3.154  -1.633
  270   HD12  LEU  39          2HD1      LEU  39   2.034  -4.897  -1.384
  271   HD13  LEU  39          3HD1      LEU  39   2.227  -4.227  -3.003
  272   HD21  LEU  39          3HD2      LEU  39   5.208  -3.727  -0.032
  273   HD22  LEU  39          1HD2      LEU  39   3.493  -3.829   0.370
  274   HD23  LEU  39          2HD2      LEU  39   4.152  -2.346  -0.323
  275    H    GLU  40           H        GLU  40   5.884  -6.524  -4.386
  276    HA   GLU  40           HA       GLU  40   6.442  -9.132  -3.517
  277    HB2  GLU  40           2HB      GLU  40   6.820  -7.965  -6.281
  278    HB3  GLU  40           1HB      GLU  40   6.743  -9.678  -5.893
  279    HG2  GLU  40           2HG      GLU  40   4.455  -9.499  -5.239
  280    HG3  GLU  40           1HG      GLU  40   4.503  -7.741  -5.367
  281    H    ASN  41           H        ASN  41   8.572  -6.542  -4.569
  282    HA   ASN  41           HA       ASN  41  10.893  -8.257  -4.721
  283    HB2  ASN  41           2HB      ASN  41  10.307  -5.390  -5.230
  284    HB3  ASN  41           1HB      ASN  41  11.960  -5.795  -4.776
  285   HD21  ASN  41          1HD2      ASN  41  13.284  -6.523  -6.294
  286   HD22  ASN  41          2HD2      ASN  41  12.813  -7.015  -7.881
  287    H    GLY  42           H        GLY  42   9.553  -5.903  -2.439
  288    HA2  GLY  42           2HA      GLY  42  10.214  -6.738  -0.068
  289    HA3  GLY  42           1HA      GLY  42  11.829  -6.344  -0.638
  290    H    GLU  43           H        GLU  43  10.262  -4.081  -2.204
  291    HA   GLU  43           HA       GLU  43  10.904  -2.014  -0.372
  292    HB2  GLU  43           2HB      GLU  43   9.612  -2.111  -3.078
  293    HB3  GLU  43           1HB      GLU  43   9.612  -0.615  -2.158
  294    HG2  GLU  43           2HG      GLU  43  12.198  -1.180  -1.973
  295    HG3  GLU  43           1HG      GLU  43  11.846  -2.038  -3.474
  296    H    ASP  44           H        ASP  44   9.605  -2.650   1.442
  297    HA   ASP  44           HA       ASP  44   6.723  -2.218   1.193
  298    HB2  ASP  44           2HB      ASP  44   6.657  -3.081   3.554
  299    HB3  ASP  44           1HB      ASP  44   7.259  -4.227   2.366
  300    H    VAL  45           H        VAL  45   8.275   0.044   0.850
  301    HA   VAL  45           HA       VAL  45   7.556   1.594   3.240
  302    HB   VAL  45           HB       VAL  45   9.990   1.295   3.260
  303   HG11  VAL  45          1HG1      VAL  45  10.343   2.965   0.830
  304   HG12  VAL  45          2HG1      VAL  45   9.956   1.261   0.605
  305   HG13  VAL  45          3HG1      VAL  45  11.393   1.725   1.515
  306   HG21  VAL  45          3HG2      VAL  45   9.256   4.121   2.509
  307   HG22  VAL  45          1HG2      VAL  45  10.595   3.604   3.535
  308   HG23  VAL  45          2HG2      VAL  45   8.931   3.388   4.080
  309    H    ALA  46           H        ALA  46   6.499   3.457   2.864
  310    HA   ALA  46           HA       ALA  46   6.171   4.264   0.051
  311    HB1  ALA  46           1HB      ALA  46   4.152   5.270   1.900
  312    HB2  ALA  46           2HB      ALA  46   4.204   3.509   1.818
  313    HB3  ALA  46           3HB      ALA  46   3.963   4.454   0.348
  314    H    THR  47           H        THR  47   6.557   6.344  -0.522
  315    HA   THR  47           HA       THR  47   7.424   8.169   1.623
  316    HB   THR  47           HB       THR  47   8.407   8.289  -1.228
  317    HG1  THR  47           1HG      THR  47   9.472   6.827   0.955
  318   HG21  THR  47          3HG2      THR  47   8.712  10.158   0.627
  319   HG22  THR  47          1HG2      THR  47   9.972   9.770  -0.543
  320   HG23  THR  47          2HG2      THR  47  10.052   9.108   1.088
  321    H    CYS  48           H        CYS  48   6.480  10.110   1.761
  322    HA   CYS  48           HA       CYS  48   4.391  10.763  -0.181
  323    HB2  CYS  48           2HB      CYS  48   3.861  10.694   2.262
  324    HB3  CYS  48           1HB      CYS  48   4.961  12.047   2.500
  325    HA   PRO  49           HA       PRO  49   7.303  13.615  -2.116
  326    HB2  PRO  49           2HB      PRO  49   4.759  14.617  -3.288
  327    HB3  PRO  49           1HB      PRO  49   6.270  14.168  -4.088
  328    HG2  PRO  49           2HG      PRO  49   4.161  12.560  -4.200
  329    HG3  PRO  49           1HG      PRO  49   5.793  11.896  -4.000
  330    HD2  PRO  49           2HD      PRO  49   3.626  12.247  -1.970
  331    HD3  PRO  49           1HD      PRO  49   4.793  10.922  -2.156
  332    H    SER  50           H        SER  50   4.505  14.477  -0.208
  333    HA   SER  50           HA       SER  50   5.093  17.305  -0.239
  334    HB2  SER  50           2HB      SER  50   2.964  15.575   0.876
  335    HB3  SER  50           1HB      SER  50   3.313  17.050   1.782
  336    HG   SER  50           HG       SER  50   2.532  18.216   0.197
  337    H    CYS  51           H        CYS  51   4.636  15.197   2.610
  338    HA   CYS  51           HA       CYS  51   6.421  16.799   4.171
  339    HB2  CYS  51           2HB      CYS  51   5.987  15.194   5.966
  340    HB3  CYS  51           1HB      CYS  51   4.491  15.710   5.197
  341    H    SER  52           H        SER  52   6.818  13.977   2.213
  342    HA   SER  52           HA       SER  52   8.623  12.721   1.664
  343    HB2  SER  52           2HB      SER  52   9.845  15.214   2.710
  344    HB3  SER  52           1HB      SER  52  10.906  13.811   2.597
  345    HG   SER  52           HG       SER  52  10.340  15.399   0.668
  346    H    LEU  53           H        LEU  53   7.205  11.869   3.817
  347    HA   LEU  53           HA       LEU  53   9.177  11.083   5.844
  348    HB2  LEU  53           2HB      LEU  53   6.257  11.479   5.819
  349    HB3  LEU  53           1HB      LEU  53   6.799  10.080   6.724
  350    HG   LEU  53           HG       LEU  53   8.416  11.720   7.898
  351   HD11  LEU  53          1HD1      LEU  53   7.515  13.502   6.082
  352   HD12  LEU  53          2HD1      LEU  53   8.174  13.945   7.656
  353   HD13  LEU  53          3HD1      LEU  53   6.429  13.840   7.430
  354   HD21  LEU  53          3HD2      LEU  53   6.388  10.611   8.866
  355   HD22  LEU  53          1HD2      LEU  53   5.470  12.052   8.424
  356   HD23  LEU  53          2HD2      LEU  53   6.795  12.171   9.582
  357    H    ILE  54           H        ILE  54   8.497   8.757   6.772
  358    HA   ILE  54           HA       ILE  54   8.258   6.927   4.471
  359    HB   ILE  54           HB       ILE  54   9.831   5.396   5.729
  360   HG12  ILE  54          2HG1      ILE  54  10.635   7.926   7.177
  361   HG13  ILE  54          1HG1      ILE  54   9.601   6.697   7.899
  362   HG21  ILE  54          1HG2      ILE  54  10.669   7.978   4.474
  363   HG22  ILE  54          2HG2      ILE  54  10.753   6.340   3.828
  364   HG23  ILE  54          3HG2      ILE  54  11.881   6.851   5.084
  365   HD11  ILE  54          3HD1      ILE  54  11.699   5.198   7.062
  366   HD12  ILE  54          1HD1      ILE  54  11.523   5.874   8.680
  367   HD13  ILE  54          2HD1      ILE  54  12.493   6.717   7.473
  368    H    ILE  55           H        ILE  55   7.120   5.039   4.783
  369    HA   ILE  55           HA       ILE  55   6.007   4.507   7.444
  370    HB   ILE  55           HB       ILE  55   3.771   4.065   6.472
  371   HG12  ILE  55          2HG1      ILE  55   4.499   5.685   4.066
  372   HG13  ILE  55          1HG1      ILE  55   4.869   3.965   4.069
  373   HG21  ILE  55          1HG2      ILE  55   4.824   6.872   6.189
  374   HG22  ILE  55          2HG2      ILE  55   4.121   6.134   7.628
  375   HG23  ILE  55          3HG2      ILE  55   3.114   6.443   6.213
  376   HD11  ILE  55          3HD1      ILE  55   2.435   5.213   3.450
  377   HD12  ILE  55          1HD1      ILE  55   2.188   4.346   4.964
  378   HD13  ILE  55          2HD1      ILE  55   2.780   3.486   3.541
  379    H    LYS  56           H        LYS  56   5.115   2.330   7.669
  380    HA   LYS  56           HA       LYS  56   6.513   0.444   5.904
  381    HB2  LYS  56           2HB      LYS  56   6.567   0.607   8.623
  382    HB3  LYS  56           1HB      LYS  56   5.297  -0.586   8.384
  383    HG2  LYS  56           2HG      LYS  56   7.988  -0.819   7.075
  384    HG3  LYS  56           1HG      LYS  56   7.648  -1.461   8.682
  385    HD2  LYS  56           2HD      LYS  56   5.738  -2.736   7.651
  386    HD3  LYS  56           1HD      LYS  56   6.354  -2.240   6.074
  387    HE2  LYS  56           2HE      LYS  56   7.260  -4.374   6.432
  388    HE3  LYS  56           1HE      LYS  56   8.573  -3.255   6.796
  389    HZ1  LYS  56           3HZ      LYS  56   6.960  -4.882   8.649
  390    HZ2  LYS  56           1HZ      LYS  56   7.708  -3.469   9.201
  391    HZ3  LYS  56           2HZ      LYS  56   8.640  -4.723   8.557
  392    H    VAL  57           H        VAL  57   5.525  -0.964   4.694
  393    HA   VAL  57           HA       VAL  57   2.590  -1.070   4.828
  394    HB   VAL  57           HB       VAL  57   3.952  -2.086   2.399
  395   HG11  VAL  57          1HG1      VAL  57   1.557  -0.368   2.984
  396   HG12  VAL  57          2HG1      VAL  57   1.568  -2.062   2.498
  397   HG13  VAL  57          3HG1      VAL  57   2.072  -0.813   1.358
  398   HG21  VAL  57          3HG2      VAL  57   5.285  -0.062   2.925
  399   HG22  VAL  57          1HG2      VAL  57   3.798   0.884   2.937
  400   HG23  VAL  57          2HG2      VAL  57   4.338   0.106   1.450
  401    H    ILE  58           H        ILE  58   1.847  -2.848   5.775
  402    HA   ILE  58           HA       ILE  58   3.429  -5.307   5.709
  403    HB   ILE  58           HB       ILE  58   0.863  -4.815   7.223
  404   HG12  ILE  58          2HG1      ILE  58   2.611  -3.189   7.887
  405   HG13  ILE  58          1HG1      ILE  58   2.231  -4.324   9.177
  406   HG21  ILE  58          1HG2      ILE  58   1.114  -7.085   7.267
  407   HG22  ILE  58          2HG2      ILE  58   2.088  -6.648   8.670
  408   HG23  ILE  58          3HG2      ILE  58   2.871  -7.007   7.131
  409   HD11  ILE  58          3HD1      ILE  58   4.243  -5.589   8.676
  410   HD12  ILE  58          1HD1      ILE  58   4.624  -3.900   9.008
  411   HD13  ILE  58          2HD1      ILE  58   4.614  -4.491   7.347
  412    H    TYR  59           H        TYR  59   2.841  -7.115   4.640
  413    HA   TYR  59           HA       TYR  59   0.158  -7.472   3.603
  414    HB2  TYR  59           2HB      TYR  59   1.038  -7.783   1.243
  415    HB3  TYR  59           1HB      TYR  59   1.015  -6.119   1.821
  416    HD1  TYR  59           2HD      TYR  59   3.154  -5.066   2.595
  417    HD2  TYR  59           1HD      TYR  59   3.073  -8.820   0.590
  418    HE1  TYR  59           2HE      TYR  59   5.553  -4.851   2.110
  419    HE2  TYR  59           1HE      TYR  59   5.474  -8.618   0.104
  420    HH   TYR  59           HH       TYR  59   7.501  -7.093   1.479
  421    H    ASP  60           H        ASP  60   0.262  -9.575   2.073
  422    HA   ASP  60           HA       ASP  60   1.587 -11.589   3.712
  423    HB2  ASP  60           2HB      ASP  60  -0.892 -11.653   2.881
  424    HB3  ASP  60           1HB      ASP  60  -0.186 -12.251   1.383
  425    H    LYS  61           H        LYS  61   3.690 -11.730   3.155
  426    HA   LYS  61           HA       LYS  61   4.769 -11.426   0.590
  427    HB2  LYS  61           2HB      LYS  61   5.761 -12.812   3.067
  428    HB3  LYS  61           1HB      LYS  61   6.704 -12.811   1.583
  429    HG2  LYS  61           2HG      LYS  61   5.741 -10.173   2.446
  430    HG3  LYS  61           1HG      LYS  61   6.902 -10.948   3.527
  431    HD2  LYS  61           2HD      LYS  61   8.053 -11.396   1.108
  432    HD3  LYS  61           1HD      LYS  61   7.274  -9.838   0.830
  433    HE2  LYS  61           2HE      LYS  61   8.653  -8.747   2.246
  434    HE3  LYS  61           1HE      LYS  61   8.727 -10.097   3.376
  435    HZ1  LYS  61           3HZ      LYS  61  10.086 -10.297   0.771
  436    HZ2  LYS  61           1HZ      LYS  61  10.441 -11.083   2.227
  437    HZ3  LYS  61           2HZ      LYS  61  10.817  -9.445   2.036
  438    H    ASP  62           H        ASP  62   3.310 -14.202   2.145
  439    HA   ASP  62           HA       ASP  62   4.299 -16.199   0.407
  440    HB2  ASP  62           2HB      ASP  62   2.069 -15.996   2.372
  441    HB3  ASP  62           1HB      ASP  62   1.996 -17.302   1.193
  442    H    GLN  63           H        GLN  63   1.451 -14.102   0.277
  443    HA   GLN  63           HA       GLN  63   0.337 -15.364  -2.041
  444    HB2  GLN  63           2HB      GLN  63  -0.209 -12.749  -0.646
  445    HB3  GLN  63           1HB      GLN  63  -1.042 -13.211  -2.124
  446    HG2  GLN  63           2HG      GLN  63  -1.080 -15.272  -0.057
  447    HG3  GLN  63           1HG      GLN  63  -1.873 -13.770   0.411
  448   HE21  GLN  63          1HE2      GLN  63  -3.976 -14.156   0.231
  449   HE22  GLN  63          2HE2      GLN  63  -4.764 -14.805  -1.163
  450    H    PHE  64           H        PHE  64   2.302 -12.472  -1.458
  451    HA   PHE  64           HA       PHE  64   2.314 -11.572  -4.149
  452    HB2  PHE  64           2HB      PHE  64   4.026 -10.978  -1.747
  453    HB3  PHE  64           1HB      PHE  64   4.430 -10.319  -3.329
  454    HD1  PHE  64           1HD      PHE  64   1.289 -10.720  -1.333
  455    HD2  PHE  64           2HD      PHE  64   3.811  -8.130  -3.579
  456    HE1  PHE  64           1HE      PHE  64  -0.292  -8.873  -0.970
  457    HE2  PHE  64           2HE      PHE  64   2.234  -6.279  -3.220
  458    HZ   PHE  64           HZ       PHE  64   0.178  -6.647  -1.914
  459    H    VAL  65           H        VAL  65   4.592 -13.542  -2.259
  460    HA   VAL  65           HA       VAL  65   6.139 -14.070  -4.700
  461    HB   VAL  65           HB       VAL  65   6.838 -14.839  -1.861
  462   HG11  VAL  65          1HG1      VAL  65   8.927 -14.481  -3.908
  463   HG12  VAL  65          2HG1      VAL  65   7.864 -15.869  -4.133
  464   HG13  VAL  65          3HG1      VAL  65   8.775 -15.691  -2.634
  465   HG21  VAL  65          3HG2      VAL  65   6.686 -12.273  -2.746
  466   HG22  VAL  65          1HG2      VAL  65   8.355 -12.677  -3.143
  467   HG23  VAL  65          2HG2      VAL  65   7.780 -12.836  -1.484
  468    H    SER  66           H        SER  66   4.513 -15.475  -5.604
  469    HA   SER  66           HA       SER  66   4.318 -18.093  -4.260
  470    HB2  SER  66           2HB      SER  66   2.438 -16.798  -6.250
  471    HB3  SER  66           1HB      SER  66   2.264 -18.441  -5.630
  472    HG   SER  66           HG       SER  66   1.058 -16.668  -4.540
  473    H    GLY  67           H        GLY  67   6.197 -19.003  -5.104
  474    HA2  GLY  67           2HA      GLY  67   6.428 -19.151  -8.030
  475    HA3  GLY  67           1HA      GLY  67   7.702 -19.529  -6.879
  476    H    GLU  68           H        GLU  68   6.455 -21.298  -5.184
  477    HA   GLU  68           HA       GLU  68   5.986 -23.571  -6.987
  478    HB2  GLU  68           2HB      GLU  68   7.239 -23.310  -4.283
  479    HB3  GLU  68           1HB      GLU  68   6.512 -24.844  -4.743
  480    HG2  GLU  68           2HG      GLU  68   8.526 -25.303  -5.586
  481    HG3  GLU  68           1HG      GLU  68   8.008 -24.299  -6.937
  482    H    THR  69           H        THR  69   3.871 -21.718  -6.256
  483    HA   THR  69           HA       THR  69   1.960 -23.664  -5.271
  484    HB   THR  69           HB       THR  69   2.037 -20.958  -3.942
  485    HG1  THR  69           1HG      THR  69   3.259 -23.371  -3.106
  486   HG21  THR  69          3HG2      THR  69  -0.064 -21.896  -3.604
  487   HG22  THR  69          1HG2      THR  69   0.837 -22.296  -2.142
  488   HG23  THR  69          2HG2      THR  69   0.593 -23.519  -3.389
  489    H    VAL  70           H        VAL  70   0.145 -23.538  -6.424
  490    HA   VAL  70           HA       VAL  70  -0.330 -21.111  -8.021
  491    HB   VAL  70           HB       VAL  70  -1.644 -23.775  -8.497
  492   HG11  VAL  70          1HG1      VAL  70  -2.713 -21.965  -9.624
  493   HG12  VAL  70          2HG1      VAL  70  -1.790 -22.872 -10.824
  494   HG13  VAL  70          3HG1      VAL  70  -1.169 -21.342 -10.206
  495   HG21  VAL  70          3HG2      VAL  70   0.774 -24.143  -8.551
  496   HG22  VAL  70          1HG2      VAL  70   0.952 -22.816  -9.699
  497   HG23  VAL  70          2HG2      VAL  70   0.072 -24.273 -10.163
  498    HA   PRO  71           HA       PRO  71  -3.992 -20.523  -5.554
  499    HB2  PRO  71           2HB      PRO  71  -4.936 -18.326  -6.762
  500    HB3  PRO  71           1HB      PRO  71  -3.435 -18.290  -5.829
  501    HG2  PRO  71           2HG      PRO  71  -3.831 -18.330  -8.780
  502    HG3  PRO  71           1HG      PRO  71  -2.589 -17.506  -7.824
  503    HD2  PRO  71           2HD      PRO  71  -2.292 -19.940  -9.179
  504    HD3  PRO  71           1HD      PRO  71  -1.199 -19.296  -7.942
  505    H    ALA  72           H        ALA  72  -4.375 -22.652  -7.261
  506    HA   ALA  72           HA       ALA  72  -6.987 -22.063  -8.492
  507    HB1  ALA  72           1HB      ALA  72  -6.571 -23.599 -10.221
  508    HB2  ALA  72           2HB      ALA  72  -5.176 -24.287  -9.389
  509    HB3  ALA  72           3HB      ALA  72  -5.085 -22.661 -10.066
  510    HA   PRO  73           HA       PRO  73  -8.518 -24.784  -5.273
  511    HB2  PRO  73           2HB      PRO  73 -10.915 -24.811  -7.026
  512    HB3  PRO  73           1HB      PRO  73 -10.779 -24.397  -5.314
  513    HG2  PRO  73           2HG      PRO  73 -11.140 -22.505  -7.154
  514    HG3  PRO  73           1HG      PRO  73 -10.076 -22.231  -5.761
  515    HD2  PRO  73           2HD      PRO  73  -9.367 -22.870  -8.596
  516    HD3  PRO  73           1HD      PRO  73  -8.583 -21.750  -7.462
  517    H    SER  74           H        SER  74  -9.703 -26.910  -5.198
  518    HA   SER  74           HA       SER  74  -8.356 -28.812  -6.829
  519    HB2  SER  74           2HB      SER  74  -9.261 -29.030  -4.381
  520    HB3  SER  74           1HB      SER  74 -10.756 -29.527  -5.172
  521    HG   SER  74           HG       SER  74  -9.816 -31.325  -5.861
  522    H    ALA  75           H        ALA  75 -11.626 -27.469  -6.844
  523    HA   ALA  75           HA       ALA  75 -12.099 -28.866  -9.394
  524    HB1  ALA  75           1HB      ALA  75 -14.274 -29.440  -8.831
  525    HB2  ALA  75           2HB      ALA  75 -14.358 -28.256  -7.527
  526    HB3  ALA  75           3HB      ALA  75 -13.400 -29.722  -7.325
  527    H    ASN  76           H        ASN  76 -12.635 -27.581 -11.046
  528    HA   ASN  76           HA       ASN  76 -12.675 -24.762 -10.765
  529    HB2  ASN  76           2HB      ASN  76 -12.994 -26.696 -13.000
  530    HB3  ASN  76           1HB      ASN  76 -13.646 -25.081 -13.255
  531   HD21  ASN  76          1HD2      ASN  76 -11.647 -25.950 -14.847
  532   HD22  ASN  76          2HD2      ASN  76 -10.178 -25.120 -14.481
  533    H    LYS  77           H        LYS  77 -14.357 -23.274 -11.084
  534    HA   LYS  77           HA       LYS  77 -17.035 -24.341 -10.491
  535    HB2  LYS  77           2HB      LYS  77 -17.496 -21.955  -9.742
  536    HB3  LYS  77           1HB      LYS  77 -16.382 -22.885  -8.751
  537    HG2  LYS  77           2HG      LYS  77 -14.580 -21.612  -9.334
  538    HG3  LYS  77           1HG      LYS  77 -15.249 -21.191 -10.912
  539    HD2  LYS  77           2HD      LYS  77 -16.839 -19.680  -9.853
  540    HD3  LYS  77           1HD      LYS  77 -16.228 -20.133  -8.261
  541    HE2  LYS  77           2HE      LYS  77 -14.223 -19.015  -8.570
  542    HE3  LYS  77           1HE      LYS  77 -14.356 -19.051 -10.327
  543    HZ1  LYS  77           3HZ      LYS  77 -16.328 -17.520  -8.772
  544    HZ2  LYS  77           1HZ      LYS  77 -15.766 -17.260 -10.347
  545    HZ3  LYS  77           2HZ      LYS  77 -14.791 -16.862  -9.024
  546    H    GLU  78           H        GLU  78 -18.884 -23.441 -11.522
  547    HA   GLU  78           HA       GLU  78 -18.459 -21.741 -13.850
  548    HB2  GLU  78           2HB      GLU  78 -19.227 -24.616 -13.968
  549    HB3  GLU  78           1HB      GLU  78 -20.059 -23.512 -15.057
  550    HG2  GLU  78           2HG      GLU  78 -17.945 -22.799 -15.997
  551    HG3  GLU  78           1HG      GLU  78 -17.073 -23.829 -14.863
  552    H    LEU  79           H        LEU  79 -19.752 -20.127 -13.076
  553    HA   LEU  79           HA       LEU  79 -22.546 -20.369 -13.362
  554    HB2  LEU  79           2HB      LEU  79 -23.218 -19.918 -11.020
  555    HB3  LEU  79           1HB      LEU  79 -22.542 -21.517 -11.259
  556    HG   LEU  79           HG       LEU  79 -20.759 -19.318 -10.297
  557   HD11  LEU  79          1HD1      LEU  79 -22.256 -18.954  -8.634
  558   HD12  LEU  79          2HD1      LEU  79 -21.466 -20.381  -7.961
  559   HD13  LEU  79          3HD1      LEU  79 -23.005 -20.541  -8.806
  560   HD21  LEU  79          3HD2      LEU  79 -20.051 -21.499  -8.941
  561   HD22  LEU  79          1HD2      LEU  79 -19.465 -21.161 -10.570
  562   HD23  LEU  79          2HD2      LEU  79 -20.808 -22.279 -10.329
  563    H    VAL  80           H        VAL  80 -23.310 -18.429 -13.895
  564    HA   VAL  80           HA       VAL  80 -21.741 -16.051 -13.127
  565    HB   VAL  80           HB       VAL  80 -23.590 -16.279 -15.508
  566   HG11  VAL  80          1HG1      VAL  80 -22.944 -14.173 -16.104
  567   HG12  VAL  80          2HG1      VAL  80 -21.378 -14.303 -15.305
  568   HG13  VAL  80          3HG1      VAL  80 -22.835 -14.025 -14.351
  569   HG21  VAL  80          3HG2      VAL  80 -21.228 -16.190 -16.692
  570   HG22  VAL  80          1HG2      VAL  80 -21.961 -17.719 -16.209
  571   HG23  VAL  80          2HG2      VAL  80 -20.716 -16.981 -15.201
  572    H    LYS  81           H        LYS  81 -22.840 -15.632 -11.196
  573    HA   LYS  81           HA       LYS  81 -25.707 -15.012 -11.440
  574    HB2  LYS  81           2HB      LYS  81 -24.008 -16.025  -9.216
  575    HB3  LYS  81           1HB      LYS  81 -25.342 -14.962  -8.790
  576    HG2  LYS  81           2HG      LYS  81 -26.624 -16.666 -10.428
  577    HG3  LYS  81           1HG      LYS  81 -25.366 -17.732  -9.794
  578    HD2  LYS  81           2HD      LYS  81 -26.733 -16.049  -7.797
  579    HD3  LYS  81           1HD      LYS  81 -27.736 -17.279  -8.569
  580    HE2  LYS  81           2HE      LYS  81 -25.652 -18.810  -8.039
  581    HE3  LYS  81           1HE      LYS  81 -25.359 -17.589  -6.801
  582    HZ1  LYS  81           3HZ      LYS  81 -27.875 -18.013  -6.297
  583    HZ2  LYS  81           1HZ      LYS  81 -26.687 -19.047  -5.676
  584    HZ3  LYS  81           2HZ      LYS  81 -27.572 -19.500  -7.044
  585    H    LEU  82           H        LEU  82 -25.887 -12.919 -12.011
  586    HA   LEU  82           HA       LEU  82 -24.546 -10.935 -10.299
  587    HB2  LEU  82           2HB      LEU  82 -24.741 -11.005 -13.292
  588    HB3  LEU  82           1HB      LEU  82 -24.581  -9.477 -12.447
  589    HG   LEU  82           HG       LEU  82 -22.609 -11.617 -11.816
  590   HD11  LEU  82          1HD1      LEU  82 -22.281  -9.879 -14.244
  591   HD12  LEU  82          2HD1      LEU  82 -22.903 -11.527 -14.333
  592   HD13  LEU  82          3HD1      LEU  82 -21.277 -11.229 -13.716
  593   HD21  LEU  82          3HD2      LEU  82 -21.126  -9.550 -11.823
  594   HD22  LEU  82          1HD2      LEU  82 -22.361  -9.641 -10.566
  595   HD23  LEU  82          2HD2      LEU  82 -22.615  -8.617 -11.978
  596    H    GLU  83           H        GLU  83 -27.178 -11.994  -9.982
  597    HA   GLU  83           HA       GLU  83 -29.036 -10.030 -11.015
  598    HB2  GLU  83           2HB      GLU  83 -29.326 -12.639 -10.334
  599    HB3  GLU  83           1HB      GLU  83 -29.906 -11.868  -8.866
  600    HG2  GLU  83           2HG      GLU  83 -31.878 -11.791  -9.892
  601    HG3  GLU  83           1HG      GLU  83 -31.200 -10.450 -10.814
  602    H    HIS  84           H        HIS  84 -30.697  -9.192  -9.279
  603    HA   HIS  84           HA       HIS  84 -29.217  -8.186  -6.941
  604    HB2  HIS  84           2HB      HIS  84 -30.382  -6.006  -7.231
  605    HB3  HIS  84           1HB      HIS  84 -29.285  -6.381  -8.552
  606    HD1  HIS  84           1HD      HIS  84 -30.375  -6.999 -10.853
  607    HD2  HIS  84           2HD      HIS  84 -33.056  -5.761  -7.929
  608    HE1  HIS  84           1HE      HIS  84 -32.523  -6.523 -12.069
  609    HE2  HIS  84           2HE      HIS  84 -34.163  -5.892 -10.264
  Start of MODEL    4
    1    H1   MET   1           1HT      MET   1  12.154  -2.709  12.498
    2    H2   MET   1           2HT      MET   1  13.661  -2.387  13.256
    3    H3   MET   1           3HT      MET   1  13.476  -2.141  11.567
    4    HA   MET   1           HA       MET   1  11.949  -0.393  11.927
    5    HB2  MET   1           2HB      MET   1  11.369  -1.640  14.247
    6    HB3  MET   1           1HB      MET   1  12.441  -0.387  14.857
    7    HG2  MET   1           2HG      MET   1  10.048   0.168  13.126
    8    HG3  MET   1           1HG      MET   1  10.008   0.176  14.887
    9    HE1  MET   1           2HE      MET   1   9.243   2.793  12.887
   10    HE2  MET   1           3HE      MET   1   9.796   3.970  14.078
   11    HE3  MET   1           1HE      MET   1   8.939   2.522  14.603
   12    H    ALA   2           H        ALA   2  12.852   1.579  11.686
   13    HA   ALA   2           HA       ALA   2  15.451   2.099  12.961
   14    HB1  ALA   2           1HB      ALA   2  15.842   3.389  10.653
   15    HB2  ALA   2           2HB      ALA   2  14.803   2.086  10.071
   16    HB3  ALA   2           3HB      ALA   2  16.314   1.708  10.899
   17    H    VAL   3           H        VAL   3  13.280   3.877  10.735
   18    HA   VAL   3           HA       VAL   3  12.704   5.825  12.832
   19    HB   VAL   3           HB       VAL   3  13.245   7.734  11.308
   20   HG11  VAL   3          1HG1      VAL   3  15.484   7.868  11.963
   21   HG12  VAL   3          2HG1      VAL   3  15.718   6.125  11.844
   22   HG13  VAL   3          3HG1      VAL   3  14.748   6.796  13.155
   23   HG21  VAL   3          3HG2      VAL   3  13.402   5.941   9.322
   24   HG22  VAL   3          1HG2      VAL   3  15.109   6.049   9.748
   25   HG23  VAL   3          2HG2      VAL   3  14.224   7.500   9.277
   26    H    PHE   4           H        PHE   4  11.174   3.825  11.200
   27    HA   PHE   4           HA       PHE   4   9.567   5.291   9.346
   28    HB2  PHE   4           2HB      PHE   4   9.530   2.542  10.501
   29    HB3  PHE   4           1HB      PHE   4   8.043   3.150   9.786
   30    HD1  PHE   4           1HD      PHE   4  11.604   3.594   8.760
   31    HD2  PHE   4           2HD      PHE   4   7.756   2.056   7.789
   32    HE1  PHE   4           1HE      PHE   4  12.420   2.967   6.527
   33    HE2  PHE   4           2HE      PHE   4   8.566   1.428   5.555
   34    HZ   PHE   4           HZ       PHE   4  10.901   1.882   4.920
   35    H    HIS   5           H        HIS   5   7.462   6.042   9.557
   36    HA   HIS   5           HA       HIS   5   6.756   7.140  12.065
   37    HB2  HIS   5           2HB      HIS   5   6.095   7.927   9.684
   38    HB3  HIS   5           1HB      HIS   5   4.789   6.755   9.814
   39    HD1  HIS   5           1HD      HIS   5   6.128   9.472  12.135
   40    HD2  HIS   5           2HD      HIS   5   2.553   8.021  10.593
   41    HE1  HIS   5           1HE      HIS   5   4.330  10.924  13.125
   42    HE2  HIS   5           2HE      HIS   5   2.178  10.064  12.134
   43    H    ASP   6           H        ASP   6   4.951   4.726  10.141
   44    HA   ASP   6           HA       ASP   6   4.553   3.016  12.396
   45    HB2  ASP   6           2HB      ASP   6   2.468   4.988  11.662
   46    HB3  ASP   6           1HB      ASP   6   1.901   3.340  11.909
   47    H    GLU   7           H        GLU   7   3.779   0.985  11.805
   48    HA   GLU   7           HA       GLU   7   3.789   0.467   8.933
   49    HB2  GLU   7           2HB      GLU   7   3.632  -1.579  11.148
   50    HB3  GLU   7           1HB      GLU   7   4.104  -1.841   9.476
   51    HG2  GLU   7           2HG      GLU   7   6.186  -1.734  10.251
   52    HG3  GLU   7           1HG      GLU   7   5.930   0.009  10.279
   53    H    VAL   8           H        VAL   8   2.045  -0.164   7.779
   54    HA   VAL   8           HA       VAL   8  -0.439  -0.794   9.228
   55    HB   VAL   8           HB       VAL   8  -0.360   0.975   6.782
   56   HG11  VAL   8          1HG1      VAL   8  -2.654   1.278   7.082
   57   HG12  VAL   8          2HG1      VAL   8  -2.617   0.660   8.731
   58   HG13  VAL   8          3HG1      VAL   8  -2.415  -0.444   7.372
   59   HG21  VAL   8          3HG2      VAL   8  -0.629   2.879   8.140
   60   HG22  VAL   8          1HG2      VAL   8   0.696   1.977   8.871
   61   HG23  VAL   8          2HG2      VAL   8  -0.913   1.911   9.585
   62    H    GLU   9           H        GLU   9  -1.746  -2.311   8.303
   63    HA   GLU   9           HA       GLU   9  -0.585  -4.142   6.484
   64    HB2  GLU   9           2HB      GLU   9  -3.474  -3.920   7.354
   65    HB3  GLU   9           1HB      GLU   9  -2.738  -5.313   6.575
   66    HG2  GLU   9           2HG      GLU   9  -1.377  -5.756   8.478
   67    HG3  GLU   9           1HG      GLU   9  -1.841  -4.233   9.235
   68    H    ILE  10           H        ILE  10  -0.929  -4.520   4.345
   69    HA   ILE  10           HA       ILE  10  -1.541  -2.406   2.641
   70    HB   ILE  10           HB       ILE  10  -0.209  -4.392   1.993
   71   HG12  ILE  10          2HG1      ILE  10  -1.742  -4.685  -0.260
   72   HG13  ILE  10          1HG1      ILE  10  -2.340  -3.161   0.384
   73   HG21  ILE  10          1HG2      ILE  10  -1.274  -6.445   1.315
   74   HG22  ILE  10          2HG2      ILE  10  -2.865  -5.789   1.702
   75   HG23  ILE  10          3HG2      ILE  10  -1.699  -6.093   2.991
   76   HD11  ILE  10          3HD1      ILE  10  -0.145  -3.489  -1.215
   77   HD12  ILE  10          1HD1      ILE  10   0.559  -3.324   0.394
   78   HD13  ILE  10          2HD1      ILE  10  -0.511  -2.071  -0.236
   79    H    GLU  11           H        GLU  11  -3.659  -4.775   4.108
   80    HA   GLU  11           HA       GLU  11  -5.861  -4.598   2.395
   81    HB2  GLU  11           2HB      GLU  11  -7.214  -5.330   4.317
   82    HB3  GLU  11           1HB      GLU  11  -5.747  -6.281   4.144
   83    HG2  GLU  11           2HG      GLU  11  -4.751  -5.303   6.017
   84    HG3  GLU  11           1HG      GLU  11  -5.874  -3.945   6.019
   85    H    ASP  12           H        ASP  12  -4.736  -2.428   4.916
   86    HA   ASP  12           HA       ASP  12  -7.121  -0.839   4.986
   87    HB2  ASP  12           2HB      ASP  12  -4.354  -0.543   6.117
   88    HB3  ASP  12           1HB      ASP  12  -5.476   0.814   6.152
   89    H    PHE  13           H        PHE  13  -4.197  -0.853   3.081
   90    HA   PHE  13           HA       PHE  13  -4.280   1.808   2.135
   91    HB2  PHE  13           2HB      PHE  13  -3.014  -0.726   1.134
   92    HB3  PHE  13           1HB      PHE  13  -2.985   0.727   0.146
   93    HD1  PHE  13           1HD      PHE  13  -2.278  -0.244   3.694
   94    HD2  PHE  13           2HD      PHE  13  -1.115   2.022   0.282
   95    HE1  PHE  13           1HE      PHE  13  -0.280   0.543   4.898
   96    HE2  PHE  13           2HE      PHE  13   0.879   2.811   1.480
   97    HZ   PHE  13           HZ       PHE  13   1.301   2.073   3.791
   98    H    GLN  14           H        GLN  14  -4.530   2.223  -0.333
   99    HA   GLN  14           HA       GLN  14  -7.111   1.075  -1.171
  100    HB2  GLN  14           2HB      GLN  14  -6.616   3.682  -0.687
  101    HB3  GLN  14           1HB      GLN  14  -6.170   3.612  -2.386
  102    HG2  GLN  14           2HG      GLN  14  -8.412   2.563  -2.823
  103    HG3  GLN  14           1HG      GLN  14  -8.828   2.946  -1.155
  104   HE21  GLN  14          1HE2      GLN  14 -10.548   4.086  -2.499
  105   HE22  GLN  14          2HE2      GLN  14 -10.227   5.735  -2.907
  106    H    TYR  15           H        TYR  15  -6.903  -0.371  -2.754
  107    HA   TYR  15           HA       TYR  15  -4.591  -0.632  -4.363
  108    HB2  TYR  15           2HB      TYR  15  -6.144  -2.508  -3.838
  109    HB3  TYR  15           1HB      TYR  15  -7.350  -1.767  -4.884
  110    HD1  TYR  15           2HD      TYR  15  -3.784  -2.894  -5.017
  111    HD2  TYR  15           1HD      TYR  15  -7.496  -2.526  -7.062
  112    HE1  TYR  15           2HE      TYR  15  -2.834  -4.092  -6.940
  113    HE2  TYR  15           1HE      TYR  15  -6.558  -3.722  -8.993
  114    HH   TYR  15           HH       TYR  15  -3.283  -4.252  -9.423
  115    H    ASP  16           H        ASP  16  -4.007   0.396  -6.147
  116    HA   ASP  16           HA       ASP  16  -5.982   2.100  -7.498
  117    HB2  ASP  16           2HB      ASP  16  -3.835   3.078  -6.498
  118    HB3  ASP  16           1HB      ASP  16  -2.985   2.269  -7.808
  119    H    GLU  17           H        GLU  17  -6.907   0.561  -8.855
  120    HA   GLU  17           HA       GLU  17  -5.594  -1.339 -10.401
  121    HB2  GLU  17           2HB      GLU  17  -7.604  -1.068 -11.977
  122    HB3  GLU  17           1HB      GLU  17  -7.920  -1.560 -10.320
  123    HG2  GLU  17           2HG      GLU  17  -8.986   0.370  -9.801
  124    HG3  GLU  17           1HG      GLU  17  -7.994   1.343 -10.887
  125    H    ASP  18           H        ASP  18  -5.882   2.094 -10.891
  126    HA   ASP  18           HA       ASP  18  -5.511   2.496 -13.551
  127    HB2  ASP  18           2HB      ASP  18  -5.431   4.116 -11.396
  128    HB3  ASP  18           1HB      ASP  18  -3.719   4.093 -11.804
  129    H    SER  19           H        SER  19  -2.902   1.808 -11.204
  130    HA   SER  19           HA       SER  19  -1.356   0.560 -13.322
  131    HB2  SER  19           2HB      SER  19  -0.485   3.087 -11.936
  132    HB3  SER  19           1HB      SER  19   0.699   1.955 -12.584
  133    HG   SER  19           HG       SER  19  -0.728   3.798 -13.886
  134    H    GLU  20           H        GLU  20  -2.636  -0.369 -10.876
  135    HA   GLU  20           HA       GLU  20  -2.257  -1.659  -9.038
  136    HB2  GLU  20           2HB      GLU  20   0.400  -2.294 -10.310
  137    HB3  GLU  20           1HB      GLU  20  -0.560  -3.317  -9.249
  138    HG2  GLU  20           2HG      GLU  20  -2.128  -3.777 -10.929
  139    HG3  GLU  20           1HG      GLU  20  -1.567  -2.442 -11.935
  140    H    THR  21           H        THR  21  -2.036   0.468  -7.878
  141    HA   THR  21           HA       THR  21   0.525   0.502  -6.442
  142    HB   THR  21           HB       THR  21  -0.893   3.034  -7.298
  143    HG1  THR  21           1HG      THR  21   1.290   1.676  -8.485
  144   HG21  THR  21          3HG2      THR  21   1.824   2.549  -6.106
  145   HG22  THR  21          1HG2      THR  21   0.473   3.415  -5.375
  146   HG23  THR  21          2HG2      THR  21   1.288   4.085  -6.788
  147    H    TYR  22           H        TYR  22   0.395   1.333  -4.279
  148    HA   TYR  22           HA       TYR  22  -2.357   1.445  -3.218
  149    HB2  TYR  22           2HB      TYR  22   0.074   0.326  -1.805
  150    HB3  TYR  22           1HB      TYR  22  -1.568   0.371  -1.176
  151    HD1  TYR  22           2HD      TYR  22   0.518  -1.074  -3.891
  152    HD2  TYR  22           1HD      TYR  22  -3.060  -1.393  -1.608
  153    HE1  TYR  22           2HE      TYR  22   0.090  -3.282  -4.879
  154    HE2  TYR  22           1HE      TYR  22  -3.495  -3.603  -2.590
  155    HH   TYR  22           HH       TYR  22  -1.875  -5.491  -3.668
  156    H    PHE  23           H        PHE  23  -2.888   3.176  -2.021
  157    HA   PHE  23           HA       PHE  23  -0.707   4.985  -1.200
  158    HB2  PHE  23           2HB      PHE  23  -3.468   5.647  -2.230
  159    HB3  PHE  23           1HB      PHE  23  -2.424   6.828  -1.449
  160    HD1  PHE  23           2HD      PHE  23  -2.261   4.311  -4.206
  161    HD2  PHE  23           1HD      PHE  23  -1.157   8.176  -2.803
  162    HE1  PHE  23           2HE      PHE  23  -1.188   4.786  -6.367
  163    HE2  PHE  23           1HE      PHE  23  -0.085   8.657  -4.963
  164    HZ   PHE  23           HZ       PHE  23  -0.096   6.961  -6.748
  165    H    TYR  24           H        TYR  24  -0.987   6.192   0.731
  166    HA   TYR  24           HA       TYR  24  -3.057   5.163   2.557
  167    HB2  TYR  24           2HB      TYR  24  -0.699   4.218   2.931
  168    HB3  TYR  24           1HB      TYR  24  -0.266   5.835   3.478
  169    HD1  TYR  24           2HD      TYR  24  -2.937   3.280   4.081
  170    HD2  TYR  24           1HD      TYR  24  -0.367   6.237   5.747
  171    HE1  TYR  24           2HE      TYR  24  -3.780   2.741   6.322
  172    HE2  TYR  24           1HE      TYR  24  -1.204   5.702   7.996
  173    HH   TYR  24           HH       TYR  24  -3.974   3.916   8.557
  174    HA   PRO  25           HA       PRO  25  -4.088   9.439   3.153
  175    HB2  PRO  25           2HB      PRO  25  -4.872   8.591   5.888
  176    HB3  PRO  25           1HB      PRO  25  -5.826   9.403   4.643
  177    HG2  PRO  25           2HG      PRO  25  -6.224   6.828   5.212
  178    HG3  PRO  25           1HG      PRO  25  -6.322   7.425   3.545
  179    HD2  PRO  25           2HD      PRO  25  -4.121   5.910   4.891
  180    HD3  PRO  25           1HD      PRO  25  -4.747   5.761   3.235
  181    H    CYS  26           H        CYS  26  -2.679  11.005   3.577
  182    HA   CYS  26           HA       CYS  26  -0.923  10.742   5.928
  183    HB2  CYS  26           2HB      CYS  26  -0.134  10.973   3.333
  184    HB3  CYS  26           1HB      CYS  26  -0.149  12.663   3.830
  185    HA   PRO  27           HA       PRO  27  -2.725  14.270   7.866
  186    HB2  PRO  27           2HB      PRO  27   0.071  15.163   8.370
  187    HB3  PRO  27           1HB      PRO  27  -1.259  14.930   9.510
  188    HG2  PRO  27           2HG      PRO  27   0.729  13.170   9.369
  189    HG3  PRO  27           1HG      PRO  27  -0.944  12.634   9.611
  190    HD2  PRO  27           2HD      PRO  27   0.737  12.553   7.142
  191    HD3  PRO  27           1HD      PRO  27  -0.459  11.381   7.734
  192    H    CYS  28           H        CYS  28  -0.071  14.774   5.583
  193    HA   CYS  28           HA       CYS  28  -0.533  17.575   5.267
  194    HB2  CYS  28           2HB      CYS  28   0.945  17.312   3.246
  195    HB3  CYS  28           1HB      CYS  28   1.655  16.763   4.759
  196    H    GLY  29           H        GLY  29  -1.492  14.684   3.436
  197    HA2  GLY  29           2HA      GLY  29  -3.808  14.842   2.512
  198    HA3  GLY  29           1HA      GLY  29  -3.321  16.398   1.861
  199    H    ASP  30           H        ASP  30  -0.594  15.145   1.238
  200    HA   ASP  30           HA       ASP  30  -1.112  14.527  -1.462
  201    HB2  ASP  30           2HB      ASP  30   1.279  14.487   0.305
  202    HB3  ASP  30           1HB      ASP  30   1.365  13.533  -1.170
  203    H    ASN  31           H        ASN  31  -0.654  12.505   1.375
  204    HA   ASN  31           HA       ASN  31  -1.191  10.336   1.780
  205    HB2  ASN  31           2HB      ASN  31  -2.206  10.273  -1.067
  206    HB3  ASN  31           1HB      ASN  31  -2.492   9.040   0.156
  207   HD21  ASN  31          1HD2      ASN  31  -4.444  10.559  -1.314
  208   HD22  ASN  31          2HD2      ASN  31  -5.376  11.424  -0.145
  209    H    PHE  32           H        PHE  32   0.105   8.641   1.912
  210    HA   PHE  32           HA       PHE  32   2.545   8.503   0.526
  211    HB2  PHE  32           2HB      PHE  32   1.051   6.500   2.217
  212    HB3  PHE  32           1HB      PHE  32   2.632   6.152   1.530
  213    HD1  PHE  32           2HD      PHE  32   4.522   7.818   2.086
  214    HD2  PHE  32           1HD      PHE  32   0.884   7.533   4.276
  215    HE1  PHE  32           2HE      PHE  32   5.600   8.900   4.011
  216    HE2  PHE  32           1HE      PHE  32   1.957   8.615   6.207
  217    HZ   PHE  32           HZ       PHE  32   4.319   9.299   6.076
  218    H    SER  33           H        SER  33   3.312   6.608  -0.778
  219    HA   SER  33           HA       SER  33   1.256   5.237  -2.323
  220    HB2  SER  33           2HB      SER  33   2.207   5.945  -4.487
  221    HB3  SER  33           1HB      SER  33   1.584   7.317  -3.574
  222    HG   SER  33           HG       SER  33   4.291   6.530  -3.889
  223    H    ILE  34           H        ILE  34   1.887   3.275  -3.089
  224    HA   ILE  34           HA       ILE  34   4.698   2.567  -3.235
  225    HB   ILE  34           HB       ILE  34   4.174   2.093  -0.884
  226   HG12  ILE  34          2HG1      ILE  34   4.298  -0.617  -2.138
  227   HG13  ILE  34          1HG1      ILE  34   5.575   0.535  -2.513
  228   HG21  ILE  34          1HG2      ILE  34   1.687   1.563  -1.565
  229   HG22  ILE  34          2HG2      ILE  34   2.420   0.831  -0.139
  230   HG23  ILE  34          3HG2      ILE  34   2.298  -0.089  -1.638
  231   HD11  ILE  34          3HD1      ILE  34   6.565   0.168  -0.569
  232   HD12  ILE  34          1HD1      ILE  34   5.431  -1.160  -0.324
  233   HD13  ILE  34          2HD1      ILE  34   5.067   0.441   0.320
  234    H    THR  35           H        THR  35   4.996   1.379  -5.008
  235    HA   THR  35           HA       THR  35   2.792   0.451  -6.562
  236    HB   THR  35           HB       THR  35   4.876  -0.694  -7.804
  237    HG1  THR  35           1HG      THR  35   6.448  -0.215  -6.342
  238   HG21  THR  35          3HG2      THR  35   4.230   0.841  -9.259
  239   HG22  THR  35          1HG2      THR  35   5.310   1.972  -8.445
  240   HG23  THR  35          2HG2      THR  35   3.610   1.887  -7.983
  241    H    LYS  36           H        LYS  36   2.215  -1.659  -7.121
  242    HA   LYS  36           HA       LYS  36   2.225  -3.545  -5.043
  243    HB2  LYS  36           2HB      LYS  36   0.565  -3.374  -6.949
  244    HB3  LYS  36           1HB      LYS  36   1.759  -4.174  -7.961
  245    HG2  LYS  36           2HG      LYS  36   0.989  -5.467  -5.397
  246    HG3  LYS  36           1HG      LYS  36  -0.147  -5.520  -6.746
  247    HD2  LYS  36           2HD      LYS  36   2.159  -6.213  -7.994
  248    HD3  LYS  36           1HD      LYS  36   2.441  -6.883  -6.387
  249    HE2  LYS  36           2HE      LYS  36   0.170  -7.483  -8.271
  250    HE3  LYS  36           1HE      LYS  36   1.419  -8.586  -7.696
  251    HZ1  LYS  36           3HZ      LYS  36  -0.984  -7.623  -6.333
  252    HZ2  LYS  36           1HZ      LYS  36   0.386  -7.924  -5.384
  253    HZ3  LYS  36           2HZ      LYS  36  -0.282  -9.161  -6.324
  254    H    GLU  37           H        GLU  37   4.262  -3.229  -7.912
  255    HA   GLU  37           HA       GLU  37   5.580  -5.700  -7.761
  256    HB2  GLU  37           2HB      GLU  37   5.619  -3.900  -9.623
  257    HB3  GLU  37           1HB      GLU  37   6.939  -3.190  -8.702
  258    HG2  GLU  37           2HG      GLU  37   7.792  -5.731  -8.824
  259    HG3  GLU  37           1HG      GLU  37   6.862  -5.656 -10.319
  260    H    ASP  38           H        ASP  38   6.239  -2.608  -6.174
  261    HA   ASP  38           HA       ASP  38   8.762  -3.145  -5.115
  262    HB2  ASP  38           2HB      ASP  38   6.516  -1.328  -4.398
  263    HB3  ASP  38           1HB      ASP  38   7.722  -1.623  -3.151
  264    H    LEU  39           H        LEU  39   5.552  -3.773  -3.732
  265    HA   LEU  39           HA       LEU  39   6.428  -4.886  -1.308
  266    HB2  LEU  39           2HB      LEU  39   3.914  -5.629  -2.795
  267    HB3  LEU  39           1HB      LEU  39   4.205  -5.771  -1.073
  268    HG   LEU  39           HG       LEU  39   4.366  -3.058  -2.298
  269   HD11  LEU  39          1HD1      LEU  39   2.296  -4.265  -3.166
  270   HD12  LEU  39          2HD1      LEU  39   2.050  -2.725  -2.344
  271   HD13  LEU  39          3HD1      LEU  39   1.726  -4.238  -1.497
  272   HD21  LEU  39          3HD2      LEU  39   3.646  -2.346  -0.150
  273   HD22  LEU  39          1HD2      LEU  39   4.879  -3.578   0.111
  274   HD23  LEU  39          2HD2      LEU  39   3.174  -3.981   0.309
  275    H    GLU  40           H        GLU  40   5.723  -6.393  -4.447
  276    HA   GLU  40           HA       GLU  40   6.013  -9.070  -3.662
  277    HB2  GLU  40           2HB      GLU  40   6.636  -7.829  -6.347
  278    HB3  GLU  40           1HB      GLU  40   6.411  -9.545  -6.041
  279    HG2  GLU  40           2HG      GLU  40   4.095  -8.807  -5.127
  280    HG3  GLU  40           1HG      GLU  40   4.398  -7.348  -6.069
  281    H    ASN  41           H        ASN  41   8.413  -6.629  -4.455
  282    HA   ASN  41           HA       ASN  41  10.574  -8.562  -4.520
  283    HB2  ASN  41           2HB      ASN  41  10.290  -5.658  -5.074
  284    HB3  ASN  41           1HB      ASN  41  11.870  -6.211  -4.529
  285   HD21  ASN  41          1HD2      ASN  41  11.899  -5.174  -6.913
  286   HD22  ASN  41          2HD2      ASN  41  11.976  -6.370  -8.157
  287    H    GLY  42           H        GLY  42   9.314  -6.097  -2.319
  288    HA2  GLY  42           2HA      GLY  42   9.792  -6.988   0.080
  289    HA3  GLY  42           1HA      GLY  42  11.456  -6.687  -0.401
  290    H    GLU  43           H        GLU  43  10.144  -4.334  -2.042
  291    HA   GLU  43           HA       GLU  43  10.802  -2.295  -0.193
  292    HB2  GLU  43           2HB      GLU  43   9.568  -2.317  -2.934
  293    HB3  GLU  43           1HB      GLU  43   9.665  -0.824  -2.013
  294    HG2  GLU  43           2HG      GLU  43  11.973  -2.557  -2.858
  295    HG3  GLU  43           1HG      GLU  43  11.520  -0.998  -3.542
  296    H    ASP  44           H        ASP  44   9.407  -2.853   1.582
  297    HA   ASP  44           HA       ASP  44   6.556  -2.306   1.230
  298    HB2  ASP  44           2HB      ASP  44   6.449  -3.027   3.676
  299    HB3  ASP  44           1HB      ASP  44   6.902  -4.261   2.506
  300    H    VAL  45           H        VAL  45   8.291  -0.109   0.903
  301    HA   VAL  45           HA       VAL  45   7.515   1.527   3.220
  302    HB   VAL  45           HB       VAL  45   9.927   1.222   3.296
  303   HG11  VAL  45          1HG1      VAL  45  11.337   1.371   1.546
  304   HG12  VAL  45          2HG1      VAL  45  10.476   2.735   0.833
  305   HG13  VAL  45          3HG1      VAL  45   9.877   1.094   0.596
  306   HG21  VAL  45          3HG2      VAL  45   8.869   3.409   3.913
  307   HG22  VAL  45          1HG2      VAL  45   9.331   4.010   2.320
  308   HG23  VAL  45          2HG2      VAL  45  10.572   3.513   3.470
  309    H    ALA  46           H        ALA  46   6.398   3.325   2.782
  310    HA   ALA  46           HA       ALA  46   6.153   4.124  -0.044
  311    HB1  ALA  46           1HB      ALA  46   4.133   3.238   1.454
  312    HB2  ALA  46           2HB      ALA  46   3.923   4.467   0.209
  313    HB3  ALA  46           3HB      ALA  46   4.072   4.942   1.899
  314    H    THR  47           H        THR  47   6.825   6.095  -0.592
  315    HA   THR  47           HA       THR  47   7.370   8.027   1.563
  316    HB   THR  47           HB       THR  47   8.658   8.014  -1.170
  317    HG1  THR  47           1HG      THR  47  10.133   6.664  -0.458
  318   HG21  THR  47          3HG2      THR  47  10.195   8.997   1.091
  319   HG22  THR  47          1HG2      THR  47   8.732   9.933   0.789
  320   HG23  THR  47          2HG2      THR  47   9.919   9.715  -0.496
  321    H    CYS  48           H        CYS  48   6.145   9.790   1.622
  322    HA   CYS  48           HA       CYS  48   4.191  10.330  -0.375
  323    HB2  CYS  48           2HB      CYS  48   4.444  10.958   2.272
  324    HB3  CYS  48           1HB      CYS  48   4.813  12.502   1.513
  325    HA   PRO  49           HA       PRO  49   6.659  13.015  -2.910
  326    HB2  PRO  49           2HB      PRO  49   4.770  13.847  -4.608
  327    HB3  PRO  49           1HB      PRO  49   5.299  12.160  -4.570
  328    HG2  PRO  49           2HG      PRO  49   2.833  13.399  -3.436
  329    HG3  PRO  49           1HG      PRO  49   3.037  11.828  -4.225
  330    HD2  PRO  49           2HD      PRO  49   2.936  12.259  -1.476
  331    HD3  PRO  49           1HD      PRO  49   3.581  10.808  -2.266
  332    H    SER  50           H        SER  50   5.729  14.204  -0.380
  333    HA   SER  50           HA       SER  50   5.920  16.973  -1.158
  334    HB2  SER  50           2HB      SER  50   3.535  16.813  -1.272
  335    HB3  SER  50           1HB      SER  50   3.458  15.909   0.240
  336    HG   SER  50           HG       SER  50   3.224  18.478  -0.035
  337    H    CYS  51           H        CYS  51   4.911  15.097   1.717
  338    HA   CYS  51           HA       CYS  51   6.559  16.694   3.444
  339    HB2  CYS  51           2HB      CYS  51   5.782  15.208   5.229
  340    HB3  CYS  51           1HB      CYS  51   4.436  15.768   4.243
  341    H    SER  52           H        SER  52   6.957  13.727   1.683
  342    HA   SER  52           HA       SER  52   8.732  12.343   1.378
  343    HB2  SER  52           2HB      SER  52  10.367  14.317   2.988
  344    HB3  SER  52           1HB      SER  52  10.960  13.145   1.810
  345    HG   SER  52           HG       SER  52  10.809  14.829   0.532
  346    H    LEU  53           H        LEU  53   6.982  11.795   3.464
  347    HA   LEU  53           HA       LEU  53   8.563  11.022   5.780
  348    HB2  LEU  53           2HB      LEU  53   5.688  11.230   5.118
  349    HB3  LEU  53           1HB      LEU  53   6.118   9.947   6.232
  350    HG   LEU  53           HG       LEU  53   7.094  12.725   6.753
  351   HD11  LEU  53          1HD1      LEU  53   4.300  11.791   6.832
  352   HD12  LEU  53          2HD1      LEU  53   4.953  13.422   6.674
  353   HD13  LEU  53          3HD1      LEU  53   4.871  12.655   8.260
  354   HD21  LEU  53          3HD2      LEU  53   7.111  12.012   9.023
  355   HD22  LEU  53          1HD2      LEU  53   7.860  10.731   8.070
  356   HD23  LEU  53          2HD2      LEU  53   6.199  10.553   8.637
  357    H    ILE  54           H        ILE  54   7.770   8.693   6.644
  358    HA   ILE  54           HA       ILE  54   7.929   6.768   4.431
  359    HB   ILE  54           HB       ILE  54   9.501   5.390   5.877
  360   HG12  ILE  54          2HG1      ILE  54   9.870   8.070   7.242
  361   HG13  ILE  54          1HG1      ILE  54   9.195   6.621   7.978
  362   HG21  ILE  54          1HG2      ILE  54  10.009   7.069   3.866
  363   HG22  ILE  54          2HG2      ILE  54  11.273   6.162   4.694
  364   HG23  ILE  54          3HG2      ILE  54  10.971   7.846   5.123
  365   HD11  ILE  54          3HD1      ILE  54  11.228   5.629   8.212
  366   HD12  ILE  54          1HD1      ILE  54  11.703   7.322   8.337
  367   HD13  ILE  54          2HD1      ILE  54  11.919   6.455   6.817
  368    H    ILE  55           H        ILE  55   6.898   4.828   4.762
  369    HA   ILE  55           HA       ILE  55   5.751   4.218   7.373
  370    HB   ILE  55           HB       ILE  55   3.511   3.740   6.312
  371   HG12  ILE  55          2HG1      ILE  55   4.096   5.772   4.221
  372   HG13  ILE  55          1HG1      ILE  55   4.702   4.144   3.943
  373   HG21  ILE  55          1HG2      ILE  55   3.825   5.625   7.792
  374   HG22  ILE  55          2HG2      ILE  55   2.735   6.063   6.477
  375   HG23  ILE  55          3HG2      ILE  55   4.411   6.612   6.453
  376   HD11  ILE  55          3HD1      ILE  55   1.997   5.180   3.776
  377   HD12  ILE  55          1HD1      ILE  55   2.112   3.701   4.729
  378   HD13  ILE  55          2HD1      ILE  55   2.702   3.729   3.068
  379    H    LYS  56           H        LYS  56   5.313   2.036   7.682
  380    HA   LYS  56           HA       LYS  56   6.486   0.269   5.677
  381    HB2  LYS  56           2HB      LYS  56   6.694   0.332   8.423
  382    HB3  LYS  56           1HB      LYS  56   5.542  -0.968   8.157
  383    HG2  LYS  56           2HG      LYS  56   8.115  -0.879   6.635
  384    HG3  LYS  56           1HG      LYS  56   8.051  -1.519   8.278
  385    HD2  LYS  56           2HD      LYS  56   6.033  -2.904   7.312
  386    HD3  LYS  56           1HD      LYS  56   6.832  -2.582   5.771
  387    HE2  LYS  56           2HE      LYS  56   8.655  -3.861   6.291
  388    HE3  LYS  56           1HE      LYS  56   8.502  -3.570   8.023
  389    HZ1  LYS  56           3HZ      LYS  56   6.527  -5.212   6.559
  390    HZ2  LYS  56           1HZ      LYS  56   6.850  -5.179   8.219
  391    HZ3  LYS  56           2HZ      LYS  56   7.960  -5.885   7.156
  392    H    VAL  57           H        VAL  57   5.454  -1.239   4.584
  393    HA   VAL  57           HA       VAL  57   2.537  -1.351   4.900
  394    HB   VAL  57           HB       VAL  57   3.753  -2.396   2.406
  395   HG11  VAL  57          1HG1      VAL  57   1.800  -1.213   1.450
  396   HG12  VAL  57          2HG1      VAL  57   1.395  -0.647   3.070
  397   HG13  VAL  57          3HG1      VAL  57   1.361  -2.371   2.704
  398   HG21  VAL  57          3HG2      VAL  57   3.573   0.162   1.643
  399   HG22  VAL  57          1HG2      VAL  57   5.080  -0.563   2.198
  400   HG23  VAL  57          2HG2      VAL  57   4.110   0.408   3.304
  401    H    ILE  58           H        ILE  58   1.834  -3.119   5.886
  402    HA   ILE  58           HA       ILE  58   3.435  -5.563   5.821
  403    HB   ILE  58           HB       ILE  58   0.883  -5.094   7.360
  404   HG12  ILE  58          2HG1      ILE  58   2.559  -3.404   7.987
  405   HG13  ILE  58          1HG1      ILE  58   2.288  -4.552   9.294
  406   HG21  ILE  58          1HG2      ILE  58   1.507  -6.974   8.660
  407   HG22  ILE  58          2HG2      ILE  58   3.115  -7.030   7.939
  408   HG23  ILE  58          3HG2      ILE  58   1.700  -7.446   6.972
  409   HD11  ILE  58          3HD1      ILE  58   4.611  -4.164   9.187
  410   HD12  ILE  58          1HD1      ILE  58   4.642  -4.390   7.439
  411   HD13  ILE  58          2HD1      ILE  58   4.340  -5.765   8.501
  412    H    TYR  59           H        TYR  59   2.856  -7.388   4.770
  413    HA   TYR  59           HA       TYR  59   0.160  -7.818   3.821
  414    HB2  TYR  59           2HB      TYR  59   0.969  -8.078   1.420
  415    HB3  TYR  59           1HB      TYR  59   0.855  -6.425   2.018
  416    HD1  TYR  59           2HD      TYR  59   2.907  -5.179   2.603
  417    HD2  TYR  59           1HD      TYR  59   3.078  -9.029   0.806
  418    HE1  TYR  59           2HE      TYR  59   5.258  -4.797   2.027
  419    HE2  TYR  59           1HE      TYR  59   5.438  -8.661   0.228
  420    HH   TYR  59           HH       TYR  59   6.981  -6.747  -0.131
  421    H    ASP  60           H        ASP  60   0.248  -9.871   2.258
  422    HA   ASP  60           HA       ASP  60   1.644 -11.920   3.770
  423    HB2  ASP  60           2HB      ASP  60  -0.810 -12.054   3.039
  424    HB3  ASP  60           1HB      ASP  60  -0.199 -12.345   1.415
  425    H    LYS  61           H        LYS  61   3.796 -11.679   3.128
  426    HA   LYS  61           HA       LYS  61   4.706 -11.374   0.501
  427    HB2  LYS  61           2HB      LYS  61   6.126 -12.770   2.774
  428    HB3  LYS  61           1HB      LYS  61   6.880 -12.148   1.313
  429    HG2  LYS  61           2HG      LYS  61   5.717  -9.903   2.162
  430    HG3  LYS  61           1HG      LYS  61   5.915 -10.716   3.714
  431    HD2  LYS  61           2HD      LYS  61   7.991  -9.879   3.706
  432    HD3  LYS  61           1HD      LYS  61   8.355 -11.112   2.498
  433    HE2  LYS  61           2HE      LYS  61   8.507  -9.607   0.838
  434    HE3  LYS  61           1HE      LYS  61   7.105  -8.705   1.403
  435    HZ1  LYS  61           3HZ      LYS  61   8.648  -7.167   1.887
  436    HZ2  LYS  61           1HZ      LYS  61   9.918  -8.283   1.955
  437    HZ3  LYS  61           2HZ      LYS  61   8.891  -8.089   3.284
  438    H    ASP  62           H        ASP  62   3.806 -14.261   2.297
  439    HA   ASP  62           HA       ASP  62   4.878 -16.162   0.498
  440    HB2  ASP  62           2HB      ASP  62   2.831 -16.237   2.675
  441    HB3  ASP  62           1HB      ASP  62   2.900 -17.587   1.547
  442    H    GLN  63           H        GLN  63   1.832 -14.382   0.570
  443    HA   GLN  63           HA       GLN  63   0.753 -15.919  -1.646
  444    HB2  GLN  63           2HB      GLN  63  -0.252 -13.794   0.171
  445    HB3  GLN  63           1HB      GLN  63  -0.988 -13.900  -1.423
  446    HG2  GLN  63           2HG      GLN  63  -0.728 -16.464  -0.034
  447    HG3  GLN  63           1HG      GLN  63  -1.779 -15.297   0.765
  448   HE21  GLN  63          1HE2      GLN  63  -3.177 -17.278   0.113
  449   HE22  GLN  63          2HE2      GLN  63  -4.035 -17.105  -1.376
  450    H    PHE  64           H        PHE  64   2.233 -12.770  -1.080
  451    HA   PHE  64           HA       PHE  64   1.646 -11.561  -3.533
  452    HB2  PHE  64           2HB      PHE  64   3.709 -11.153  -1.426
  453    HB3  PHE  64           1HB      PHE  64   4.000 -10.412  -2.996
  454    HD1  PHE  64           2HD      PHE  64   0.904 -10.870  -0.951
  455    HD2  PHE  64           1HD      PHE  64   3.564  -8.159  -2.877
  456    HE1  PHE  64           2HE      PHE  64  -0.569  -8.996  -0.341
  457    HE2  PHE  64           1HE      PHE  64   2.094  -6.284  -2.268
  458    HZ   PHE  64           HZ       PHE  64   0.027  -6.698  -1.000
  459    H    VAL  65           H        VAL  65   4.630 -13.311  -2.594
  460    HA   VAL  65           HA       VAL  65   5.284 -13.539  -5.448
  461    HB   VAL  65           HB       VAL  65   7.061 -12.580  -4.106
  462   HG11  VAL  65          1HG1      VAL  65   7.423 -13.218  -2.014
  463   HG12  VAL  65          2HG1      VAL  65   8.001 -14.779  -2.597
  464   HG13  VAL  65          3HG1      VAL  65   6.296 -14.560  -2.207
  465   HG21  VAL  65          3HG2      VAL  65   7.638 -15.369  -5.092
  466   HG22  VAL  65          1HG2      VAL  65   8.884 -14.203  -4.647
  467   HG23  VAL  65          2HG2      VAL  65   7.791 -13.857  -5.987
  468    H    SER  66           H        SER  66   3.938 -15.213  -6.035
  469    HA   SER  66           HA       SER  66   4.803 -17.863  -5.138
  470    HB2  SER  66           2HB      SER  66   2.563 -18.653  -4.799
  471    HB3  SER  66           1HB      SER  66   2.742 -17.169  -3.864
  472    HG   SER  66           HG       SER  66   1.197 -16.329  -5.006
  473    H    GLY  67           H        GLY  67   5.200 -16.248  -7.605
  474    HA2  GLY  67           2HA      GLY  67   3.701 -17.866  -9.556
  475    HA3  GLY  67           1HA      GLY  67   4.501 -16.340  -9.902
  476    H    GLU  68           H        GLU  68   6.880 -16.335  -9.854
  477    HA   GLU  68           HA       GLU  68   7.892 -18.758 -11.095
  478    HB2  GLU  68           2HB      GLU  68   8.804 -15.927 -10.899
  479    HB3  GLU  68           1HB      GLU  68  10.020 -17.166 -11.176
  480    HG2  GLU  68           2HG      GLU  68   8.127 -17.840 -13.010
  481    HG3  GLU  68           1HG      GLU  68   7.987 -16.083 -12.974
  482    H    THR  69           H        THR  69   7.821 -20.065  -9.160
  483    HA   THR  69           HA       THR  69  10.206 -19.655  -7.494
  484    HB   THR  69           HB       THR  69   8.336 -18.992  -6.120
  485    HG1  THR  69           1HG      THR  69   9.859 -20.165  -5.003
  486   HG21  THR  69          3HG2      THR  69   6.955 -21.479  -5.797
  487   HG22  THR  69          1HG2      THR  69   6.864 -20.944  -7.475
  488   HG23  THR  69          2HG2      THR  69   6.316 -19.880  -6.179
  489    H    VAL  70           H        VAL  70  11.507 -21.198  -8.286
  490    HA   VAL  70           HA       VAL  70  10.539 -23.978  -8.217
  491    HB   VAL  70           HB       VAL  70  12.403 -22.912 -10.340
  492   HG11  VAL  70          1HG1      VAL  70  10.908 -25.523 -10.124
  493   HG12  VAL  70          2HG1      VAL  70  12.635 -25.293  -9.845
  494   HG13  VAL  70          3HG1      VAL  70  11.959 -25.035 -11.454
  495   HG21  VAL  70          3HG2      VAL  70   9.422 -23.209 -10.347
  496   HG22  VAL  70          1HG2      VAL  70  10.350 -23.354 -11.839
  497   HG23  VAL  70          2HG2      VAL  70  10.410 -21.858 -10.905
  498    HA   PRO  71           HA       PRO  71  14.078 -24.749  -5.635
  499    HB2  PRO  71           2HB      PRO  71  14.153 -27.406  -6.962
  500    HB3  PRO  71           1HB      PRO  71  14.038 -27.008  -5.245
  501    HG2  PRO  71           2HG      PRO  71  11.920 -27.915  -6.581
  502    HG3  PRO  71           1HG      PRO  71  11.749 -26.653  -5.345
  503    HD2  PRO  71           2HD      PRO  71  11.739 -26.407  -8.326
  504    HD3  PRO  71           1HD      PRO  71  10.753 -25.553  -7.121
  505    H    ALA  72           H        ALA  72  16.361 -25.634  -5.797
  506    HA   ALA  72           HA       ALA  72  17.485 -25.217  -8.488
  507    HB1  ALA  72           1HB      ALA  72  17.712 -23.329  -6.624
  508    HB2  ALA  72           2HB      ALA  72  18.984 -23.664  -7.797
  509    HB3  ALA  72           3HB      ALA  72  19.095 -24.327  -6.168
  510    HA   PRO  73           HA       PRO  73  19.747 -28.964  -7.832
  511    HB2  PRO  73           2HB      PRO  73  21.881 -28.553  -9.450
  512    HB3  PRO  73           1HB      PRO  73  20.257 -28.861 -10.076
  513    HG2  PRO  73           2HG      PRO  73  21.692 -26.253  -9.737
  514    HG3  PRO  73           1HG      PRO  73  20.735 -26.831 -11.115
  515    HD2  PRO  73           2HD      PRO  73  19.738 -25.121  -9.270
  516    HD3  PRO  73           1HD      PRO  73  18.729 -26.326 -10.095
  517    H    SER  74           H        SER  74  22.203 -29.651  -7.525
  518    HA   SER  74           HA       SER  74  23.056 -28.354  -5.104
  519    HB2  SER  74           2HB      SER  74  23.784 -30.844  -6.567
  520    HB3  SER  74           1HB      SER  74  24.994 -30.159  -5.481
  521    HG   SER  74           HG       SER  74  23.892 -31.011  -3.923
  522    H    ALA  75           H        ALA  75  24.471 -26.770  -4.931
  523    HA   ALA  75           HA       ALA  75  26.180 -25.328  -5.320
  524    HB1  ALA  75           1HB      ALA  75  27.315 -27.662  -5.818
  525    HB2  ALA  75           2HB      ALA  75  28.148 -26.141  -6.132
  526    HB3  ALA  75           3HB      ALA  75  27.375 -27.012  -7.456
  527    H    ASN  76           H        ASN  76  25.196 -23.592  -6.212
  528    HA   ASN  76           HA       ASN  76  24.563 -23.609  -9.068
  529    HB2  ASN  76           2HB      ASN  76  23.412 -21.464  -8.608
  530    HB3  ASN  76           1HB      ASN  76  22.815 -22.775  -7.599
  531   HD21  ASN  76          1HD2      ASN  76  22.822 -19.814  -7.265
  532   HD22  ASN  76          2HD2      ASN  76  23.542 -19.546  -5.718
  533    H    LYS  77           H        LYS  77  27.318 -23.640  -8.424
  534    HA   LYS  77           HA       LYS  77  28.135 -21.132  -9.678
  535    HB2  LYS  77           2HB      LYS  77  28.994 -22.091  -6.990
  536    HB3  LYS  77           1HB      LYS  77  30.218 -21.369  -8.024
  537    HG2  LYS  77           2HG      LYS  77  27.654 -19.914  -7.642
  538    HG3  LYS  77           1HG      LYS  77  28.831 -19.925  -6.328
  539    HD2  LYS  77           2HD      LYS  77  29.664 -18.126  -7.401
  540    HD3  LYS  77           1HD      LYS  77  30.441 -19.338  -8.419
  541    HE2  LYS  77           2HE      LYS  77  29.465 -18.186 -10.092
  542    HE3  LYS  77           1HE      LYS  77  28.047 -19.136  -9.648
  543    HZ1  LYS  77           3HZ      LYS  77  27.503 -17.235  -8.089
  544    HZ2  LYS  77           1HZ      LYS  77  27.319 -16.930  -9.744
  545    HZ3  LYS  77           2HZ      LYS  77  28.672 -16.337  -8.920
  546    H    GLU  78           H        GLU  78  28.891 -21.934 -11.558
  547    HA   GLU  78           HA       GLU  78  30.546 -24.349 -11.517
  548    HB2  GLU  78           2HB      GLU  78  28.566 -23.684 -13.214
  549    HB3  GLU  78           1HB      GLU  78  29.928 -22.987 -14.082
  550    HG2  GLU  78           2HG      GLU  78  30.235 -25.759 -13.093
  551    HG3  GLU  78           1HG      GLU  78  29.118 -25.494 -14.430
  552    H    LEU  79           H        LEU  79  32.676 -24.076 -11.286
  553    HA   LEU  79           HA       LEU  79  34.062 -22.163 -12.946
  554    HB2  LEU  79           2HB      LEU  79  35.260 -21.118 -11.028
  555    HB3  LEU  79           1HB      LEU  79  33.561 -20.706 -11.128
  556    HG   LEU  79           HG       LEU  79  34.282 -22.982  -9.362
  557   HD11  LEU  79          1HD1      LEU  79  35.233 -20.200  -8.976
  558   HD12  LEU  79          2HD1      LEU  79  35.947 -21.727  -8.458
  559   HD13  LEU  79          3HD1      LEU  79  34.582 -21.047  -7.573
  560   HD21  LEU  79          3HD2      LEU  79  32.573 -21.719  -7.933
  561   HD22  LEU  79          1HD2      LEU  79  31.998 -22.480  -9.416
  562   HD23  LEU  79          2HD2      LEU  79  32.284 -20.741  -9.372
  563    H    VAL  80           H        VAL  80  34.486 -24.574 -13.527
  564    HA   VAL  80           HA       VAL  80  37.069 -25.272 -12.329
  565    HB   VAL  80           HB       VAL  80  34.965 -27.372 -12.867
  566   HG11  VAL  80          1HG1      VAL  80  37.263 -27.858 -11.070
  567   HG12  VAL  80          2HG1      VAL  80  37.623 -27.723 -12.792
  568   HG13  VAL  80          3HG1      VAL  80  36.473 -28.934 -12.223
  569   HG21  VAL  80          3HG2      VAL  80  35.734 -26.037 -10.280
  570   HG22  VAL  80          1HG2      VAL  80  34.864 -27.570 -10.366
  571   HG23  VAL  80          2HG2      VAL  80  34.139 -26.106 -11.032
  572    H    LYS  81           H        LYS  81  38.548 -25.503 -13.874
  573    HA   LYS  81           HA       LYS  81  39.568 -25.842 -15.872
  574    HB2  LYS  81           2HB      LYS  81  37.386 -27.871 -15.897
  575    HB3  LYS  81           1HB      LYS  81  38.247 -27.576 -17.401
  576    HG2  LYS  81           2HG      LYS  81  40.369 -27.887 -15.903
  577    HG3  LYS  81           1HG      LYS  81  39.242 -28.733 -14.841
  578    HD2  LYS  81           2HD      LYS  81  38.609 -30.203 -16.705
  579    HD3  LYS  81           1HD      LYS  81  39.757 -29.364 -17.749
  580    HE2  LYS  81           2HE      LYS  81  40.776 -30.484 -15.192
  581    HE3  LYS  81           1HE      LYS  81  40.368 -31.619 -16.477
  582    HZ1  LYS  81           3HZ      LYS  81  42.002 -29.312 -17.210
  583    HZ2  LYS  81           1HZ      LYS  81  42.062 -30.905 -17.777
  584    HZ3  LYS  81           2HZ      LYS  81  42.746 -30.513 -16.280
  585    H    LEU  82           H        LEU  82  39.370 -23.790 -16.716
  586    HA   LEU  82           HA       LEU  82  36.991 -23.059 -18.215
  587    HB2  LEU  82           2HB      LEU  82  39.563 -21.562 -17.700
  588    HB3  LEU  82           1HB      LEU  82  38.188 -20.907 -18.566
  589    HG   LEU  82           HG       LEU  82  37.830 -21.915 -15.769
  590   HD11  LEU  82          1HD1      LEU  82  38.559 -19.063 -16.292
  591   HD12  LEU  82          2HD1      LEU  82  39.818 -20.270 -16.030
  592   HD13  LEU  82          3HD1      LEU  82  38.608 -19.975 -14.782
  593   HD21  LEU  82          3HD2      LEU  82  35.872 -20.780 -15.820
  594   HD22  LEU  82          1HD2      LEU  82  36.052 -21.012 -17.558
  595   HD23  LEU  82          2HD2      LEU  82  36.522 -19.481 -16.821
  596    H    GLU  83           H        GLU  83  36.821 -24.050 -20.136
  597    HA   GLU  83           HA       GLU  83  39.187 -24.278 -21.858
  598    HB2  GLU  83           2HB      GLU  83  37.364 -26.161 -21.270
  599    HB3  GLU  83           1HB      GLU  83  36.588 -25.456 -22.681
  600    HG2  GLU  83           2HG      GLU  83  39.450 -26.059 -22.983
  601    HG3  GLU  83           1HG      GLU  83  38.394 -27.454 -22.772
  602    H    HIS  84           H        HIS  84  35.959 -22.869 -21.727
  603    HA   HIS  84           HA       HIS  84  34.910 -21.287 -22.968
  604    HB2  HIS  84           2HB      HIS  84  37.744 -20.675 -23.835
  605    HB3  HIS  84           1HB      HIS  84  36.352 -19.688 -24.263
  606    HD1  HIS  84           1HD      HIS  84  38.866 -20.150 -21.676
  607    HD2  HIS  84           2HD      HIS  84  35.059 -18.503 -21.920
  608    HE1  HIS  84           1HE      HIS  84  38.641 -18.675 -19.652
  609    HE2  HIS  84           2HE      HIS  84  36.370 -17.605 -19.880
  Start of MODEL    5
    1    H1   MET   1           1HT      MET   1  12.449  10.293  11.860
    2    H2   MET   1           2HT      MET   1  12.954  11.574  12.883
    3    H3   MET   1           3HT      MET   1  13.746  10.054  12.954
    4    HA   MET   1           HA       MET   1  13.757  11.991  10.737
    5    HB2  MET   1           2HB      MET   1  15.917  10.931  12.575
    6    HB3  MET   1           1HB      MET   1  16.183  12.036  11.233
    7    HG2  MET   1           2HG      MET   1  14.425  13.508  12.487
    8    HG3  MET   1           1HG      MET   1  14.902  12.531  13.874
    9    HE1  MET   1           2HE      MET   1  17.551  11.775  13.559
   10    HE2  MET   1           3HE      MET   1  17.764  12.845  14.944
   11    HE3  MET   1           1HE      MET   1  18.818  13.001  13.540
   12    H    ALA   2           H        ALA   2  15.484   9.052  11.816
   13    HA   ALA   2           HA       ALA   2  15.653   8.191   9.022
   14    HB1  ALA   2           1HB      ALA   2  17.775   7.989   9.799
   15    HB2  ALA   2           2HB      ALA   2  17.177   6.396  10.264
   16    HB3  ALA   2           3HB      ALA   2  17.260   7.692  11.459
   17    H    VAL   3           H        VAL   3  14.623   6.999  12.211
   18    HA   VAL   3           HA       VAL   3  13.761   4.456  11.343
   19    HB   VAL   3           HB       VAL   3  12.429   4.391  13.442
   20   HG11  VAL   3          1HG1      VAL   3  15.051   5.477  14.286
   21   HG12  VAL   3          2HG1      VAL   3  15.065   4.131  13.147
   22   HG13  VAL   3          3HG1      VAL   3  14.262   3.958  14.708
   23   HG21  VAL   3          3HG2      VAL   3  13.581   6.957  14.364
   24   HG22  VAL   3          1HG2      VAL   3  12.050   6.185  14.780
   25   HG23  VAL   3          2HG2      VAL   3  12.213   7.056  13.256
   26    H    PHE   4           H        PHE   4  11.538   3.667  11.262
   27    HA   PHE   4           HA       PHE   4   9.934   5.246   9.511
   28    HB2  PHE   4           2HB      PHE   4   9.728   2.527  10.729
   29    HB3  PHE   4           1HB      PHE   4   8.272   3.250  10.056
   30    HD1  PHE   4           1HD      PHE   4  11.859   2.819   9.086
   31    HD2  PHE   4           2HD      PHE   4   7.773   2.694   7.902
   32    HE1  PHE   4           1HE      PHE   4  12.535   2.085   6.838
   33    HE2  PHE   4           2HE      PHE   4   8.443   1.960   5.653
   34    HZ   PHE   4           HZ       PHE   4  10.827   1.655   5.118
   35    H    HIS   5           H        HIS   5   7.588   5.639   9.886
   36    HA   HIS   5           HA       HIS   5   7.233   6.877  12.495
   37    HB2  HIS   5           2HB      HIS   5   6.647   7.849  10.088
   38    HB3  HIS   5           1HB      HIS   5   5.124   7.022  10.391
   39    HD1  HIS   5           1HD      HIS   5   4.071   7.703  12.896
   40    HD2  HIS   5           2HD      HIS   5   6.652  10.375  11.028
   41    HE1  HIS   5           1HE      HIS   5   3.643   9.928  13.986
   42    HE2  HIS   5           2HE      HIS   5   5.132  11.550  12.759
   43    H    ASP   6           H        ASP   6   5.020   5.007  10.387
   44    HA   ASP   6           HA       ASP   6   4.293   3.321  12.654
   45    HB2  ASP   6           2HB      ASP   6   2.432   5.226  11.266
   46    HB3  ASP   6           1HB      ASP   6   1.811   3.721  11.938
   47    H    GLU   7           H        GLU   7   2.889   1.489  12.004
   48    HA   GLU   7           HA       GLU   7   3.429   0.688   9.216
   49    HB2  GLU   7           2HB      GLU   7   3.017  -1.153  11.578
   50    HB3  GLU   7           1HB      GLU   7   3.550  -1.598   9.963
   51    HG2  GLU   7           2HG      GLU   7   5.612  -1.495  10.786
   52    HG3  GLU   7           1HG      GLU   7   5.422   0.256  10.710
   53    H    VAL   8           H        VAL   8   1.759   0.066   7.948
   54    HA   VAL   8           HA       VAL   8  -0.860  -0.384   9.213
   55    HB   VAL   8           HB       VAL   8  -0.517   1.206   6.671
   56   HG11  VAL   8          1HG1      VAL   8  -2.754   1.303   6.552
   57   HG12  VAL   8          2HG1      VAL   8  -2.940   1.497   8.295
   58   HG13  VAL   8          3HG1      VAL   8  -2.709  -0.110   7.604
   59   HG21  VAL   8          3HG2      VAL   8  -1.410   3.044   8.390
   60   HG22  VAL   8          1HG2      VAL   8   0.305   2.781   8.083
   61   HG23  VAL   8          2HG2      VAL   8  -0.456   2.066   9.503
   62    H    GLU   9           H        GLU   9  -2.135  -1.937   8.286
   63    HA   GLU   9           HA       GLU   9  -0.889  -3.899   6.671
   64    HB2  GLU   9           2HB      GLU   9  -3.730  -3.489   7.588
   65    HB3  GLU   9           1HB      GLU   9  -3.286  -4.823   6.533
   66    HG2  GLU   9           2HG      GLU   9  -1.878  -5.777   8.180
   67    HG3  GLU   9           1HG      GLU   9  -1.964  -4.332   9.185
   68    H    ILE  10           H        ILE  10  -1.057  -4.381   4.547
   69    HA   ILE  10           HA       ILE  10  -1.472  -2.358   2.683
   70    HB   ILE  10           HB       ILE  10  -0.118  -4.404   2.306
   71   HG12  ILE  10          2HG1      ILE  10  -1.003  -4.761  -0.102
   72   HG13  ILE  10          1HG1      ILE  10  -2.189  -3.529   0.315
   73   HG21  ILE  10          1HG2      ILE  10  -2.816  -5.708   2.010
   74   HG22  ILE  10          2HG2      ILE  10  -1.530  -6.127   3.141
   75   HG23  ILE  10          3HG2      ILE  10  -1.313  -6.414   1.415
   76   HD11  ILE  10          3HD1      ILE  10   0.142  -2.965  -0.816
   77   HD12  ILE  10          1HD1      ILE  10   0.641  -2.902   0.874
   78   HD13  ILE  10          2HD1      ILE  10  -0.664  -1.864   0.299
   79    H    GLU  11           H        GLU  11  -3.740  -4.677   4.018
   80    HA   GLU  11           HA       GLU  11  -5.775  -4.501   2.092
   81    HB2  GLU  11           2HB      GLU  11  -5.451  -5.911   4.386
   82    HB3  GLU  11           1HB      GLU  11  -6.621  -4.712   4.920
   83    HG2  GLU  11           2HG      GLU  11  -8.234  -5.430   3.394
   84    HG3  GLU  11           1HG      GLU  11  -7.054  -6.307   2.421
   85    H    ASP  12           H        ASP  12  -4.871  -2.373   4.731
   86    HA   ASP  12           HA       ASP  12  -7.246  -0.790   4.687
   87    HB2  ASP  12           2HB      ASP  12  -5.281  -1.052   6.488
   88    HB3  ASP  12           1HB      ASP  12  -4.696   0.389   5.659
   89    H    PHE  13           H        PHE  13  -4.232  -0.743   2.926
   90    HA   PHE  13           HA       PHE  13  -4.286   1.910   1.993
   91    HB2  PHE  13           2HB      PHE  13  -3.018  -0.625   0.998
   92    HB3  PHE  13           1HB      PHE  13  -2.944   0.839   0.026
   93    HD1  PHE  13           2HD      PHE  13  -2.359  -0.186   3.578
   94    HD2  PHE  13           1HD      PHE  13  -1.062   2.122   0.243
   95    HE1  PHE  13           2HE      PHE  13  -0.403   0.568   4.864
   96    HE2  PHE  13           1HE      PHE  13   0.896   2.876   1.523
   97    HZ   PHE  13           HZ       PHE  13   1.228   2.102   3.838
   98    H    GLN  14           H        GLN  14  -4.722   2.621  -0.234
   99    HA   GLN  14           HA       GLN  14  -7.233   1.465  -1.198
  100    HB2  GLN  14           2HB      GLN  14  -6.849   3.985  -0.677
  101    HB3  GLN  14           1HB      GLN  14  -6.022   4.016  -2.227
  102    HG2  GLN  14           2HG      GLN  14  -8.337   2.770  -2.897
  103    HG3  GLN  14           1HG      GLN  14  -8.883   3.847  -1.613
  104   HE21  GLN  14          1HE2      GLN  14  -9.764   4.125  -4.204
  105   HE22  GLN  14          2HE2      GLN  14  -9.137   5.591  -4.869
  106    H    TYR  15           H        TYR  15  -6.242  -0.369  -2.206
  107    HA   TYR  15           HA       TYR  15  -4.266  -0.111  -4.222
  108    HB2  TYR  15           2HB      TYR  15  -4.634  -2.233  -3.061
  109    HB3  TYR  15           1HB      TYR  15  -6.253  -2.343  -3.744
  110    HD1  TYR  15           2HD      TYR  15  -2.665  -2.170  -4.725
  111    HD2  TYR  15           1HD      TYR  15  -6.586  -3.438  -5.786
  112    HE1  TYR  15           2HE      TYR  15  -1.748  -3.352  -6.673
  113    HE2  TYR  15           1HE      TYR  15  -5.680  -4.622  -7.742
  114    HH   TYR  15           HH       TYR  15  -3.462  -4.316  -9.219
  115    H    ASP  16           H        ASP  16  -4.485  -0.409  -6.486
  116    HA   ASP  16           HA       ASP  16  -7.134  -0.035  -7.646
  117    HB2  ASP  16           2HB      ASP  16  -5.841   2.213  -7.195
  118    HB3  ASP  16           1HB      ASP  16  -4.932   1.746  -8.629
  119    H    GLU  17           H        GLU  17  -7.358  -1.416  -9.291
  120    HA   GLU  17           HA       GLU  17  -5.208  -2.986 -10.259
  121    HB2  GLU  17           2HB      GLU  17  -6.893  -3.726 -12.002
  122    HB3  GLU  17           1HB      GLU  17  -7.354  -3.978 -10.325
  123    HG2  GLU  17           2HG      GLU  17  -8.917  -2.244 -10.372
  124    HG3  GLU  17           1HG      GLU  17  -8.235  -1.546 -11.839
  125    H    ASP  18           H        ASP  18  -6.632   0.005 -11.330
  126    HA   ASP  18           HA       ASP  18  -5.815   0.074 -13.990
  127    HB2  ASP  18           2HB      ASP  18  -6.406   2.173 -11.940
  128    HB3  ASP  18           1HB      ASP  18  -5.706   2.656 -13.482
  129    H    SER  19           H        SER  19  -4.139   1.628 -11.234
  130    HA   SER  19           HA       SER  19  -1.702   1.774 -12.839
  131    HB2  SER  19           2HB      SER  19  -2.525   3.020 -10.217
  132    HB3  SER  19           1HB      SER  19  -0.871   3.107 -10.820
  133    HG   SER  19           HG       SER  19  -1.476   4.488 -12.311
  134    H    GLU  20           H        GLU  20  -3.052  -0.113 -10.284
  135    HA   GLU  20           HA       GLU  20  -2.286  -1.899  -9.115
  136    HB2  GLU  20           2HB      GLU  20   0.169  -1.834 -10.869
  137    HB3  GLU  20           1HB      GLU  20  -0.492  -3.212 -10.004
  138    HG2  GLU  20           2HG      GLU  20  -2.441  -3.212 -11.460
  139    HG3  GLU  20           1HG      GLU  20  -1.820  -1.798 -12.307
  140    H    THR  21           H        THR  21  -1.922   0.488  -7.926
  141    HA   THR  21           HA       THR  21   0.557   0.077  -6.420
  142    HB   THR  21           HB       THR  21  -0.375   2.768  -7.458
  143    HG1  THR  21           1HG      THR  21   1.310   2.665  -8.823
  144   HG21  THR  21          3HG2      THR  21   1.280   3.827  -6.318
  145   HG22  THR  21          1HG2      THR  21   2.291   2.388  -6.218
  146   HG23  THR  21          2HG2      THR  21   0.894   2.558  -5.157
  147    H    TYR  22           H        TYR  22   0.427   0.655  -4.235
  148    HA   TYR  22           HA       TYR  22  -2.305   1.057  -3.245
  149    HB2  TYR  22           2HB      TYR  22   0.193   0.204  -1.761
  150    HB3  TYR  22           1HB      TYR  22  -1.421   0.308  -1.071
  151    HD1  TYR  22           1HD      TYR  22   0.701  -1.536  -3.465
  152    HD2  TYR  22           2HD      TYR  22  -3.018  -1.434  -1.399
  153    HE1  TYR  22           1HE      TYR  22   0.280  -3.866  -4.123
  154    HE2  TYR  22           2HE      TYR  22  -3.447  -3.767  -2.050
  155    HH   TYR  22           HH       TYR  22  -1.080  -5.802  -3.293
  156    H    PHE  23           H        PHE  23  -2.883   2.769  -1.930
  157    HA   PHE  23           HA       PHE  23  -0.810   4.804  -1.426
  158    HB2  PHE  23           2HB      PHE  23  -3.664   5.404  -2.223
  159    HB3  PHE  23           1HB      PHE  23  -2.368   6.569  -1.977
  160    HD1  PHE  23           2HD      PHE  23  -3.548   3.832  -4.157
  161    HD2  PHE  23           1HD      PHE  23  -0.845   7.088  -3.702
  162    HE1  PHE  23           2HE      PHE  23  -2.958   3.668  -6.538
  163    HE2  PHE  23           1HE      PHE  23  -0.250   6.931  -6.084
  164    HZ   PHE  23           HZ       PHE  23  -1.307   5.218  -7.506
  165    H    TYR  24           H        TYR  24  -1.238   6.266   0.350
  166    HA   TYR  24           HA       TYR  24  -3.254   5.371   2.280
  167    HB2  TYR  24           2HB      TYR  24  -0.968   4.295   2.718
  168    HB3  TYR  24           1HB      TYR  24  -0.418   5.909   3.154
  169    HD1  TYR  24           1HD      TYR  24  -2.949   3.321   4.008
  170    HD2  TYR  24           2HD      TYR  24  -0.786   6.747   5.314
  171    HE1  TYR  24           1HE      TYR  24  -3.825   3.001   6.280
  172    HE2  TYR  24           2HE      TYR  24  -1.654   6.434   7.592
  173    HH   TYR  24           HH       TYR  24  -2.566   4.565   8.984
  174    HA   PRO  25           HA       PRO  25  -3.849   9.767   2.637
  175    HB2  PRO  25           2HB      PRO  25  -5.241   9.802   4.979
  176    HB3  PRO  25           1HB      PRO  25  -5.952   9.333   3.430
  177    HG2  PRO  25           2HG      PRO  25  -4.915   7.600   5.641
  178    HG3  PRO  25           1HG      PRO  25  -6.388   7.416   4.671
  179    HD2  PRO  25           2HD      PRO  25  -4.157   5.983   4.179
  180    HD3  PRO  25           1HD      PRO  25  -5.249   6.505   2.882
  181    H    CYS  26           H        CYS  26  -2.371  11.210   3.240
  182    HA   CYS  26           HA       CYS  26  -0.774  10.715   5.638
  183    HB2  CYS  26           2HB      CYS  26  -0.089  11.566   3.090
  184    HB3  CYS  26           1HB      CYS  26  -0.030  13.044   4.046
  185    HA   PRO  27           HA       PRO  27  -2.884  13.857   7.933
  186    HB2  PRO  27           2HB      PRO  27  -0.952  14.504   9.725
  187    HB3  PRO  27           1HB      PRO  27  -1.876  13.000   9.805
  188    HG2  PRO  27           2HG      PRO  27   0.871  13.479   8.718
  189    HG3  PRO  27           1HG      PRO  27   0.282  12.141   9.720
  190    HD2  PRO  27           2HD      PRO  27   0.621  11.925   7.040
  191    HD3  PRO  27           1HD      PRO  27  -0.637  11.035   7.923
  192    H    CYS  28           H        CYS  28   0.021  14.511   6.168
  193    HA   CYS  28           HA       CYS  28   0.131  17.313   6.793
  194    HB2  CYS  28           2HB      CYS  28   1.864  17.431   5.073
  195    HB3  CYS  28           1HB      CYS  28   2.157  16.073   6.152
  196    H    GLY  29           H        GLY  29  -1.171  15.343   4.153
  197    HA2  GLY  29           2HA      GLY  29  -3.298  16.824   3.430
  198    HA3  GLY  29           1HA      GLY  29  -1.987  17.674   2.631
  199    H    ASP  30           H        ASP  30  -0.379  15.672   1.745
  200    HA   ASP  30           HA       ASP  30  -1.902  14.632  -0.468
  201    HB2  ASP  30           2HB      ASP  30   0.647  15.494  -0.226
  202    HB3  ASP  30           1HB      ASP  30   0.906  13.760  -0.065
  203    H    ASN  31           H        ASN  31  -0.682  12.202  -1.028
  204    HA   ASN  31           HA       ASN  31  -1.295  10.486   1.276
  205    HB2  ASN  31           2HB      ASN  31  -2.305   9.946  -1.526
  206    HB3  ASN  31           1HB      ASN  31  -2.619   8.983  -0.088
  207   HD21  ASN  31          1HD2      ASN  31  -4.519   9.301   0.828
  208   HD22  ASN  31          2HD2      ASN  31  -5.482  10.730   0.703
  209    H    PHE  32           H        PHE  32  -0.058   8.663   1.459
  210    HA   PHE  32           HA       PHE  32   2.435   8.553   0.136
  211    HB2  PHE  32           2HB      PHE  32   0.955   6.588   1.881
  212    HB3  PHE  32           1HB      PHE  32   2.527   6.209   1.190
  213    HD1  PHE  32           1HD      PHE  32   4.376   8.061   1.628
  214    HD2  PHE  32           2HD      PHE  32   0.881   7.486   3.989
  215    HE1  PHE  32           1HE      PHE  32   5.482   9.161   3.531
  216    HE2  PHE  32           2HE      PHE  32   1.982   8.588   5.893
  217    HZ   PHE  32           HZ       PHE  32   4.285   9.426   5.665
  218    H    SER  33           H        SER  33   3.252   6.591  -1.056
  219    HA   SER  33           HA       SER  33   1.263   5.138  -2.596
  220    HB2  SER  33           2HB      SER  33   2.431   5.788  -4.762
  221    HB3  SER  33           1HB      SER  33   1.444   7.043  -4.015
  222    HG   SER  33           HG       SER  33   4.258   6.791  -3.701
  223    H    ILE  34           H        ILE  34   1.954   3.180  -3.293
  224    HA   ILE  34           HA       ILE  34   4.775   2.531  -3.410
  225    HB   ILE  34           HB       ILE  34   4.291   2.156  -1.037
  226   HG12  ILE  34          2HG1      ILE  34   4.434  -0.639  -1.995
  227   HG13  ILE  34          1HG1      ILE  34   5.603   0.467  -2.711
  228   HG21  ILE  34          1HG2      ILE  34   2.498  -0.133  -1.542
  229   HG22  ILE  34          2HG2      ILE  34   1.799   1.472  -1.756
  230   HG23  ILE  34          3HG2      ILE  34   2.522   1.024  -0.212
  231   HD11  ILE  34          3HD1      ILE  34   5.741  -0.837  -0.233
  232   HD12  ILE  34          1HD1      ILE  34   5.525   0.879   0.110
  233   HD13  ILE  34          2HD1      ILE  34   6.863   0.345  -0.905
  234    H    THR  35           H        THR  35   5.086   1.255  -5.123
  235    HA   THR  35           HA       THR  35   2.882   0.239  -6.616
  236    HB   THR  35           HB       THR  35   4.776  -0.852  -7.982
  237    HG1  THR  35           1HG      THR  35   6.823  -0.183  -7.517
  238   HG21  THR  35          3HG2      THR  35   3.719   1.623  -8.138
  239   HG22  THR  35          1HG2      THR  35   4.927   0.986  -9.247
  240   HG23  THR  35          2HG2      THR  35   5.425   2.006  -7.896
  241    H    LYS  36           H        LYS  36   2.327  -1.897  -7.093
  242    HA   LYS  36           HA       LYS  36   2.354  -3.695  -4.934
  243    HB2  LYS  36           2HB      LYS  36   0.610  -3.687  -6.667
  244    HB3  LYS  36           1HB      LYS  36   1.780  -4.241  -7.855
  245    HG2  LYS  36           2HG      LYS  36   1.276  -5.849  -5.388
  246    HG3  LYS  36           1HG      LYS  36   0.159  -5.933  -6.751
  247    HD2  LYS  36           2HD      LYS  36   2.866  -6.135  -7.690
  248    HD3  LYS  36           1HD      LYS  36   2.583  -7.323  -6.417
  249    HE2  LYS  36           2HE      LYS  36   1.912  -8.499  -8.265
  250    HE3  LYS  36           1HE      LYS  36   0.383  -7.786  -7.751
  251    HZ1  LYS  36           3HZ      LYS  36   0.351  -7.248  -9.947
  252    HZ2  LYS  36           1HZ      LYS  36   2.035  -7.161 -10.085
  253    HZ3  LYS  36           2HZ      LYS  36   1.177  -5.889  -9.373
  254    H    GLU  37           H        GLU  37   4.359  -3.480  -7.833
  255    HA   GLU  37           HA       GLU  37   5.686  -5.942  -7.599
  256    HB2  GLU  37           2HB      GLU  37   5.699  -4.197  -9.526
  257    HB3  GLU  37           1HB      GLU  37   7.048  -3.482  -8.653
  258    HG2  GLU  37           2HG      GLU  37   7.938  -5.964  -8.704
  259    HG3  GLU  37           1HG      GLU  37   6.876  -6.063 -10.107
  260    H    ASP  38           H        ASP  38   6.330  -2.788  -6.138
  261    HA   ASP  38           HA       ASP  38   8.870  -3.256  -5.088
  262    HB2  ASP  38           2HB      ASP  38   6.613  -1.439  -4.414
  263    HB3  ASP  38           1HB      ASP  38   7.822  -1.685  -3.161
  264    H    LEU  39           H        LEU  39   5.682  -3.895  -3.673
  265    HA   LEU  39           HA       LEU  39   6.568  -4.887  -1.209
  266    HB2  LEU  39           2HB      LEU  39   4.094  -5.789  -2.675
  267    HB3  LEU  39           1HB      LEU  39   4.375  -5.825  -0.945
  268    HG   LEU  39           HG       LEU  39   3.990  -3.368  -2.656
  269   HD11  LEU  39          1HD1      LEU  39   1.871  -4.138  -2.305
  270   HD12  LEU  39          2HD1      LEU  39   2.096  -3.171  -0.849
  271   HD13  LEU  39          3HD1      LEU  39   2.286  -4.922  -0.781
  272   HD21  LEU  39          3HD2      LEU  39   5.661  -2.990  -0.879
  273   HD22  LEU  39          1HD2      LEU  39   4.484  -3.531   0.317
  274   HD23  LEU  39          2HD2      LEU  39   4.179  -2.072  -0.622
  275    H    GLU  40           H        GLU  40   5.870  -6.595  -4.263
  276    HA   GLU  40           HA       GLU  40   6.327  -9.197  -3.328
  277    HB2  GLU  40           2HB      GLU  40   6.822  -8.087  -6.097
  278    HB3  GLU  40           1HB      GLU  40   6.721  -9.793  -5.687
  279    HG2  GLU  40           2HG      GLU  40   4.400  -9.508  -5.011
  280    HG3  GLU  40           1HG      GLU  40   4.498  -7.787  -5.381
  281    H    ASN  41           H        ASN  41   8.568  -6.695  -4.384
  282    HA   ASN  41           HA       ASN  41  10.845  -8.470  -4.411
  283    HB2  ASN  41           2HB      ASN  41  10.358  -5.595  -4.984
  284    HB3  ASN  41           1HB      ASN  41  11.987  -6.051  -4.494
  285   HD21  ASN  41          1HD2      ASN  41  13.263  -7.192  -5.866
  286   HD22  ASN  41          2HD2      ASN  41  12.821  -7.567  -7.493
  287    H    GLY  42           H        GLY  42   9.512  -6.027  -2.212
  288    HA2  GLY  42           2HA      GLY  42  10.085  -6.831   0.192
  289    HA3  GLY  42           1HA      GLY  42  11.726  -6.506  -0.344
  290    H    GLU  43           H        GLU  43  10.267  -4.232  -1.998
  291    HA   GLU  43           HA       GLU  43  10.950  -2.134  -0.217
  292    HB2  GLU  43           2HB      GLU  43   9.716  -2.292  -2.946
  293    HB3  GLU  43           1HB      GLU  43   9.699  -0.764  -2.075
  294    HG2  GLU  43           2HG      GLU  43  12.281  -1.380  -1.798
  295    HG3  GLU  43           1HG      GLU  43  11.949  -2.231  -3.305
  296    H    ASP  44           H        ASP  44   9.607  -2.676   1.598
  297    HA   ASP  44           HA       ASP  44   6.745  -2.151   1.291
  298    HB2  ASP  44           2HB      ASP  44   6.602  -2.962   3.660
  299    HB3  ASP  44           1HB      ASP  44   7.208  -4.154   2.520
  300    H    VAL  45           H        VAL  45   8.385   0.044   0.917
  301    HA   VAL  45           HA       VAL  45   7.730   1.670   3.281
  302    HB   VAL  45           HB       VAL  45  10.156   1.328   3.219
  303   HG11  VAL  45          1HG1      VAL  45  11.519   1.759   1.420
  304   HG12  VAL  45          2HG1      VAL  45  10.388   2.901   0.697
  305   HG13  VAL  45          3HG1      VAL  45  10.073   1.169   0.602
  306   HG21  VAL  45          3HG2      VAL  45   9.168   3.468   4.017
  307   HG22  VAL  45          1HG2      VAL  45   9.461   4.150   2.416
  308   HG23  VAL  45          2HG2      VAL  45  10.818   3.628   3.414
  309    H    ALA  46           H        ALA  46   6.610   3.491   2.889
  310    HA   ALA  46           HA       ALA  46   6.249   4.281   0.073
  311    HB1  ALA  46           1HB      ALA  46   4.048   4.320   0.387
  312    HB2  ALA  46           2HB      ALA  46   4.208   5.319   1.831
  313    HB3  ALA  46           3HB      ALA  46   4.321   3.564   1.957
  314    H    THR  47           H        THR  47   6.670   6.336  -0.526
  315    HA   THR  47           HA       THR  47   7.475   8.220   1.594
  316    HB   THR  47           HB       THR  47   8.504   8.304  -1.239
  317    HG1  THR  47           1HG      THR  47   9.515   6.831   0.959
  318   HG21  THR  47          3HG2      THR  47   8.824  10.094   0.795
  319   HG22  THR  47          1HG2      THR  47   9.913   9.895  -0.577
  320   HG23  THR  47          2HG2      THR  47  10.261   9.084   0.950
  321    H    CYS  48           H        CYS  48   6.531  10.168   1.669
  322    HA   CYS  48           HA       CYS  48   4.424  10.745  -0.262
  323    HB2  CYS  48           2HB      CYS  48   4.030  10.899   2.220
  324    HB3  CYS  48           1HB      CYS  48   5.131  12.271   2.253
  325    HA   PRO  49           HA       PRO  49   7.043  13.723  -2.301
  326    HB2  PRO  49           2HB      PRO  49   5.248  14.730  -4.027
  327    HB3  PRO  49           1HB      PRO  49   5.894  13.093  -4.195
  328    HG2  PRO  49           2HG      PRO  49   3.263  13.991  -3.101
  329    HG3  PRO  49           1HG      PRO  49   3.633  12.593  -4.124
  330    HD2  PRO  49           2HD      PRO  49   3.261  12.483  -1.393
  331    HD3  PRO  49           1HD      PRO  49   4.171  11.285  -2.333
  332    H    SER  50           H        SER  50   4.692  14.481  -0.062
  333    HA   SER  50           HA       SER  50   4.953  17.375  -0.489
  334    HB2  SER  50           2HB      SER  50   2.665  16.053  -0.139
  335    HB3  SER  50           1HB      SER  50   3.085  16.278   1.560
  336    HG   SER  50           HG       SER  50   2.542  18.209  -0.412
  337    H    CYS  51           H        CYS  51   5.021  14.944   2.128
  338    HA   CYS  51           HA       CYS  51   6.577  16.823   3.761
  339    HB2  CYS  51           2HB      CYS  51   6.016  15.416   5.661
  340    HB3  CYS  51           1HB      CYS  51   4.554  15.850   4.782
  341    H    SER  52           H        SER  52   6.874  13.823   2.031
  342    HA   SER  52           HA       SER  52   8.676  12.520   1.551
  343    HB2  SER  52           2HB      SER  52   9.801  14.924   1.706
  344    HB3  SER  52           1HB      SER  52  10.557  14.216   3.133
  345    HG   SER  52           HG       SER  52  10.846  13.544   0.438
  346    H    LEU  53           H        LEU  53   7.071  11.893   3.736
  347    HA   LEU  53           HA       LEU  53   8.874  11.024   5.865
  348    HB2  LEU  53           2HB      LEU  53   6.598  12.125   6.257
  349    HB3  LEU  53           1HB      LEU  53   5.895  10.609   5.729
  350    HG   LEU  53           HG       LEU  53   6.922   9.434   7.590
  351   HD11  LEU  53          1HD1      LEU  53   8.970  10.482   7.970
  352   HD12  LEU  53          2HD1      LEU  53   8.009  10.902   9.388
  353   HD13  LEU  53          3HD1      LEU  53   8.236  12.081   8.097
  354   HD21  LEU  53          3HD2      LEU  53   5.791  11.791   8.973
  355   HD22  LEU  53          1HD2      LEU  53   5.374  10.083   9.107
  356   HD23  LEU  53          2HD2      LEU  53   4.785  11.029   7.742
  357    H    ILE  54           H        ILE  54   8.623   8.770   6.691
  358    HA   ILE  54           HA       ILE  54   8.269   6.895   4.442
  359    HB   ILE  54           HB       ILE  54   9.835   5.385   5.665
  360   HG12  ILE  54          2HG1      ILE  54  10.324   7.820   7.401
  361   HG13  ILE  54          1HG1      ILE  54   9.518   6.344   7.920
  362   HG21  ILE  54          1HG2      ILE  54  10.495   7.050   3.844
  363   HG22  ILE  54          2HG2      ILE  54  11.786   6.390   4.848
  364   HG23  ILE  54          3HG2      ILE  54  11.182   8.019   5.149
  365   HD11  ILE  54          3HD1      ILE  54  12.218   6.030   6.776
  366   HD12  ILE  54          1HD1      ILE  54  11.452   5.206   8.134
  367   HD13  ILE  54          2HD1      ILE  54  12.104   6.831   8.344
  368    H    ILE  55           H        ILE  55   7.122   5.007   4.749
  369    HA   ILE  55           HA       ILE  55   5.994   4.458   7.389
  370    HB   ILE  55           HB       ILE  55   3.727   4.089   6.394
  371   HG12  ILE  55          2HG1      ILE  55   4.365   5.948   4.167
  372   HG13  ILE  55          1HG1      ILE  55   4.894   4.280   3.978
  373   HG21  ILE  55          1HG2      ILE  55   3.063   6.410   6.503
  374   HG22  ILE  55          2HG2      ILE  55   4.728   6.926   6.246
  375   HG23  ILE  55          3HG2      ILE  55   4.287   6.076   7.726
  376   HD11  ILE  55          3HD1      ILE  55   2.782   3.490   3.781
  377   HD12  ILE  55          1HD1      ILE  55   2.514   5.125   3.180
  378   HD13  ILE  55          2HD1      ILE  55   2.101   4.721   4.846
  379    H    LYS  56           H        LYS  56   5.473   2.304   7.752
  380    HA   LYS  56           HA       LYS  56   6.619   0.440   5.823
  381    HB2  LYS  56           2HB      LYS  56   7.276   0.312   8.214
  382    HB3  LYS  56           1HB      LYS  56   5.611  -0.070   8.629
  383    HG2  LYS  56           2HG      LYS  56   6.645  -2.139   8.607
  384    HG3  LYS  56           1HG      LYS  56   5.886  -2.057   7.018
  385    HD2  LYS  56           2HD      LYS  56   7.869  -1.971   5.928
  386    HD3  LYS  56           1HD      LYS  56   8.638  -1.004   7.188
  387    HE2  LYS  56           2HE      LYS  56   9.553  -3.329   6.902
  388    HE3  LYS  56           1HE      LYS  56   9.034  -2.916   8.536
  389    HZ1  LYS  56           3HZ      LYS  56   7.158  -4.253   8.360
  390    HZ2  LYS  56           1HZ      LYS  56   8.350  -5.170   7.583
  391    HZ3  LYS  56           2HZ      LYS  56   7.217  -4.310   6.669
  392    H    VAL  57           H        VAL  57   5.581  -1.014   4.692
  393    HA   VAL  57           HA       VAL  57   2.652  -1.057   4.901
  394    HB   VAL  57           HB       VAL  57   3.951  -2.181   2.480
  395   HG11  VAL  57          1HG1      VAL  57   1.592  -0.399   3.035
  396   HG12  VAL  57          2HG1      VAL  57   1.559  -2.119   2.654
  397   HG13  VAL  57          3HG1      VAL  57   2.060  -0.954   1.429
  398   HG21  VAL  57          3HG2      VAL  57   4.325  -0.020   1.450
  399   HG22  VAL  57          1HG2      VAL  57   5.313  -0.159   2.901
  400   HG23  VAL  57          2HG2      VAL  57   3.839   0.806   2.930
  401    H    ILE  58           H        ILE  58   1.891  -2.783   5.927
  402    HA   ILE  58           HA       ILE  58   3.417  -5.274   5.937
  403    HB   ILE  58           HB       ILE  58   0.855  -4.682   7.421
  404   HG12  ILE  58          2HG1      ILE  58   2.557  -3.055   8.082
  405   HG13  ILE  58          1HG1      ILE  58   2.281  -4.211   9.380
  406   HG21  ILE  58          1HG2      ILE  58   1.024  -6.925   7.643
  407   HG22  ILE  58          2HG2      ILE  58   2.152  -6.483   8.923
  408   HG23  ILE  58          3HG2      ILE  58   2.760  -6.940   7.332
  409   HD11  ILE  58          3HD1      ILE  58   4.561  -4.078   9.386
  410   HD12  ILE  58          1HD1      ILE  58   4.664  -3.838   7.641
  411   HD13  ILE  58          2HD1      ILE  58   4.323  -5.441   8.293
  412    H    TYR  59           H        TYR  59   2.822  -7.093   4.899
  413    HA   TYR  59           HA       TYR  59   0.131  -7.483   3.910
  414    HB2  TYR  59           2HB      TYR  59   0.972  -7.815   1.535
  415    HB3  TYR  59           1HB      TYR  59   0.909  -6.146   2.092
  416    HD1  TYR  59           1HD      TYR  59   2.956  -4.895   2.518
  417    HD2  TYR  59           2HD      TYR  59   3.099  -8.920   1.146
  418    HE1  TYR  59           1HE      TYR  59   5.339  -4.623   1.986
  419    HE2  TYR  59           2HE      TYR  59   5.481  -8.657   0.605
  420    HH   TYR  59           HH       TYR  59   7.074  -6.796   0.089
  421    H    ASP  60           H        ASP  60   0.179  -9.586   2.432
  422    HA   ASP  60           HA       ASP  60   1.576 -11.592   4.016
  423    HB2  ASP  60           2HB      ASP  60  -0.887 -11.769   3.414
  424    HB3  ASP  60           1HB      ASP  60  -0.371 -12.100   1.762
  425    H    LYS  61           H        LYS  61   3.627 -11.890   3.415
  426    HA   LYS  61           HA       LYS  61   4.677 -11.510   0.842
  427    HB2  LYS  61           2HB      LYS  61   5.627 -12.825   3.337
  428    HB3  LYS  61           1HB      LYS  61   6.483 -13.194   1.845
  429    HG2  LYS  61           2HG      LYS  61   5.975 -10.339   2.343
  430    HG3  LYS  61           1HG      LYS  61   7.087 -11.132   3.461
  431    HD2  LYS  61           2HD      LYS  61   8.620 -10.631   1.885
  432    HD3  LYS  61           1HD      LYS  61   8.001 -12.091   1.108
  433    HE2  LYS  61           2HE      LYS  61   6.330 -10.567  -0.061
  434    HE3  LYS  61           1HE      LYS  61   7.318  -9.224   0.509
  435    HZ1  LYS  61           3HZ      LYS  61   8.740 -11.362  -0.855
  436    HZ2  LYS  61           1HZ      LYS  61   8.948  -9.685  -0.951
  437    HZ3  LYS  61           2HZ      LYS  61   7.705 -10.435  -1.819
  438    H    ASP  62           H        ASP  62   3.147 -14.290   2.328
  439    HA   ASP  62           HA       ASP  62   4.030 -16.249   0.495
  440    HB2  ASP  62           2HB      ASP  62   2.745 -16.460   2.793
  441    HB3  ASP  62           1HB      ASP  62   1.322 -16.440   1.755
  442    H    GLN  63           H        GLN  63   1.273 -14.043   0.506
  443    HA   GLN  63           HA       GLN  63   0.110 -15.140  -1.879
  444    HB2  GLN  63           2HB      GLN  63  -0.455 -12.807  -0.105
  445    HB3  GLN  63           1HB      GLN  63  -1.138 -12.809  -1.725
  446    HG2  GLN  63           2HG      GLN  63  -1.508 -15.304  -0.232
  447    HG3  GLN  63           1HG      GLN  63  -2.317 -13.896   0.455
  448   HE21  GLN  63          1HE2      GLN  63  -1.740 -15.244  -2.791
  449   HE22  GLN  63          2HE2      GLN  63  -3.374 -15.080  -3.328
  450    H    PHE  64           H        PHE  64   1.937 -12.175  -1.121
  451    HA   PHE  64           HA       PHE  64   1.930 -11.087  -3.703
  452    HB2  PHE  64           2HB      PHE  64   3.625 -10.717  -1.275
  453    HB3  PHE  64           1HB      PHE  64   4.207 -10.058  -2.802
  454    HD1  PHE  64           1HD      PHE  64   1.299 -10.032  -0.494
  455    HD2  PHE  64           2HD      PHE  64   3.395  -8.025  -3.608
  456    HE1  PHE  64           1HE      PHE  64  -0.155  -8.070  -0.204
  457    HE2  PHE  64           2HE      PHE  64   1.946  -6.059  -3.320
  458    HZ   PHE  64           HZ       PHE  64   0.168  -6.080  -1.616
  459    H    VAL  65           H        VAL  65   4.240 -13.299  -2.146
  460    HA   VAL  65           HA       VAL  65   5.804 -13.485  -4.597
  461    HB   VAL  65           HB       VAL  65   6.200 -15.056  -2.045
  462   HG11  VAL  65          1HG1      VAL  65   8.146 -15.820  -2.910
  463   HG12  VAL  65          2HG1      VAL  65   8.448 -14.346  -3.829
  464   HG13  VAL  65          3HG1      VAL  65   7.308 -15.544  -4.437
  465   HG21  VAL  65          3HG2      VAL  65   7.633 -12.519  -2.807
  466   HG22  VAL  65          1HG2      VAL  65   7.726 -13.404  -1.285
  467   HG23  VAL  65          2HG2      VAL  65   6.243 -12.556  -1.722
  468    H    SER  66           H        SER  66   4.184 -14.421  -5.951
  469    HA   SER  66           HA       SER  66   3.814 -17.304  -5.474
  470    HB2  SER  66           2HB      SER  66   1.786 -15.216  -6.004
  471    HB3  SER  66           1HB      SER  66   1.602 -16.706  -6.927
  472    HG   SER  66           HG       SER  66   0.734 -16.366  -4.567
  473    H    GLY  67           H        GLY  67   5.537 -17.807  -6.867
  474    HA2  GLY  67           2HA      GLY  67   5.452 -16.845  -9.618
  475    HA3  GLY  67           1HA      GLY  67   6.707 -17.847  -8.903
  476    H    GLU  68           H        GLU  68   4.982 -19.874  -7.850
  477    HA   GLU  68           HA       GLU  68   4.284 -21.224 -10.361
  478    HB2  GLU  68           2HB      GLU  68   5.927 -22.111  -8.476
  479    HB3  GLU  68           1HB      GLU  68   4.426 -22.670  -7.752
  480    HG2  GLU  68           2HG      GLU  68   3.965 -24.108  -9.536
  481    HG3  GLU  68           1HG      GLU  68   5.131 -23.313 -10.593
  482    H    THR  69           H        THR  69   2.460 -19.311  -9.307
  483    HA   THR  69           HA       THR  69   0.330 -20.845  -8.042
  484    HB   THR  69           HB       THR  69   0.824 -18.570  -7.235
  485    HG1  THR  69           1HG      THR  69  -1.270 -17.994  -7.047
  486   HG21  THR  69          3HG2      THR  69   1.517 -17.406  -9.193
  487   HG22  THR  69          1HG2      THR  69   0.056 -16.629  -8.585
  488   HG23  THR  69          2HG2      THR  69  -0.031 -17.700  -9.984
  489    H    VAL  70           H        VAL  70  -1.954 -20.376  -8.933
  490    HA   VAL  70           HA       VAL  70  -1.940 -20.460 -11.873
  491    HB   VAL  70           HB       VAL  70  -2.126 -22.755 -11.051
  492   HG11  VAL  70          1HG1      VAL  70  -3.136 -22.242  -8.863
  493   HG12  VAL  70          2HG1      VAL  70  -4.007 -23.506  -9.731
  494   HG13  VAL  70          3HG1      VAL  70  -4.658 -21.869  -9.674
  495   HG21  VAL  70          3HG2      VAL  70  -4.271 -23.354 -12.173
  496   HG22  VAL  70          1HG2      VAL  70  -3.240 -22.276 -13.113
  497   HG23  VAL  70          2HG2      VAL  70  -4.646 -21.634 -12.266
  498    HA   PRO  71           HA       PRO  71  -5.173 -17.440 -11.365
  499    HB2  PRO  71           2HB      PRO  71  -5.950 -17.242 -13.938
  500    HB3  PRO  71           1HB      PRO  71  -4.397 -16.608 -13.377
  501    HG2  PRO  71           2HG      PRO  71  -4.995 -19.172 -14.804
  502    HG3  PRO  71           1HG      PRO  71  -3.670 -18.024 -15.074
  503    HD2  PRO  71           2HD      PRO  71  -3.397 -20.339 -13.653
  504    HD3  PRO  71           1HD      PRO  71  -2.409 -18.894 -13.366
  505    H    ALA  72           H        ALA  72  -7.531 -17.179 -12.430
  506    HA   ALA  72           HA       ALA  72  -8.906 -19.759 -12.522
  507    HB1  ALA  72           1HB      ALA  72  -9.562 -17.568 -10.560
  508    HB2  ALA  72           2HB      ALA  72  -8.991 -19.196 -10.192
  509    HB3  ALA  72           3HB      ALA  72 -10.594 -18.961 -10.886
  510    HA   PRO  73           HA       PRO  73 -11.397 -18.076 -15.748
  511    HB2  PRO  73           2HB      PRO  73 -13.749 -19.132 -14.254
  512    HB3  PRO  73           1HB      PRO  73 -13.261 -19.412 -15.928
  513    HG2  PRO  73           2HG      PRO  73 -12.907 -21.291 -14.077
  514    HG3  PRO  73           1HG      PRO  73 -11.694 -21.017 -15.342
  515    HD2  PRO  73           2HD      PRO  73 -11.645 -20.232 -12.463
  516    HD3  PRO  73           1HD      PRO  73 -10.317 -20.769 -13.512
  517    H    SER  74           H        SER  74 -12.471 -16.217 -16.207
  518    HA   SER  74           HA       SER  74 -14.173 -14.902 -14.303
  519    HB2  SER  74           2HB      SER  74 -11.566 -14.363 -13.880
  520    HB3  SER  74           1HB      SER  74 -11.919 -13.143 -15.104
  521    HG   SER  74           HG       SER  74 -13.174 -13.507 -12.589
  522    H    ALA  75           H        ALA  75 -15.620 -13.612 -15.301
  523    HA   ALA  75           HA       ALA  75 -15.275 -13.182 -18.194
  524    HB1  ALA  75           1HB      ALA  75 -17.613 -13.766 -16.472
  525    HB2  ALA  75           2HB      ALA  75 -17.237 -14.322 -18.103
  526    HB3  ALA  75           3HB      ALA  75 -17.877 -12.698 -17.851
  527    H    ASN  76           H        ASN  76 -14.633 -11.185 -18.712
  528    HA   ASN  76           HA       ASN  76 -15.115  -8.966 -16.916
  529    HB2  ASN  76           2HB      ASN  76 -13.830  -7.645 -18.644
  530    HB3  ASN  76           1HB      ASN  76 -12.950  -8.984 -17.920
  531   HD21  ASN  76          1HD2      ASN  76 -14.125  -7.598 -20.803
  532   HD22  ASN  76          2HD2      ASN  76 -13.581  -8.830 -21.886
  533    H    LYS  77           H        LYS  77 -17.120  -8.171 -16.907
  534    HA   LYS  77           HA       LYS  77 -18.885  -8.222 -19.117
  535    HB2  LYS  77           2HB      LYS  77 -20.353  -6.831 -17.750
  536    HB3  LYS  77           1HB      LYS  77 -19.683  -8.150 -16.802
  537    HG2  LYS  77           2HG      LYS  77 -18.423  -6.760 -15.497
  538    HG3  LYS  77           1HG      LYS  77 -18.281  -5.527 -16.749
  539    HD2  LYS  77           2HD      LYS  77 -20.957  -5.503 -16.302
  540    HD3  LYS  77           1HD      LYS  77 -20.355  -5.917 -14.698
  541    HE2  LYS  77           2HE      LYS  77 -20.242  -3.662 -14.503
  542    HE3  LYS  77           1HE      LYS  77 -18.675  -3.919 -15.269
  543    HZ1  LYS  77           3HZ      LYS  77 -19.434  -3.139 -17.284
  544    HZ2  LYS  77           1HZ      LYS  77 -20.277  -2.142 -16.207
  545    HZ3  LYS  77           2HZ      LYS  77 -21.059  -3.452 -16.936
  546    H    GLU  78           H        GLU  78 -19.493  -6.661 -20.577
  547    HA   GLU  78           HA       GLU  78 -18.401  -3.994 -20.432
  548    HB2  GLU  78           2HB      GLU  78 -16.747  -5.761 -21.597
  549    HB3  GLU  78           1HB      GLU  78 -17.736  -5.340 -22.991
  550    HG2  GLU  78           2HG      GLU  78 -17.251  -2.899 -22.291
  551    HG3  GLU  78           1HG      GLU  78 -15.931  -3.607 -21.362
  552    H    LEU  79           H        LEU  79 -20.333  -3.025 -20.641
  553    HA   LEU  79           HA       LEU  79 -21.579  -2.974 -23.214
  554    HB2  LEU  79           2HB      LEU  79 -23.854  -3.625 -22.342
  555    HB3  LEU  79           1HB      LEU  79 -22.710  -4.937 -22.557
  556    HG   LEU  79           HG       LEU  79 -22.984  -3.680 -19.856
  557   HD11  LEU  79          1HD1      LEU  79 -24.717  -5.551 -19.453
  558   HD12  LEU  79          2HD1      LEU  79 -24.967  -5.477 -21.197
  559   HD13  LEU  79          3HD1      LEU  79 -25.247  -4.046 -20.204
  560   HD21  LEU  79          3HD2      LEU  79 -22.003  -6.220 -21.030
  561   HD22  LEU  79          1HD2      LEU  79 -22.730  -6.291 -19.425
  562   HD23  LEU  79          2HD2      LEU  79 -21.341  -5.245 -19.720
  563    H    VAL  80           H        VAL  80 -20.353  -1.021 -21.627
  564    HA   VAL  80           HA       VAL  80 -22.338   0.516 -20.230
  565    HB   VAL  80           HB       VAL  80 -19.628   1.464 -21.174
  566   HG11  VAL  80          1HG1      VAL  80 -21.717   2.533 -19.351
  567   HG12  VAL  80          2HG1      VAL  80 -20.651   3.379 -20.474
  568   HG13  VAL  80          3HG1      VAL  80 -20.027   2.806 -18.927
  569   HG21  VAL  80          3HG2      VAL  80 -19.193   0.936 -18.596
  570   HG22  VAL  80          1HG2      VAL  80 -18.913  -0.255 -19.866
  571   HG23  VAL  80          2HG2      VAL  80 -20.402  -0.305 -18.922
  572    H    LYS  81           H        LYS  81 -23.860   1.696 -21.186
  573    HA   LYS  81           HA       LYS  81 -23.193   3.291 -23.540
  574    HB2  LYS  81           2HB      LYS  81 -25.166   1.054 -23.484
  575    HB3  LYS  81           1HB      LYS  81 -25.585   2.494 -24.401
  576    HG2  LYS  81           2HG      LYS  81 -23.119   2.093 -25.352
  577    HG3  LYS  81           1HG      LYS  81 -23.539   0.431 -24.932
  578    HD2  LYS  81           2HD      LYS  81 -25.615   1.960 -26.371
  579    HD3  LYS  81           1HD      LYS  81 -24.158   1.588 -27.292
  580    HE2  LYS  81           2HE      LYS  81 -24.423  -0.773 -26.824
  581    HE3  LYS  81           1HE      LYS  81 -25.814  -0.441 -25.794
  582    HZ1  LYS  81           3HZ      LYS  81 -25.631  -0.042 -28.731
  583    HZ2  LYS  81           1HZ      LYS  81 -26.932   0.491 -27.786
  584    HZ3  LYS  81           2HZ      LYS  81 -26.597  -1.162 -27.910
  585    H    LEU  82           H        LEU  82 -23.886   3.779 -20.654
  586    HA   LEU  82           HA       LEU  82 -24.968   5.389 -19.464
  587    HB2  LEU  82           2HB      LEU  82 -24.717   6.548 -21.849
  588    HB3  LEU  82           1HB      LEU  82 -26.464   6.403 -21.825
  589    HG   LEU  82           HG       LEU  82 -25.184   7.597 -19.426
  590   HD11  LEU  82          1HD1      LEU  82 -23.917   8.842 -20.911
  591   HD12  LEU  82          2HD1      LEU  82 -25.350   9.846 -20.688
  592   HD13  LEU  82          3HD1      LEU  82 -25.184   8.857 -22.139
  593   HD21  LEU  82          3HD2      LEU  82 -27.766   7.670 -20.850
  594   HD22  LEU  82          1HD2      LEU  82 -27.254   9.178 -20.092
  595   HD23  LEU  82          2HD2      LEU  82 -27.417   7.714 -19.123
  596    H    GLU  83           H        GLU  83 -27.008   5.807 -18.477
  597    HA   GLU  83           HA       GLU  83 -28.795   3.610 -18.556
  598    HB2  GLU  83           2HB      GLU  83 -28.792   6.259 -17.147
  599    HB3  GLU  83           1HB      GLU  83 -30.225   5.240 -17.101
  600    HG2  GLU  83           2HG      GLU  83 -29.301   3.779 -15.676
  601    HG3  GLU  83           1HG      GLU  83 -27.721   3.861 -16.456
  602    H    HIS  84           H        HIS  84 -30.937   3.482 -19.241
  603    HA   HIS  84           HA       HIS  84 -32.023   5.674 -20.829
  604    HB2  HIS  84           2HB      HIS  84 -30.621   3.783 -22.148
  605    HB3  HIS  84           1HB      HIS  84 -32.203   3.012 -22.128
  606    HD1  HIS  84           1HD      HIS  84 -34.171   4.982 -22.876
  607    HD2  HIS  84           2HD      HIS  84 -30.316   5.191 -24.413
  608    HE1  HIS  84           1HE      HIS  84 -34.357   6.354 -24.975
  609    HE2  HIS  84           2HE      HIS  84 -32.025   6.406 -25.926
  Start of MODEL    6
    1    H1   MET   1           1HT      MET   1  14.299  10.296   9.123
    2    H2   MET   1           2HT      MET   1  14.270   9.938   7.445
    3    H3   MET   1           3HT      MET   1  15.770  10.086   8.268
    4    HA   MET   1           HA       MET   1  13.717   8.010   8.659
    5    HB2  MET   1           2HB      MET   1  15.225   7.989   6.598
    6    HB3  MET   1           1HB      MET   1  16.570   7.750   7.704
    7    HG2  MET   1           2HG      MET   1  15.998   5.606   8.167
    8    HG3  MET   1           1HG      MET   1  14.273   5.901   7.956
    9    HE1  MET   1           2HE      MET   1  17.158   5.785   4.407
   10    HE2  MET   1           3HE      MET   1  17.662   4.857   5.820
   11    HE3  MET   1           1HE      MET   1  17.389   6.594   5.957
   12    H    ALA   2           H        ALA   2  13.943   6.700  10.417
   13    HA   ALA   2           HA       ALA   2  16.290   6.534  12.008
   14    HB1  ALA   2           1HB      ALA   2  14.129   7.821  13.589
   15    HB2  ALA   2           2HB      ALA   2  15.106   8.848  12.541
   16    HB3  ALA   2           3HB      ALA   2  15.879   7.883  13.799
   17    H    VAL   3           H        VAL   3  12.780   6.521  12.710
   18    HA   VAL   3           HA       VAL   3  12.938   3.622  13.190
   19    HB   VAL   3           HB       VAL   3  11.342   3.947  15.131
   20   HG11  VAL   3          1HG1      VAL   3  14.012   3.736  15.108
   21   HG12  VAL   3          2HG1      VAL   3  13.065   3.850  16.591
   22   HG13  VAL   3          3HG1      VAL   3  13.850   5.286  15.935
   23   HG21  VAL   3          3HG2      VAL   3  12.388   6.712  15.451
   24   HG22  VAL   3          1HG2      VAL   3  10.887   5.994  16.035
   25   HG23  VAL   3          2HG2      VAL   3  11.042   6.458  14.341
   26    H    PHE   4           H        PHE   4  11.826   5.369  10.996
   27    HA   PHE   4           HA       PHE   4  10.039   5.438   9.606
   28    HB2  PHE   4           2HB      PHE   4   9.917   2.852  10.938
   29    HB3  PHE   4           1HB      PHE   4   8.338   3.405  10.406
   30    HD1  PHE   4           1HD      PHE   4  11.804   3.467   9.003
   31    HD2  PHE   4           2HD      PHE   4   7.700   2.514   8.400
   32    HE1  PHE   4           1HE      PHE   4  12.318   2.707   6.720
   33    HE2  PHE   4           2HE      PHE   4   8.211   1.753   6.117
   34    HZ   PHE   4           HZ       PHE   4  10.520   1.848   5.275
   35    H    HIS   5           H        HIS   5   7.435   5.318   9.685
   36    HA   HIS   5           HA       HIS   5   6.703   7.165  11.836
   37    HB2  HIS   5           2HB      HIS   5   6.311   7.735   9.387
   38    HB3  HIS   5           1HB      HIS   5   5.059   6.498   9.392
   39    HD1  HIS   5           1HD      HIS   5   5.910   9.734  11.181
   40    HD2  HIS   5           2HD      HIS   5   2.624   7.375  10.230
   41    HE1  HIS   5           1HE      HIS   5   3.900  11.053  11.917
   42    HE2  HIS   5           2HE      HIS   5   1.919   9.647  11.245
   43    H    ASP   6           H        ASP   6   5.118   4.492  10.078
   44    HA   ASP   6           HA       ASP   6   4.396   3.119  12.472
   45    HB2  ASP   6           2HB      ASP   6   2.422   4.953  11.208
   46    HB3  ASP   6           1HB      ASP   6   1.831   3.368  11.692
   47    H    GLU   7           H        GLU   7   3.148   1.142  12.019
   48    HA   GLU   7           HA       GLU   7   3.597   0.219   9.257
   49    HB2  GLU   7           2HB      GLU   7   3.229  -1.491  11.725
   50    HB3  GLU   7           1HB      GLU   7   3.730  -2.028  10.128
   51    HG2  GLU   7           2HG      GLU   7   5.868  -1.433  10.453
   52    HG3  GLU   7           1HG      GLU   7   5.437   0.035  11.329
   53    H    VAL   8           H        VAL   8   1.841  -0.031   8.025
   54    HA   VAL   8           HA       VAL   8  -0.717  -0.695   9.334
   55    HB   VAL   8           HB       VAL   8  -0.453   1.063   6.891
   56   HG11  VAL   8          1HG1      VAL   8  -2.835   0.701   8.692
   57   HG12  VAL   8          2HG1      VAL   8  -2.567  -0.283   7.255
   58   HG13  VAL   8          3HG1      VAL   8  -2.772   1.461   7.103
   59   HG21  VAL   8          3HG2      VAL   8   0.492   2.107   8.965
   60   HG22  VAL   8          1HG2      VAL   8  -1.108   1.958   9.693
   61   HG23  VAL   8          2HG2      VAL   8  -0.879   2.967   8.265
   62    H    GLU   9           H        GLU   9  -2.011  -2.194   8.342
   63    HA   GLU   9           HA       GLU   9  -0.783  -4.061   6.605
   64    HB2  GLU   9           2HB      GLU   9  -3.677  -3.745   7.423
   65    HB3  GLU   9           1HB      GLU   9  -3.047  -5.117   6.522
   66    HG2  GLU   9           2HG      GLU   9  -1.835  -5.914   8.337
   67    HG3  GLU   9           1HG      GLU   9  -1.871  -4.361   9.168
   68    H    ILE  10           H        ILE  10  -0.996  -4.440   4.450
   69    HA   ILE  10           HA       ILE  10  -1.455  -2.315   2.710
   70    HB   ILE  10           HB       ILE  10  -0.093  -4.307   2.170
   71   HG12  ILE  10          2HG1      ILE  10  -0.964  -4.563  -0.218
   72   HG13  ILE  10          1HG1      ILE  10  -2.274  -3.488   0.257
   73   HG21  ILE  10          1HG2      ILE  10  -1.257  -6.311   1.248
   74   HG22  ILE  10          2HG2      ILE  10  -2.765  -5.669   1.899
   75   HG23  ILE  10          3HG2      ILE  10  -1.443  -6.092   2.988
   76   HD11  ILE  10          3HD1      ILE  10   0.478  -2.578   0.830
   77   HD12  ILE  10          1HD1      ILE  10  -0.939  -1.666   0.309
   78   HD13  ILE  10          2HD1      ILE  10  -0.027  -2.622  -0.860
   79    H    GLU  11           H        GLU  11  -3.690  -4.673   4.002
   80    HA   GLU  11           HA       GLU  11  -5.786  -4.468   2.163
   81    HB2  GLU  11           2HB      GLU  11  -5.634  -6.119   4.025
   82    HB3  GLU  11           1HB      GLU  11  -6.007  -4.828   5.159
   83    HG2  GLU  11           2HG      GLU  11  -8.097  -4.589   3.484
   84    HG3  GLU  11           1HG      GLU  11  -7.767  -6.313   3.321
   85    H    ASP  12           H        ASP  12  -4.848  -2.371   4.845
   86    HA   ASP  12           HA       ASP  12  -7.188  -0.735   4.783
   87    HB2  ASP  12           2HB      ASP  12  -4.513  -0.586   6.103
   88    HB3  ASP  12           1HB      ASP  12  -5.474   0.885   6.001
   89    H    PHE  13           H        PHE  13  -4.145  -0.729   3.062
   90    HA   PHE  13           HA       PHE  13  -4.144   1.941   2.164
   91    HB2  PHE  13           2HB      PHE  13  -2.863  -0.591   1.190
   92    HB3  PHE  13           1HB      PHE  13  -2.779   0.862   0.206
   93    HD1  PHE  13           2HD      PHE  13  -2.180  -0.207   3.737
   94    HD2  PHE  13           1HD      PHE  13  -0.962   2.228   0.465
   95    HE1  PHE  13           2HE      PHE  13  -0.234   0.555   5.033
   96    HE2  PHE  13           1HE      PHE  13   0.987   2.992   1.750
   97    HZ   PHE  13           HZ       PHE  13   1.355   2.155   4.042
   98    H    GLN  14           H        GLN  14  -4.482   2.668  -0.073
   99    HA   GLN  14           HA       GLN  14  -6.993   1.596  -1.121
  100    HB2  GLN  14           2HB      GLN  14  -6.657   4.064  -0.603
  101    HB3  GLN  14           1HB      GLN  14  -5.571   4.118  -1.986
  102    HG2  GLN  14           2HG      GLN  14  -8.176   2.926  -2.572
  103    HG3  GLN  14           1HG      GLN  14  -8.253   4.608  -2.049
  104   HE21  GLN  14          1HE2      GLN  14  -6.480   6.001  -3.139
  105   HE22  GLN  14          2HE2      GLN  14  -6.341   5.801  -4.849
  106    H    TYR  15           H        TYR  15  -6.508  -0.141  -2.396
  107    HA   TYR  15           HA       TYR  15  -4.247  -0.266  -4.108
  108    HB2  TYR  15           2HB      TYR  15  -5.311  -2.306  -3.291
  109    HB3  TYR  15           1HB      TYR  15  -6.798  -1.897  -4.140
  110    HD1  TYR  15           1HD      TYR  15  -3.156  -2.285  -4.947
  111    HD2  TYR  15           2HD      TYR  15  -7.180  -3.025  -6.114
  112    HE1  TYR  15           1HE      TYR  15  -2.352  -3.499  -6.927
  113    HE2  TYR  15           2HE      TYR  15  -6.386  -4.242  -8.097
  114    HH   TYR  15           HH       TYR  15  -3.957  -4.067  -9.518
  115    H    ASP  16           H        ASP  16  -3.986   0.230  -6.209
  116    HA   ASP  16           HA       ASP  16  -6.279   1.435  -7.612
  117    HB2  ASP  16           2HB      ASP  16  -4.613   3.121  -6.957
  118    HB3  ASP  16           1HB      ASP  16  -3.356   2.212  -7.788
  119    H    GLU  17           H        GLU  17  -6.844  -0.470  -8.681
  120    HA   GLU  17           HA       GLU  17  -5.128  -2.220 -10.005
  121    HB2  GLU  17           2HB      GLU  17  -7.167  -2.710 -11.472
  122    HB3  GLU  17           1HB      GLU  17  -7.329  -2.977  -9.744
  123    HG2  GLU  17           2HG      GLU  17  -8.728  -1.160  -9.459
  124    HG3  GLU  17           1HG      GLU  17  -8.177  -0.372 -10.937
  125    H    ASP  18           H        ASP  18  -6.316   0.911 -10.970
  126    HA   ASP  18           HA       ASP  18  -6.030   0.947 -13.686
  127    HB2  ASP  18           2HB      ASP  18  -6.512   2.843 -11.835
  128    HB3  ASP  18           1HB      ASP  18  -4.856   3.269 -12.254
  129    H    SER  19           H        SER  19  -3.424   1.299 -11.272
  130    HA   SER  19           HA       SER  19  -1.499   0.562 -13.362
  131    HB2  SER  19           2HB      SER  19  -1.367   2.993 -11.590
  132    HB3  SER  19           1HB      SER  19   0.088   2.287 -12.293
  133    HG   SER  19           HG       SER  19  -1.545   3.976 -13.432
  134    H    GLU  20           H        GLU  20  -2.720  -0.804 -10.951
  135    HA   GLU  20           HA       GLU  20  -2.127  -2.079  -9.161
  136    HB2  GLU  20           2HB      GLU  20  -0.769  -2.903 -11.338
  137    HB3  GLU  20           1HB      GLU  20   0.580  -2.569 -10.261
  138    HG2  GLU  20           2HG      GLU  20  -0.306  -4.091  -8.614
  139    HG3  GLU  20           1HG      GLU  20  -1.747  -4.355  -9.588
  140    H    THR  21           H        THR  21  -1.953   0.263  -8.155
  141    HA   THR  21           HA       THR  21   0.559   0.296  -6.630
  142    HB   THR  21           HB       THR  21  -0.743   2.796  -7.736
  143    HG1  THR  21           1HG      THR  21   0.206   1.795  -9.451
  144   HG21  THR  21          3HG2      THR  21   0.756   4.034  -6.647
  145   HG22  THR  21          1HG2      THR  21   2.062   2.884  -6.931
  146   HG23  THR  21          2HG2      THR  21   0.933   2.625  -5.602
  147    H    TYR  22           H        TYR  22   0.362   0.948  -4.483
  148    HA   TYR  22           HA       TYR  22  -2.408   1.242  -3.519
  149    HB2  TYR  22           2HB      TYR  22   0.054   0.351  -1.997
  150    HB3  TYR  22           1HB      TYR  22  -1.578   0.443  -1.346
  151    HD1  TYR  22           2HD      TYR  22   0.479  -1.265  -3.929
  152    HD2  TYR  22           1HD      TYR  22  -3.041  -1.382  -1.538
  153    HE1  TYR  22           2HE      TYR  22   0.073  -3.576  -4.652
  154    HE2  TYR  22           1HE      TYR  22  -3.455  -3.697  -2.254
  155    HH   TYR  22           HH       TYR  22  -2.122  -5.623  -3.133
  156    H    PHE  23           H        PHE  23  -2.999   2.919  -2.183
  157    HA   PHE  23           HA       PHE  23  -0.946   4.970  -1.660
  158    HB2  PHE  23           2HB      PHE  23  -3.830   5.451  -2.448
  159    HB3  PHE  23           1HB      PHE  23  -2.655   6.700  -2.051
  160    HD1  PHE  23           2HD      PHE  23  -3.599   4.139  -4.518
  161    HD2  PHE  23           1HD      PHE  23  -1.013   7.404  -3.632
  162    HE1  PHE  23           2HE      PHE  23  -2.895   4.217  -6.872
  163    HE2  PHE  23           1HE      PHE  23  -0.307   7.487  -5.987
  164    HZ   PHE  23           HZ       PHE  23  -1.247   5.892  -7.611
  165    H    TYR  24           H        TYR  24  -1.467   6.456   0.137
  166    HA   TYR  24           HA       TYR  24  -3.397   5.480   2.090
  167    HB2  TYR  24           2HB      TYR  24  -1.047   4.354   2.353
  168    HB3  TYR  24           1HB      TYR  24  -0.584   5.903   3.048
  169    HD1  TYR  24           2HD      TYR  24  -3.261   3.306   3.369
  170    HD2  TYR  24           1HD      TYR  24  -0.821   6.192   5.327
  171    HE1  TYR  24           2HE      TYR  24  -4.181   2.606   5.537
  172    HE2  TYR  24           1HE      TYR  24  -1.735   5.498   7.500
  173    HH   TYR  24           HH       TYR  24  -4.116   4.304   8.199
  174    HA   PRO  25           HA       PRO  25  -3.748   9.875   2.688
  175    HB2  PRO  25           2HB      PRO  25  -5.194   9.884   4.985
  176    HB3  PRO  25           1HB      PRO  25  -5.889   9.480   3.410
  177    HG2  PRO  25           2HG      PRO  25  -4.958   7.655   5.594
  178    HG3  PRO  25           1HG      PRO  25  -6.423   7.553   4.599
  179    HD2  PRO  25           2HD      PRO  25  -4.218   6.058   4.110
  180    HD3  PRO  25           1HD      PRO  25  -5.298   6.618   2.818
  181    H    CYS  26           H        CYS  26  -2.246  11.236   3.419
  182    HA   CYS  26           HA       CYS  26  -0.755  10.530   5.844
  183    HB2  CYS  26           2HB      CYS  26   0.275  11.137   3.470
  184    HB3  CYS  26           1HB      CYS  26   0.094  12.779   4.080
  185    HA   PRO  27           HA       PRO  27  -2.674  13.643   8.321
  186    HB2  PRO  27           2HB      PRO  27   0.059  14.169   9.368
  187    HB3  PRO  27           1HB      PRO  27  -1.422  13.758  10.240
  188    HG2  PRO  27           2HG      PRO  27   0.503  11.952   9.909
  189    HG3  PRO  27           1HG      PRO  27  -1.206  11.489   9.805
  190    HD2  PRO  27           2HD      PRO  27   0.783  11.912   7.612
  191    HD3  PRO  27           1HD      PRO  27  -0.504  10.695   7.751
  192    H    CYS  28           H        CYS  28   0.194  14.409   6.427
  193    HA   CYS  28           HA       CYS  28   0.109  17.222   6.811
  194    HB2  CYS  28           2HB      CYS  28   1.683  17.346   4.963
  195    HB3  CYS  28           1HB      CYS  28   2.126  16.019   6.032
  196    H    GLY  29           H        GLY  29  -1.325  15.053   4.408
  197    HA2  GLY  29           2HA      GLY  29  -3.599  16.181   3.754
  198    HA3  GLY  29           1HA      GLY  29  -2.511  17.335   2.998
  199    H    ASP  30           H        ASP  30  -0.543  15.507   2.099
  200    HA   ASP  30           HA       ASP  30  -1.789  14.600  -0.315
  201    HB2  ASP  30           2HB      ASP  30   0.721  15.430   0.315
  202    HB3  ASP  30           1HB      ASP  30   0.959  13.686   0.293
  203    H    ASN  31           H        ASN  31  -0.761  12.253  -1.054
  204    HA   ASN  31           HA       ASN  31  -1.446  10.337   1.071
  205    HB2  ASN  31           2HB      ASN  31  -2.382  10.225  -1.806
  206    HB3  ASN  31           1HB      ASN  31  -2.628   8.955  -0.613
  207   HD21  ASN  31          1HD2      ASN  31  -4.391   9.036   0.627
  208   HD22  ASN  31          2HD2      ASN  31  -5.479  10.375   0.721
  209    H    PHE  32           H        PHE  32  -0.113   8.637   1.273
  210    HA   PHE  32           HA       PHE  32   2.371   8.540  -0.063
  211    HB2  PHE  32           2HB      PHE  32   0.908   6.554   1.675
  212    HB3  PHE  32           1HB      PHE  32   2.494   6.210   1.001
  213    HD1  PHE  32           1HD      PHE  32   4.252   8.203   1.427
  214    HD2  PHE  32           2HD      PHE  32   0.838   7.339   3.819
  215    HE1  PHE  32           1HE      PHE  32   5.314   9.318   3.344
  216    HE2  PHE  32           2HE      PHE  32   1.895   8.456   5.738
  217    HZ   PHE  32           HZ       PHE  32   4.138   9.447   5.502
  218    H    SER  33           H        SER  33   3.202   6.649  -1.314
  219    HA   SER  33           HA       SER  33   1.194   5.162  -2.807
  220    HB2  SER  33           2HB      SER  33   2.643   5.830  -4.942
  221    HB3  SER  33           1HB      SER  33   1.277   6.808  -4.410
  222    HG   SER  33           HG       SER  33   4.036   7.267  -3.970
  223    H    ILE  34           H        ILE  34   1.865   3.195  -3.516
  224    HA   ILE  34           HA       ILE  34   4.685   2.526  -3.625
  225    HB   ILE  34           HB       ILE  34   4.197   2.159  -1.256
  226   HG12  ILE  34          2HG1      ILE  34   4.284  -0.643  -2.191
  227   HG13  ILE  34          1HG1      ILE  34   5.472   0.432  -2.919
  228   HG21  ILE  34          1HG2      ILE  34   1.691   1.511  -1.984
  229   HG22  ILE  34          2HG2      ILE  34   2.399   1.080  -0.427
  230   HG23  ILE  34          3HG2      ILE  34   2.365  -0.099  -1.738
  231   HD11  ILE  34          3HD1      ILE  34   5.634  -0.866  -0.461
  232   HD12  ILE  34          1HD1      ILE  34   5.371   0.836  -0.081
  233   HD13  ILE  34          2HD1      ILE  34   6.726   0.361  -1.103
  234    H    THR  35           H        THR  35   4.974   1.313  -5.383
  235    HA   THR  35           HA       THR  35   2.771   0.215  -6.832
  236    HB   THR  35           HB       THR  35   4.447  -0.572  -8.428
  237    HG1  THR  35           1HG      THR  35   6.455   0.393  -6.689
  238   HG21  THR  35          3HG2      THR  35   3.854   1.876  -8.364
  239   HG22  THR  35          1HG2      THR  35   5.385   1.461  -9.135
  240   HG23  THR  35          2HG2      THR  35   5.372   2.126  -7.502
  241    H    LYS  36           H        LYS  36   2.323  -1.962  -7.319
  242    HA   LYS  36           HA       LYS  36   2.485  -3.755  -5.165
  243    HB2  LYS  36           2HB      LYS  36   0.737  -3.904  -6.872
  244    HB3  LYS  36           1HB      LYS  36   1.934  -4.337  -8.083
  245    HG2  LYS  36           2HG      LYS  36   1.254  -6.426  -7.592
  246    HG3  LYS  36           1HG      LYS  36   2.416  -6.262  -6.275
  247    HD2  LYS  36           2HD      LYS  36   0.676  -5.655  -4.738
  248    HD3  LYS  36           1HD      LYS  36  -0.513  -5.591  -6.040
  249    HE2  LYS  36           2HE      LYS  36  -0.081  -8.021  -6.443
  250    HE3  LYS  36           1HE      LYS  36   0.922  -8.025  -4.993
  251    HZ1  LYS  36           3HZ      LYS  36  -0.908  -7.638  -3.635
  252    HZ2  LYS  36           1HZ      LYS  36  -1.502  -8.737  -4.776
  253    HZ3  LYS  36           2HZ      LYS  36  -1.881  -7.094  -4.907
  254    H    GLU  37           H        GLU  37   4.495  -3.372  -8.037
  255    HA   GLU  37           HA       GLU  37   5.997  -5.735  -7.838
  256    HB2  GLU  37           2HB      GLU  37   5.917  -4.010  -9.747
  257    HB3  GLU  37           1HB      GLU  37   7.115  -3.116  -8.823
  258    HG2  GLU  37           2HG      GLU  37   8.439  -5.336  -8.836
  259    HG3  GLU  37           1HG      GLU  37   7.369  -5.775 -10.166
  260    H    ASP  38           H        ASP  38   6.389  -2.569  -6.298
  261    HA   ASP  38           HA       ASP  38   8.938  -2.891  -5.210
  262    HB2  ASP  38           2HB      ASP  38   6.543  -1.260  -4.486
  263    HB3  ASP  38           1HB      ASP  38   7.817  -1.415  -3.282
  264    H    LEU  39           H        LEU  39   5.769  -3.770  -3.853
  265    HA   LEU  39           HA       LEU  39   6.719  -4.783  -1.411
  266    HB2  LEU  39           2HB      LEU  39   4.260  -5.686  -2.910
  267    HB3  LEU  39           1HB      LEU  39   4.565  -5.870  -1.193
  268    HG   LEU  39           HG       LEU  39   4.447  -3.142  -2.440
  269   HD11  LEU  39          1HD1      LEU  39   2.121  -4.796  -1.478
  270   HD12  LEU  39          2HD1      LEU  39   2.386  -4.175  -3.108
  271   HD13  LEU  39          3HD1      LEU  39   2.064  -3.059  -1.782
  272   HD21  LEU  39          3HD2      LEU  39   4.195  -2.363  -0.285
  273   HD22  LEU  39          1HD2      LEU  39   5.281  -3.731  -0.044
  274   HD23  LEU  39          2HD2      LEU  39   3.561  -3.898   0.311
  275    H    GLU  40           H        GLU  40   6.056  -6.447  -4.497
  276    HA   GLU  40           HA       GLU  40   6.660  -9.044  -3.616
  277    HB2  GLU  40           2HB      GLU  40   6.882  -7.804  -6.361
  278    HB3  GLU  40           1HB      GLU  40   7.085  -9.523  -6.047
  279    HG2  GLU  40           2HG      GLU  40   4.797  -9.606  -5.149
  280    HG3  GLU  40           1HG      GLU  40   4.601  -7.899  -5.543
  281    H    ASN  41           H        ASN  41   8.749  -6.407  -4.614
  282    HA   ASN  41           HA       ASN  41  11.097  -8.087  -4.777
  283    HB2  ASN  41           2HB      ASN  41  10.477  -5.224  -5.272
  284    HB3  ASN  41           1HB      ASN  41  12.132  -5.610  -4.816
  285   HD21  ASN  41          1HD2      ASN  41  13.472  -6.349  -6.329
  286   HD22  ASN  41          2HD2      ASN  41  13.007  -6.830  -7.922
  287    H    GLY  42           H        GLY  42   9.693  -5.805  -2.451
  288    HA2  GLY  42           2HA      GLY  42  10.371  -6.651  -0.097
  289    HA3  GLY  42           1HA      GLY  42  11.982  -6.232  -0.657
  290    H    GLU  43           H        GLU  43  10.382  -3.957  -2.192
  291    HA   GLU  43           HA       GLU  43  10.977  -1.905  -0.313
  292    HB2  GLU  43           2HB      GLU  43   9.711  -1.957  -3.041
  293    HB3  GLU  43           1HB      GLU  43   9.710  -0.483  -2.087
  294    HG2  GLU  43           2HG      GLU  43  12.302  -1.077  -1.919
  295    HG3  GLU  43           1HG      GLU  43  11.934  -1.864  -3.454
  296    H    ASP  44           H        ASP  44   9.649  -2.565   1.459
  297    HA   ASP  44           HA       ASP  44   6.761  -2.204   1.152
  298    HB2  ASP  44           2HB      ASP  44   6.656  -3.091   3.492
  299    HB3  ASP  44           1HB      ASP  44   7.345  -4.205   2.321
  300    H    VAL  45           H        VAL  45   8.272   0.108   0.854
  301    HA   VAL  45           HA       VAL  45   7.479   1.627   3.243
  302    HB   VAL  45           HB       VAL  45   9.911   1.374   3.304
  303   HG11  VAL  45          1HG1      VAL  45  10.125   2.955   0.764
  304   HG12  VAL  45          2HG1      VAL  45  10.071   1.192   0.747
  305   HG13  VAL  45          3HG1      VAL  45  11.368   2.026   1.603
  306   HG21  VAL  45          3HG2      VAL  45  10.376   3.555   3.864
  307   HG22  VAL  45          1HG2      VAL  45   8.613   3.580   3.862
  308   HG23  VAL  45          2HG2      VAL  45   9.506   4.213   2.478
  309    H    ALA  46           H        ALA  46   6.445   3.531   2.885
  310    HA   ALA  46           HA       ALA  46   6.077   4.330   0.070
  311    HB1  ALA  46           1HB      ALA  46   3.877   4.510   0.399
  312    HB2  ALA  46           2HB      ALA  46   4.087   5.367   1.925
  313    HB3  ALA  46           3HB      ALA  46   4.137   3.604   1.889
  314    H    THR  47           H        THR  47   6.637   6.331  -0.532
  315    HA   THR  47           HA       THR  47   7.492   8.206   1.574
  316    HB   THR  47           HB       THR  47   8.438   8.331  -1.280
  317    HG1  THR  47           1HG      THR  47   9.374   6.485  -0.948
  318   HG21  THR  47          3HG2      THR  47   9.181  10.224  -0.185
  319   HG22  THR  47          1HG2      THR  47  10.541   9.114  -0.028
  320   HG23  THR  47          2HG2      THR  47   9.448   9.367   1.333
  321    H    CYS  48           H        CYS  48   6.594  10.179   1.686
  322    HA   CYS  48           HA       CYS  48   4.387  10.789  -0.090
  323    HB2  CYS  48           2HB      CYS  48   4.753  11.233   2.561
  324    HB3  CYS  48           1HB      CYS  48   5.226  12.800   1.914
  325    HA   PRO  49           HA       PRO  49   6.825  13.505  -2.632
  326    HB2  PRO  49           2HB      PRO  49   4.870  14.575  -4.119
  327    HB3  PRO  49           1HB      PRO  49   5.332  12.875  -4.274
  328    HG2  PRO  49           2HG      PRO  49   3.007  14.083  -2.834
  329    HG3  PRO  49           1HG      PRO  49   3.074  12.613  -3.820
  330    HD2  PRO  49           2HD      PRO  49   3.153  12.655  -1.062
  331    HD3  PRO  49           1HD      PRO  49   3.784  11.335  -2.068
  332    H    SER  50           H        SER  50   4.947  14.560  -0.090
  333    HA   SER  50           HA       SER  50   5.531  17.385  -0.675
  334    HB2  SER  50           2HB      SER  50   3.053  16.348  -0.212
  335    HB3  SER  50           1HB      SER  50   3.526  16.822   1.418
  336    HG   SER  50           HG       SER  50   2.547  18.387  -0.371
  337    H    CYS  51           H        CYS  51   4.908  15.341   2.210
  338    HA   CYS  51           HA       CYS  51   6.783  16.930   3.748
  339    HB2  CYS  51           2HB      CYS  51   6.068  15.630   5.656
  340    HB3  CYS  51           1HB      CYS  51   4.654  16.141   4.740
  341    H    SER  52           H        SER  52   6.859  13.978   1.964
  342    HA   SER  52           HA       SER  52   8.503  12.475   1.532
  343    HB2  SER  52           2HB      SER  52  10.398  14.251   3.077
  344    HB3  SER  52           1HB      SER  52  10.790  13.107   1.793
  345    HG   SER  52           HG       SER  52  10.687  14.891   0.641
  346    H    LEU  53           H        LEU  53   6.851  12.068   3.769
  347    HA   LEU  53           HA       LEU  53   8.490  11.126   5.961
  348    HB2  LEU  53           2HB      LEU  53   6.296  12.153   6.374
  349    HB3  LEU  53           1HB      LEU  53   5.520  10.890   5.442
  350    HG   LEU  53           HG       LEU  53   6.283   9.229   7.134
  351   HD11  LEU  53          1HD1      LEU  53   7.569   9.733   8.903
  352   HD12  LEU  53          2HD1      LEU  53   6.802  11.302   9.147
  353   HD13  LEU  53          3HD1      LEU  53   8.061  11.116   7.926
  354   HD21  LEU  53          3HD2      LEU  53   4.809  11.210   8.739
  355   HD22  LEU  53          1HD2      LEU  53   4.408   9.540   8.341
  356   HD23  LEU  53          2HD2      LEU  53   4.111  10.820   7.166
  357    H    ILE  54           H        ILE  54   8.379   8.889   6.730
  358    HA   ILE  54           HA       ILE  54   8.154   6.982   4.491
  359    HB   ILE  54           HB       ILE  54   9.740   5.549   5.823
  360   HG12  ILE  54          2HG1      ILE  54  10.109   8.098   7.420
  361   HG13  ILE  54          1HG1      ILE  54   9.382   6.612   8.020
  362   HG21  ILE  54          1HG2      ILE  54  11.685   6.617   5.010
  363   HG22  ILE  54          2HG2      ILE  54  10.946   8.215   5.122
  364   HG23  ILE  54          3HG2      ILE  54  10.384   7.065   3.907
  365   HD11  ILE  54          3HD1      ILE  54  11.837   7.140   8.591
  366   HD12  ILE  54          1HD1      ILE  54  12.170   6.607   6.943
  367   HD13  ILE  54          2HD1      ILE  54  11.410   5.504   8.089
  368    H    ILE  55           H        ILE  55   7.051   5.051   4.794
  369    HA   ILE  55           HA       ILE  55   5.922   4.462   7.423
  370    HB   ILE  55           HB       ILE  55   3.654   4.082   6.453
  371   HG12  ILE  55          2HG1      ILE  55   4.225   5.934   4.208
  372   HG13  ILE  55          1HG1      ILE  55   4.809   4.284   4.023
  373   HG21  ILE  55          1HG2      ILE  55   4.682   6.913   6.346
  374   HG22  ILE  55          2HG2      ILE  55   4.100   6.059   7.775
  375   HG23  ILE  55          3HG2      ILE  55   2.986   6.444   6.463
  376   HD11  ILE  55          3HD1      ILE  55   2.061   4.412   4.967
  377   HD12  ILE  55          1HD1      ILE  55   2.765   3.497   3.636
  378   HD13  ILE  55          2HD1      ILE  55   2.299   5.180   3.398
  379    H    LYS  56           H        LYS  56   5.428   2.288   7.757
  380    HA   LYS  56           HA       LYS  56   6.595   0.478   5.789
  381    HB2  LYS  56           2HB      LYS  56   7.226   0.325   8.204
  382    HB3  LYS  56           1HB      LYS  56   5.572  -0.148   8.565
  383    HG2  LYS  56           2HG      LYS  56   6.457  -2.217   8.421
  384    HG3  LYS  56           1HG      LYS  56   6.140  -1.983   6.702
  385    HD2  LYS  56           2HD      LYS  56   8.398  -1.422   6.265
  386    HD3  LYS  56           1HD      LYS  56   8.759  -1.235   7.982
  387    HE2  LYS  56           2HE      LYS  56   7.808  -3.872   6.945
  388    HE3  LYS  56           1HE      LYS  56   9.489  -3.396   6.705
  389    HZ1  LYS  56           3HZ      LYS  56   9.291  -4.661   8.719
  390    HZ2  LYS  56           1HZ      LYS  56   8.076  -3.641   9.309
  391    HZ3  LYS  56           2HZ      LYS  56   9.655  -3.061   9.127
  392    H    VAL  57           H        VAL  57   5.582  -0.959   4.627
  393    HA   VAL  57           HA       VAL  57   2.654  -1.056   4.833
  394    HB   VAL  57           HB       VAL  57   3.986  -2.083   2.381
  395   HG11  VAL  57          1HG1      VAL  57   2.062  -0.827   1.373
  396   HG12  VAL  57          2HG1      VAL  57   1.558  -0.429   3.015
  397   HG13  VAL  57          3HG1      VAL  57   1.609  -2.112   2.493
  398   HG21  VAL  57          3HG2      VAL  57   5.279  -0.023   2.881
  399   HG22  VAL  57          1HG2      VAL  57   3.769   0.887   2.895
  400   HG23  VAL  57          2HG2      VAL  57   4.315   0.106   1.413
  401    H    ILE  58           H        ILE  58   1.930  -2.827   5.816
  402    HA   ILE  58           HA       ILE  58   3.511  -5.285   5.760
  403    HB   ILE  58           HB       ILE  58   0.948  -4.786   7.275
  404   HG12  ILE  58          2HG1      ILE  58   2.666  -3.134   7.924
  405   HG13  ILE  58          1HG1      ILE  58   2.320  -4.267   9.226
  406   HG21  ILE  58          1HG2      ILE  58   2.141  -6.589   8.751
  407   HG22  ILE  58          2HG2      ILE  58   2.993  -6.954   7.251
  408   HG23  ILE  58          3HG2      ILE  58   1.234  -7.062   7.316
  409   HD11  ILE  58          3HD1      ILE  58   4.732  -3.700   8.900
  410   HD12  ILE  58          1HD1      ILE  58   4.659  -4.561   7.363
  411   HD13  ILE  58          2HD1      ILE  58   4.358  -5.423   8.870
  412    H    TYR  59           H        TYR  59   2.920  -7.109   4.700
  413    HA   TYR  59           HA       TYR  59   0.230  -7.486   3.695
  414    HB2  TYR  59           2HB      TYR  59   1.050  -7.762   1.321
  415    HB3  TYR  59           1HB      TYR  59   1.058  -6.103   1.915
  416    HD1  TYR  59           1HD      TYR  59   3.233  -5.075   2.636
  417    HD2  TYR  59           2HD      TYR  59   3.049  -8.815   0.604
  418    HE1  TYR  59           1HE      TYR  59   5.621  -4.879   2.081
  419    HE2  TYR  59           2HE      TYR  59   5.434  -8.629   0.042
  420    HH   TYR  59           HH       TYR  59   7.517  -7.202   1.323
  421    H    ASP  60           H        ASP  60   0.095  -9.609   2.425
  422    HA   ASP  60           HA       ASP  60   1.612 -11.600   3.889
  423    HB2  ASP  60           2HB      ASP  60  -0.885 -11.763   3.458
  424    HB3  ASP  60           1HB      ASP  60  -0.490 -12.116   1.780
  425    H    LYS  61           H        LYS  61   3.663 -11.690   3.121
  426    HA   LYS  61           HA       LYS  61   4.475 -11.447   0.457
  427    HB2  LYS  61           2HB      LYS  61   5.718 -12.680   2.891
  428    HB3  LYS  61           1HB      LYS  61   6.500 -12.846   1.325
  429    HG2  LYS  61           2HG      LYS  61   5.676 -10.119   2.125
  430    HG3  LYS  61           1HG      LYS  61   7.021 -10.846   3.006
  431    HD2  LYS  61           2HD      LYS  61   7.060 -11.047   0.044
  432    HD3  LYS  61           1HD      LYS  61   7.366  -9.460   0.752
  433    HE2  LYS  61           2HE      LYS  61   9.478 -10.496   0.486
  434    HE3  LYS  61           1HE      LYS  61   9.100 -10.564   2.206
  435    HZ1  LYS  61           3HZ      LYS  61   8.681 -12.830   2.105
  436    HZ2  LYS  61           1HZ      LYS  61  10.012 -12.654   1.075
  437    HZ3  LYS  61           2HZ      LYS  61   8.461 -12.835   0.427
  438    H    ASP  62           H        ASP  62   3.220 -14.198   2.221
  439    HA   ASP  62           HA       ASP  62   4.060 -16.236   0.454
  440    HB2  ASP  62           2HB      ASP  62   2.995 -16.375   2.849
  441    HB3  ASP  62           1HB      ASP  62   1.472 -16.414   1.965
  442    H    GLN  63           H        GLN  63   1.254 -14.089   0.495
  443    HA   GLN  63           HA       GLN  63  -0.035 -15.418  -1.716
  444    HB2  GLN  63           2HB      GLN  63  -0.603 -13.058  -0.003
  445    HB3  GLN  63           1HB      GLN  63  -1.322 -13.065  -1.607
  446    HG2  GLN  63           2HG      GLN  63  -1.907 -15.577  -0.728
  447    HG3  GLN  63           1HG      GLN  63  -1.982 -14.644   0.763
  448   HE21  GLN  63          1HE2      GLN  63  -3.087 -14.538  -2.607
  449   HE22  GLN  63          2HE2      GLN  63  -4.631 -13.850  -2.256
  450    H    PHE  64           H        PHE  64   1.984 -12.544  -1.264
  451    HA   PHE  64           HA       PHE  64   1.676 -11.450  -3.832
  452    HB2  PHE  64           2HB      PHE  64   3.689 -11.164  -1.652
  453    HB3  PHE  64           1HB      PHE  64   4.131 -10.584  -3.256
  454    HD1  PHE  64           2HD      PHE  64   1.231 -10.400  -0.904
  455    HD2  PHE  64           1HD      PHE  64   3.690  -8.381  -3.732
  456    HE1  PHE  64           2HE      PHE  64  -0.011  -8.319  -0.493
  457    HE2  PHE  64           1HE      PHE  64   2.450  -6.297  -3.326
  458    HZ   PHE  64           HZ       PHE  64   0.596  -6.263  -1.704
  459    H    VAL  65           H        VAL  65   4.429 -13.392  -2.600
  460    HA   VAL  65           HA       VAL  65   4.945 -14.200  -5.384
  461    HB   VAL  65           HB       VAL  65   6.795 -12.939  -4.431
  462   HG11  VAL  65          1HG1      VAL  65   7.565 -13.161  -2.358
  463   HG12  VAL  65          2HG1      VAL  65   7.738 -14.907  -2.528
  464   HG13  VAL  65          3HG1      VAL  65   6.187 -14.217  -2.054
  465   HG21  VAL  65          3HG2      VAL  65   8.460 -14.274  -5.260
  466   HG22  VAL  65          1HG2      VAL  65   7.043 -15.108  -5.901
  467   HG23  VAL  65          2HG2      VAL  65   7.850 -15.723  -4.458
  468    H    SER  66           H        SER  66   3.695 -16.002  -5.542
  469    HA   SER  66           HA       SER  66   3.959 -18.116  -3.537
  470    HB2  SER  66           2HB      SER  66   1.958 -17.404  -5.609
  471    HB3  SER  66           1HB      SER  66   2.184 -19.125  -5.304
  472    HG   SER  66           HG       SER  66   0.750 -17.462  -3.899
  473    H    GLY  67           H        GLY  67   6.083 -18.820  -4.035
  474    HA2  GLY  67           2HA      GLY  67   6.944 -19.563  -6.624
  475    HA3  GLY  67           1HA      GLY  67   7.671 -20.087  -5.113
  476    H    GLU  68           H        GLU  68   5.602 -21.507  -3.960
  477    HA   GLU  68           HA       GLU  68   5.156 -23.678  -5.902
  478    HB2  GLU  68           2HB      GLU  68   6.147 -23.721  -3.091
  479    HB3  GLU  68           1HB      GLU  68   5.117 -25.048  -3.611
  480    HG2  GLU  68           2HG      GLU  68   6.865 -24.934  -5.671
  481    HG3  GLU  68           1HG      GLU  68   7.888 -24.401  -4.339
  482    H    THR  69           H        THR  69   3.101 -22.778  -6.420
  483    HA   THR  69           HA       THR  69   1.054 -23.296  -4.368
  484    HB   THR  69           HB       THR  69   1.374 -20.870  -4.665
  485    HG1  THR  69           1HG      THR  69  -0.743 -20.450  -4.737
  486   HG21  THR  69          3HG2      THR  69   2.094 -20.735  -6.962
  487   HG22  THR  69          1HG2      THR  69   0.632 -19.774  -6.728
  488   HG23  THR  69          2HG2      THR  69   0.535 -21.349  -7.515
  489    H    VAL  70           H        VAL  70  -1.114 -23.752  -5.260
  490    HA   VAL  70           HA       VAL  70  -0.900 -25.265  -7.775
  491    HB   VAL  70           HB       VAL  70  -3.005 -25.612  -5.638
  492   HG11  VAL  70          1HG1      VAL  70  -2.150 -27.341  -7.954
  493   HG12  VAL  70          2HG1      VAL  70  -3.676 -26.472  -7.787
  494   HG13  VAL  70          3HG1      VAL  70  -3.306 -27.819  -6.711
  495   HG21  VAL  70          3HG2      VAL  70  -1.247 -26.329  -4.399
  496   HG22  VAL  70          1HG2      VAL  70  -0.243 -26.657  -5.810
  497   HG23  VAL  70          2HG2      VAL  70  -1.498 -27.801  -5.336
  498    HA   PRO  71           HA       PRO  71  -3.551 -22.403  -9.885
  499    HB2  PRO  71           2HB      PRO  71  -4.628 -24.831 -11.226
  500    HB3  PRO  71           1HB      PRO  71  -3.942 -23.364 -11.932
  501    HG2  PRO  71           2HG      PRO  71  -2.551 -25.635 -11.897
  502    HG3  PRO  71           1HG      PRO  71  -1.759 -24.074 -11.614
  503    HD2  PRO  71           2HD      PRO  71  -2.526 -26.194  -9.653
  504    HD3  PRO  71           1HD      PRO  71  -1.086 -25.156  -9.687
  505    H    ALA  72           H        ALA  72  -5.337 -21.505  -9.107
  506    HA   ALA  72           HA       ALA  72  -7.474 -21.188  -8.397
  507    HB1  ALA  72           1HB      ALA  72  -8.215 -24.053  -8.710
  508    HB2  ALA  72           2HB      ALA  72  -7.851 -23.108 -10.155
  509    HB3  ALA  72           3HB      ALA  72  -9.144 -22.597  -9.071
  510    HA   PRO  73           HA       PRO  73  -7.391 -22.305  -4.126
  511    HB2  PRO  73           2HB      PRO  73  -9.962 -21.990  -3.368
  512    HB3  PRO  73           1HB      PRO  73  -8.931 -20.621  -3.801
  513    HG2  PRO  73           2HG      PRO  73 -10.987 -22.041  -5.454
  514    HG3  PRO  73           1HG      PRO  73 -10.700 -20.299  -5.282
  515    HD2  PRO  73           2HD      PRO  73  -9.795 -21.739  -7.399
  516    HD3  PRO  73           1HD      PRO  73  -8.940 -20.316  -6.770
  517    H    SER  74           H        SER  74  -8.227 -23.785  -2.477
  518    HA   SER  74           HA       SER  74  -9.760 -26.066  -3.435
  519    HB2  SER  74           2HB      SER  74  -6.982 -26.400  -2.278
  520    HB3  SER  74           1HB      SER  74  -8.073 -27.700  -2.749
  521    HG   SER  74           HG       SER  74  -7.992 -26.613  -4.907
  522    H    ALA  75           H        ALA  75  -7.714 -25.080  -0.672
  523    HA   ALA  75           HA       ALA  75  -9.759 -26.095   1.163
  524    HB1  ALA  75           1HB      ALA  75  -7.785 -25.405   2.819
  525    HB2  ALA  75           2HB      ALA  75  -6.839 -25.613   1.346
  526    HB3  ALA  75           3HB      ALA  75  -7.811 -26.948   1.966
  527    H    ASN  76           H        ASN  76  -9.951 -24.764   3.263
  528    HA   ASN  76           HA       ASN  76  -9.799 -21.886   2.824
  529    HB2  ASN  76           2HB      ASN  76 -12.337 -23.446   3.024
  530    HB3  ASN  76           1HB      ASN  76 -12.270 -21.873   3.814
  531   HD21  ASN  76          1HD2      ASN  76 -11.245 -20.131   2.350
  532   HD22  ASN  76          2HD2      ASN  76 -11.845 -20.086   0.731
  533    H    LYS  77           H        LYS  77  -8.326 -23.591   4.560
  534    HA   LYS  77           HA       LYS  77  -9.134 -22.454   7.142
  535    HB2  LYS  77           2HB      LYS  77  -8.472 -25.334   6.564
  536    HB3  LYS  77           1HB      LYS  77  -8.238 -24.654   8.166
  537    HG2  LYS  77           2HG      LYS  77 -10.885 -24.266   6.887
  538    HG3  LYS  77           1HG      LYS  77 -10.471 -25.882   7.461
  539    HD2  LYS  77           2HD      LYS  77 -11.452 -25.001   9.342
  540    HD3  LYS  77           1HD      LYS  77  -9.760 -24.592   9.634
  541    HE2  LYS  77           2HE      LYS  77 -10.086 -22.347   8.988
  542    HE3  LYS  77           1HE      LYS  77 -11.651 -22.702   8.259
  543    HZ1  LYS  77           3HZ      LYS  77 -12.165 -23.425  10.737
  544    HZ2  LYS  77           1HZ      LYS  77 -12.346 -21.826  10.214
  545    HZ3  LYS  77           2HZ      LYS  77 -10.960 -22.285  11.065
  546    H    GLU  78           H        GLU  78  -7.162 -21.509   5.285
  547    HA   GLU  78           HA       GLU  78  -4.556 -22.345   6.047
  548    HB2  GLU  78           2HB      GLU  78  -5.510 -20.869   3.996
  549    HB3  GLU  78           1HB      GLU  78  -4.915 -19.582   5.033
  550    HG2  GLU  78           2HG      GLU  78  -2.763 -20.084   4.646
  551    HG3  GLU  78           1HG      GLU  78  -3.055 -21.823   4.656
  552    H    LEU  79           H        LEU  79  -4.306 -22.303   8.257
  553    HA   LEU  79           HA       LEU  79  -4.382 -19.657   9.537
  554    HB2  LEU  79           2HB      LEU  79  -5.993 -21.751  10.161
  555    HB3  LEU  79           1HB      LEU  79  -4.647 -22.064  11.235
  556    HG   LEU  79           HG       LEU  79  -5.083 -19.420  11.724
  557   HD11  LEU  79          1HD1      LEU  79  -7.869 -20.335  11.821
  558   HD12  LEU  79          2HD1      LEU  79  -7.252 -20.019  10.200
  559   HD13  LEU  79          3HD1      LEU  79  -7.204 -18.751  11.425
  560   HD21  LEU  79          3HD2      LEU  79  -6.461 -20.320  13.697
  561   HD22  LEU  79          1HD2      LEU  79  -4.801 -20.885  13.515
  562   HD23  LEU  79          2HD2      LEU  79  -6.143 -21.912  13.011
  563    H    VAL  80           H        VAL  80  -3.237 -21.009  11.981
  564    HA   VAL  80           HA       VAL  80  -0.446 -20.876  11.136
  565    HB   VAL  80           HB       VAL  80  -1.495 -21.017  13.968
  566   HG11  VAL  80          1HG1      VAL  80   1.026 -21.426  13.154
  567   HG12  VAL  80          2HG1      VAL  80   0.621 -20.651  14.685
  568   HG13  VAL  80          3HG1      VAL  80   1.044 -19.667  13.285
  569   HG21  VAL  80          3HG2      VAL  80  -1.148 -18.682  12.128
  570   HG22  VAL  80          1HG2      VAL  80  -0.914 -18.486  13.866
  571   HG23  VAL  80          2HG2      VAL  80  -2.467 -19.044  13.242
  572    H    LYS  81           H        LYS  81   0.215 -22.810  10.370
  573    HA   LYS  81           HA       LYS  81   0.841 -24.988  10.297
  574    HB2  LYS  81           2HB      LYS  81   1.780 -24.262  12.576
  575    HB3  LYS  81           1HB      LYS  81   0.423 -25.130  13.278
  576    HG2  LYS  81           2HG      LYS  81   1.232 -27.188  12.644
  577    HG3  LYS  81           1HG      LYS  81   2.188 -26.523  11.318
  578    HD2  LYS  81           2HD      LYS  81   3.678 -25.461  13.013
  579    HD3  LYS  81           1HD      LYS  81   2.775 -26.307  14.270
  580    HE2  LYS  81           2HE      LYS  81   4.120 -27.728  11.979
  581    HE3  LYS  81           1HE      LYS  81   4.935 -27.392  13.506
  582    HZ1  LYS  81           3HZ      LYS  81   2.412 -28.942  13.260
  583    HZ2  LYS  81           1HZ      LYS  81   3.321 -28.708  14.668
  584    HZ3  LYS  81           2HZ      LYS  81   3.950 -29.632  13.398
  585    H    LEU  82           H        LEU  82  -1.162 -25.412   9.146
  586    HA   LEU  82           HA       LEU  82  -2.873 -27.285  10.627
  587    HB2  LEU  82           2HB      LEU  82  -3.790 -24.821  10.065
  588    HB3  LEU  82           1HB      LEU  82  -4.196 -25.620   8.559
  589    HG   LEU  82           HG       LEU  82  -5.250 -27.415  10.219
  590   HD11  LEU  82          1HD1      LEU  82  -6.366 -26.160  12.085
  591   HD12  LEU  82          2HD1      LEU  82  -5.233 -24.843  11.782
  592   HD13  LEU  82          3HD1      LEU  82  -4.634 -26.423  12.286
  593   HD21  LEU  82          3HD2      LEU  82  -7.374 -26.431   9.809
  594   HD22  LEU  82          1HD2      LEU  82  -6.355 -26.062   8.418
  595   HD23  LEU  82          2HD2      LEU  82  -6.667 -24.825   9.637
  596    H    GLU  83           H        GLU  83  -3.986 -28.839   9.281
  597    HA   GLU  83           HA       GLU  83  -4.221 -30.313   7.568
  598    HB2  GLU  83           2HB      GLU  83  -4.007 -27.981   6.223
  599    HB3  GLU  83           1HB      GLU  83  -2.581 -28.810   5.614
  600    HG2  GLU  83           2HG      GLU  83  -3.946 -30.670   4.869
  601    HG3  GLU  83           1HG      GLU  83  -5.386 -29.902   5.536
  602    H    HIS  84           H        HIS  84  -0.985 -28.862   7.048
  603    HA   HIS  84           HA       HIS  84   0.271 -31.335   6.494
  604    HB2  HIS  84           2HB      HIS  84   1.157 -29.146   5.756
  605    HB3  HIS  84           1HB      HIS  84   1.511 -28.733   7.427
  606    HD1  HIS  84           1HD      HIS  84   3.019 -30.179   4.486
  607    HD2  HIS  84           2HD      HIS  84   3.520 -30.587   8.592
  608    HE1  HIS  84           1HE      HIS  84   5.299 -31.196   4.788
  609    HE2  HIS  84           2HE      HIS  84   5.587 -31.419   7.281
  Start of MODEL    7
    1    H1   MET   1           1HT      MET   1  15.690   1.192  17.725
    2    H2   MET   1           2HT      MET   1  14.171   1.395  16.955
    3    H3   MET   1           3HT      MET   1  15.483   2.425  16.553
    4    HA   MET   1           HA       MET   1  16.683   0.335  15.887
    5    HB2  MET   1           2HB      MET   1  14.537  -0.875  16.990
    6    HB3  MET   1           1HB      MET   1  14.000  -0.802  15.317
    7    HG2  MET   1           2HG      MET   1  15.968  -2.009  14.598
    8    HG3  MET   1           1HG      MET   1  16.597  -2.014  16.245
    9    HE1  MET   1           2HE      MET   1  14.510  -3.096  18.284
   10    HE2  MET   1           3HE      MET   1  16.169  -3.579  17.932
   11    HE3  MET   1           1HE      MET   1  14.896  -4.795  18.014
   12    H    ALA   2           H        ALA   2  13.598   1.858  14.957
   13    HA   ALA   2           HA       ALA   2  14.755   2.402  12.311
   14    HB1  ALA   2           1HB      ALA   2  12.951   0.439  12.548
   15    HB2  ALA   2           2HB      ALA   2  13.063   1.472  11.124
   16    HB3  ALA   2           3HB      ALA   2  11.855   1.809  12.363
   17    H    VAL   3           H        VAL   3  13.920   4.258  11.233
   18    HA   VAL   3           HA       VAL   3  12.704   6.202  13.074
   19    HB   VAL   3           HB       VAL   3  13.523   7.937  11.455
   20   HG11  VAL   3          1HG1      VAL   3  15.441   6.118  12.874
   21   HG12  VAL   3          2HG1      VAL   3  14.802   7.676  13.397
   22   HG13  VAL   3          3HG1      VAL   3  15.971   7.601  12.080
   23   HG21  VAL   3          3HG2      VAL   3  15.147   7.378   9.785
   24   HG22  VAL   3          1HG2      VAL   3  13.708   6.397   9.503
   25   HG23  VAL   3          2HG2      VAL   3  15.130   5.681  10.264
   26    H    PHE   4           H        PHE   4  11.146   4.196  11.625
   27    HA   PHE   4           HA       PHE   4   9.807   5.467   9.433
   28    HB2  PHE   4           2HB      PHE   4   9.432   2.947  11.001
   29    HB3  PHE   4           1HB      PHE   4   8.099   3.531  10.014
   30    HD1  PHE   4           2HD      PHE   4  11.780   3.523   9.375
   31    HD2  PHE   4           1HD      PHE   4   7.933   2.118   8.217
   32    HE1  PHE   4           2HE      PHE   4  12.774   2.431   7.405
   33    HE2  PHE   4           1HE      PHE   4   8.919   1.023   6.253
   34    HZ   PHE   4           HZ       PHE   4  11.342   1.176   5.841
   35    H    HIS   5           H        HIS   5   7.302   5.547   9.538
   36    HA   HIS   5           HA       HIS   5   6.611   7.272  11.795
   37    HB2  HIS   5           2HB      HIS   5   6.232   7.958   9.366
   38    HB3  HIS   5           1HB      HIS   5   4.944   6.761   9.328
   39    HD1  HIS   5           1HD      HIS   5   2.756   7.334  10.533
   40    HD2  HIS   5           2HD      HIS   5   5.689  10.251  10.916
   41    HE1  HIS   5           1HE      HIS   5   1.584   9.345  11.483
   42    HE2  HIS   5           2HE      HIS   5   3.407  11.050  11.825
   43    H    ASP   6           H        ASP   6   4.843   4.812   9.889
   44    HA   ASP   6           HA       ASP   6   4.136   3.301  12.220
   45    HB2  ASP   6           2HB      ASP   6   2.246   5.304  11.118
   46    HB3  ASP   6           1HB      ASP   6   1.570   3.715  11.458
   47    H    GLU   7           H        GLU   7   3.541   1.236  11.691
   48    HA   GLU   7           HA       GLU   7   3.609   0.541   8.859
   49    HB2  GLU   7           2HB      GLU   7   3.404  -1.369  11.190
   50    HB3  GLU   7           1HB      GLU   7   3.936  -1.722   9.554
   51    HG2  GLU   7           2HG      GLU   7   6.002  -1.504  10.336
   52    HG3  GLU   7           1HG      GLU   7   5.693   0.231  10.363
   53    H    VAL   8           H        VAL   8   1.891  -0.159   7.697
   54    HA   VAL   8           HA       VAL   8  -0.603  -0.797   9.114
   55    HB   VAL   8           HB       VAL   8  -0.543   0.994   6.683
   56   HG11  VAL   8          1HG1      VAL   8  -2.797   0.587   8.624
   57   HG12  VAL   8          2HG1      VAL   8  -2.575  -0.454   7.219
   58   HG13  VAL   8          3HG1      VAL   8  -2.850   1.273   7.002
   59   HG21  VAL   8          3HG2      VAL   8  -1.057   1.855   9.524
   60   HG22  VAL   8          1HG2      VAL   8  -0.935   2.875   8.092
   61   HG23  VAL   8          2HG2      VAL   8   0.495   2.051   8.712
   62    H    GLU   9           H        GLU   9  -1.886  -2.323   8.163
   63    HA   GLU   9           HA       GLU   9  -0.689  -4.117   6.329
   64    HB2  GLU   9           2HB      GLU   9  -3.487  -3.893   7.430
   65    HB3  GLU   9           1HB      GLU   9  -3.023  -5.151   6.293
   66    HG2  GLU   9           2HG      GLU   9  -1.774  -6.275   7.821
   67    HG3  GLU   9           1HG      GLU   9  -1.354  -4.815   8.719
   68    H    ILE  10           H        ILE  10  -1.010  -4.469   4.190
   69    HA   ILE  10           HA       ILE  10  -1.614  -2.350   2.497
   70    HB   ILE  10           HB       ILE  10  -0.272  -4.337   1.869
   71   HG12  ILE  10          2HG1      ILE  10  -1.768  -4.604  -0.416
   72   HG13  ILE  10          1HG1      ILE  10  -2.352  -3.074   0.228
   73   HG21  ILE  10          1HG2      ILE  10  -2.960  -5.691   1.717
   74   HG22  ILE  10          2HG2      ILE  10  -1.599  -6.121   2.753
   75   HG23  ILE  10          3HG2      ILE  10  -1.480  -6.336   1.007
   76   HD11  ILE  10          3HD1      ILE  10  -0.217  -3.317  -1.374
   77   HD12  ILE  10          1HD1      ILE  10   0.566  -3.405   0.204
   78   HD13  ILE  10          2HD1      ILE  10  -0.430  -2.009  -0.210
   79    H    GLU  11           H        GLU  11  -3.750  -4.714   3.929
   80    HA   GLU  11           HA       GLU  11  -5.938  -4.537   2.189
   81    HB2  GLU  11           2HB      GLU  11  -5.965  -4.937   5.187
   82    HB3  GLU  11           1HB      GLU  11  -7.289  -5.303   4.092
   83    HG2  GLU  11           2HG      GLU  11  -6.219  -7.144   3.199
   84    HG3  GLU  11           1HG      GLU  11  -4.621  -6.577   3.681
   85    H    ASP  12           H        ASP  12  -4.831  -2.406   4.749
   86    HA   ASP  12           HA       ASP  12  -7.198  -0.803   4.847
   87    HB2  ASP  12           2HB      ASP  12  -5.106  -1.088   6.522
   88    HB3  ASP  12           1HB      ASP  12  -4.602   0.374   5.678
   89    H    PHE  13           H        PHE  13  -4.285  -0.801   2.920
   90    HA   PHE  13           HA       PHE  13  -4.392   1.863   1.972
   91    HB2  PHE  13           2HB      PHE  13  -3.076  -0.660   1.008
   92    HB3  PHE  13           1HB      PHE  13  -3.063   0.780  -0.001
   93    HD1  PHE  13           2HD      PHE  13  -2.401  -0.086   3.582
   94    HD2  PHE  13           1HD      PHE  13  -1.182   2.059   0.114
   95    HE1  PHE  13           2HE      PHE  13  -0.425   0.741   4.791
   96    HE2  PHE  13           1HE      PHE  13   0.795   2.886   1.313
   97    HZ   PHE  13           HZ       PHE  13   1.178   2.228   3.656
   98    H    GLN  14           H        GLN  14  -4.660   2.319  -0.462
   99    HA   GLN  14           HA       GLN  14  -7.222   1.154  -1.316
  100    HB2  GLN  14           2HB      GLN  14  -7.022   3.660  -0.901
  101    HB3  GLN  14           1HB      GLN  14  -5.998   3.721  -2.330
  102    HG2  GLN  14           2HG      GLN  14  -7.796   2.917  -3.716
  103    HG3  GLN  14           1HG      GLN  14  -8.826   2.689  -2.304
  104   HE21  GLN  14          1HE2      GLN  14  -9.973   4.378  -1.530
  105   HE22  GLN  14          2HE2      GLN  14  -9.938   5.969  -2.201
  106    H    TYR  15           H        TYR  15  -6.948  -0.448  -2.743
  107    HA   TYR  15           HA       TYR  15  -4.655  -0.756  -4.379
  108    HB2  TYR  15           2HB      TYR  15  -6.011  -2.673  -3.687
  109    HB3  TYR  15           1HB      TYR  15  -7.380  -2.058  -4.603
  110    HD1  TYR  15           2HD      TYR  15  -3.872  -3.252  -5.015
  111    HD2  TYR  15           1HD      TYR  15  -7.681  -2.706  -6.831
  112    HE1  TYR  15           2HE      TYR  15  -3.107  -4.515  -6.977
  113    HE2  TYR  15           1HE      TYR  15  -6.925  -3.970  -8.800
  114    HH   TYR  15           HH       TYR  15  -3.956  -5.725  -8.843
  115    H    ASP  16           H        ASP  16  -4.152   0.565  -5.997
  116    HA   ASP  16           HA       ASP  16  -6.227   1.933  -7.507
  117    HB2  ASP  16           2HB      ASP  16  -3.950   2.915  -6.647
  118    HB3  ASP  16           1HB      ASP  16  -3.296   2.180  -8.104
  119    H    GLU  17           H        GLU  17  -7.183   0.434  -8.822
  120    HA   GLU  17           HA       GLU  17  -5.898  -1.587 -10.276
  121    HB2  GLU  17           2HB      GLU  17  -7.969  -1.401 -11.797
  122    HB3  GLU  17           1HB      GLU  17  -8.209  -1.847 -10.114
  123    HG2  GLU  17           2HG      GLU  17  -9.380   0.010  -9.655
  124    HG3  GLU  17           1HG      GLU  17  -8.339   1.035 -10.644
  125    H    ASP  18           H        ASP  18  -6.190   1.809 -10.909
  126    HA   ASP  18           HA       ASP  18  -5.945   2.026 -13.627
  127    HB2  ASP  18           2HB      ASP  18  -5.949   3.821 -11.652
  128    HB3  ASP  18           1HB      ASP  18  -4.220   3.820 -11.987
  129    H    SER  19           H        SER  19  -3.224   1.711 -11.317
  130    HA   SER  19           HA       SER  19  -1.650   0.461 -13.446
  131    HB2  SER  19           2HB      SER  19  -0.546   2.732 -11.778
  132    HB3  SER  19           1HB      SER  19   0.276   1.880 -13.084
  133    HG   SER  19           HG       SER  19  -1.427   3.975 -13.212
  134    H    GLU  20           H        GLU  20  -2.932  -0.487 -10.941
  135    HA   GLU  20           HA       GLU  20  -2.511  -1.797  -9.126
  136    HB2  GLU  20           2HB      GLU  20   0.104  -2.463 -10.467
  137    HB3  GLU  20           1HB      GLU  20  -0.858  -3.480  -9.405
  138    HG2  GLU  20           2HG      GLU  20  -2.410  -2.704 -11.689
  139    HG3  GLU  20           1HG      GLU  20  -0.874  -3.395 -12.206
  140    H    THR  21           H        THR  21  -2.212   0.381  -8.017
  141    HA   THR  21           HA       THR  21   0.363   0.331  -6.607
  142    HB   THR  21           HB       THR  21  -0.954   2.894  -7.539
  143    HG1  THR  21           1HG      THR  21   1.161   1.384  -8.646
  144   HG21  THR  21          3HG2      THR  21   1.857   2.562  -6.559
  145   HG22  THR  21          1HG2      THR  21   0.522   2.951  -5.475
  146   HG23  THR  21          2HG2      THR  21   0.936   4.047  -6.793
  147    H    TYR  22           H        TYR  22   0.280   1.095  -4.436
  148    HA   TYR  22           HA       TYR  22  -2.459   1.327  -3.364
  149    HB2  TYR  22           2HB      TYR  22  -0.011   0.284  -1.923
  150    HB3  TYR  22           1HB      TYR  22  -1.654   0.326  -1.296
  151    HD1  TYR  22           2HD      TYR  22   0.494  -1.210  -3.899
  152    HD2  TYR  22           1HD      TYR  22  -3.161  -1.440  -1.731
  153    HE1  TYR  22           2HE      TYR  22   0.096  -3.452  -4.819
  154    HE2  TYR  22           1HE      TYR  22  -3.566  -3.685  -2.646
  155    HH   TYR  22           HH       TYR  22  -1.541  -5.614  -3.756
  156    H    PHE  23           H        PHE  23  -2.953   2.998  -1.994
  157    HA   PHE  23           HA       PHE  23  -0.778   4.889  -1.361
  158    HB2  PHE  23           2HB      PHE  23  -3.590   5.619  -2.208
  159    HB3  PHE  23           1HB      PHE  23  -2.312   6.751  -1.782
  160    HD1  PHE  23           1HD      PHE  23  -3.034   3.978  -4.169
  161    HD2  PHE  23           2HD      PHE  23  -1.014   7.658  -3.460
  162    HE1  PHE  23           1HE      PHE  23  -2.301   4.023  -6.514
  163    HE2  PHE  23           2HE      PHE  23  -0.278   7.708  -5.807
  164    HZ   PHE  23           HZ       PHE  23  -0.921   5.889  -7.338
  165    H    TYR  24           H        TYR  24  -1.142   6.284   0.486
  166    HA   TYR  24           HA       TYR  24  -3.187   5.340   2.371
  167    HB2  TYR  24           2HB      TYR  24  -0.810   4.343   2.741
  168    HB3  TYR  24           1HB      TYR  24  -0.414   5.945   3.357
  169    HD1  TYR  24           2HD      TYR  24  -2.975   3.256   3.781
  170    HD2  TYR  24           1HD      TYR  24  -0.733   6.375   5.614
  171    HE1  TYR  24           2HE      TYR  24  -3.922   2.646   5.965
  172    HE2  TYR  24           1HE      TYR  24  -1.674   5.772   7.804
  173    HH   TYR  24           HH       TYR  24  -3.167   2.922   8.447
  174    HA   PRO  25           HA       PRO  25  -3.888   9.699   2.864
  175    HB2  PRO  25           2HB      PRO  25  -5.244   9.623   5.231
  176    HB3  PRO  25           1HB      PRO  25  -5.967   9.201   3.675
  177    HG2  PRO  25           2HG      PRO  25  -4.864   7.406   5.803
  178    HG3  PRO  25           1HG      PRO  25  -6.347   7.229   4.847
  179    HD2  PRO  25           2HD      PRO  25  -4.100   5.859   4.268
  180    HD3  PRO  25           1HD      PRO  25  -5.212   6.420   3.004
  181    H    CYS  26           H        CYS  26  -2.442  11.164   3.490
  182    HA   CYS  26           HA       CYS  26  -0.839  10.658   5.891
  183    HB2  CYS  26           2HB      CYS  26  -0.144  11.514   3.332
  184    HB3  CYS  26           1HB      CYS  26  -0.045  12.970   4.320
  185    HA   PRO  27           HA       PRO  27  -2.930  13.823   8.166
  186    HB2  PRO  27           2HB      PRO  27  -0.951  14.548   9.886
  187    HB3  PRO  27           1HB      PRO  27  -1.873  13.049  10.044
  188    HG2  PRO  27           2HG      PRO  27   0.847  13.489   8.873
  189    HG3  PRO  27           1HG      PRO  27   0.281  12.184   9.932
  190    HD2  PRO  27           2HD      PRO  27   0.559  11.869   7.260
  191    HD3  PRO  27           1HD      PRO  27  -0.696  11.026   8.194
  192    H    CYS  28           H        CYS  28  -0.026  14.475   6.376
  193    HA   CYS  28           HA       CYS  28   0.042  17.292   6.899
  194    HB2  CYS  28           2HB      CYS  28   1.725  17.372   5.109
  195    HB3  CYS  28           1HB      CYS  28   2.080  16.099   6.270
  196    H    GLY  29           H        GLY  29  -1.351  15.226   4.394
  197    HA2  GLY  29           2HA      GLY  29  -3.490  16.604   3.640
  198    HA3  GLY  29           1HA      GLY  29  -2.232  17.536   2.844
  199    H    ASP  30           H        ASP  30  -0.519  15.639   1.921
  200    HA   ASP  30           HA       ASP  30  -1.994  14.551  -0.294
  201    HB2  ASP  30           2HB      ASP  30   0.519  15.493  -0.060
  202    HB3  ASP  30           1HB      ASP  30   0.843  13.773   0.123
  203    H    ASN  31           H        ASN  31  -0.733  12.153  -0.873
  204    HA   ASN  31           HA       ASN  31  -1.269  10.419   1.429
  205    HB2  ASN  31           2HB      ASN  31  -2.379   9.865  -1.329
  206    HB3  ASN  31           1HB      ASN  31  -2.665   8.938   0.138
  207   HD21  ASN  31          1HD2      ASN  31  -3.269  12.019  -1.452
  208   HD22  ASN  31          2HD2      ASN  31  -4.704  12.399  -0.565
  209    H    PHE  32           H        PHE  32   0.002   8.639   1.575
  210    HA   PHE  32           HA       PHE  32   2.438   8.521   0.175
  211    HB2  PHE  32           2HB      PHE  32   0.984   6.661   2.028
  212    HB3  PHE  32           1HB      PHE  32   2.425   6.096   1.193
  213    HD1  PHE  32           2HD      PHE  32   4.552   7.515   1.455
  214    HD2  PHE  32           1HD      PHE  32   1.173   7.837   4.023
  215    HE1  PHE  32           2HE      PHE  32   5.968   8.538   3.187
  216    HE2  PHE  32           1HE      PHE  32   2.586   8.861   5.759
  217    HZ   PHE  32           HZ       PHE  32   4.988   9.212   5.341
  218    H    SER  33           H        SER  33   3.228   6.627  -1.112
  219    HA   SER  33           HA       SER  33   1.175   5.203  -2.615
  220    HB2  SER  33           2HB      SER  33   2.396   5.865  -4.785
  221    HB3  SER  33           1HB      SER  33   1.335   7.065  -4.049
  222    HG   SER  33           HG       SER  33   3.293   8.027  -4.596
  223    H    ILE  34           H        ILE  34   1.804   3.245  -3.364
  224    HA   ILE  34           HA       ILE  34   4.606   2.527  -3.534
  225    HB   ILE  34           HB       ILE  34   4.153   2.121  -1.165
  226   HG12  ILE  34          2HG1      ILE  34   4.179  -0.665  -2.140
  227   HG13  ILE  34          1HG1      ILE  34   5.355   0.401  -2.903
  228   HG21  ILE  34          1HG2      ILE  34   1.626   1.534  -1.856
  229   HG22  ILE  34          2HG2      ILE  34   2.355   1.048  -0.328
  230   HG23  ILE  34          3HG2      ILE  34   2.274  -0.095  -1.668
  231   HD11  ILE  34          3HD1      ILE  34   5.559  -0.909  -0.441
  232   HD12  ILE  34          1HD1      ILE  34   5.387   0.807  -0.074
  233   HD13  ILE  34          2HD1      ILE  34   6.678   0.260  -1.143
  234    H    THR  35           H        THR  35   4.867   1.273  -5.271
  235    HA   THR  35           HA       THR  35   2.628   0.317  -6.758
  236    HB   THR  35           HB       THR  35   4.391  -0.677  -8.250
  237    HG1  THR  35           1HG      THR  35   6.513  -0.375  -7.743
  238   HG21  THR  35          3HG2      THR  35   5.100   2.156  -7.566
  239   HG22  THR  35          1HG2      THR  35   3.622   1.727  -8.428
  240   HG23  THR  35          2HG2      THR  35   5.195   1.344  -9.128
  241    H    LYS  36           H        LYS  36   2.049  -1.822  -7.268
  242    HA   LYS  36           HA       LYS  36   2.079  -3.646  -5.129
  243    HB2  LYS  36           2HB      LYS  36   0.352  -3.571  -6.927
  244    HB3  LYS  36           1HB      LYS  36   1.528  -4.255  -8.042
  245    HG2  LYS  36           2HG      LYS  36   1.019  -5.729  -5.521
  246    HG3  LYS  36           1HG      LYS  36  -0.247  -5.741  -6.750
  247    HD2  LYS  36           2HD      LYS  36   1.974  -6.246  -8.248
  248    HD3  LYS  36           1HD      LYS  36   2.385  -7.044  -6.729
  249    HE2  LYS  36           2HE      LYS  36   1.255  -8.764  -7.665
  250    HE3  LYS  36           1HE      LYS  36  -0.136  -7.906  -7.008
  251    HZ1  LYS  36           3HZ      LYS  36   0.860  -7.424  -9.755
  252    HZ2  LYS  36           1HZ      LYS  36  -0.642  -6.998  -9.100
  253    HZ3  LYS  36           2HZ      LYS  36  -0.282  -8.622  -9.409
  254    H    GLU  37           H        GLU  37   4.076  -3.411  -8.035
  255    HA   GLU  37           HA       GLU  37   5.405  -5.877  -7.810
  256    HB2  GLU  37           2HB      GLU  37   5.404  -4.076  -9.720
  257    HB3  GLU  37           1HB      GLU  37   6.806  -3.447  -8.866
  258    HG2  GLU  37           2HG      GLU  37   8.023  -5.445  -9.198
  259    HG3  GLU  37           1HG      GLU  37   6.588  -6.314  -9.739
  260    H    ASP  38           H        ASP  38   6.057  -2.712  -6.359
  261    HA   ASP  38           HA       ASP  38   8.601  -3.184  -5.318
  262    HB2  ASP  38           2HB      ASP  38   6.340  -1.373  -4.604
  263    HB3  ASP  38           1HB      ASP  38   7.600  -1.596  -3.397
  264    H    LEU  39           H        LEU  39   5.418  -3.797  -3.851
  265    HA   LEU  39           HA       LEU  39   6.374  -4.839  -1.419
  266    HB2  LEU  39           2HB      LEU  39   3.802  -5.582  -2.804
  267    HB3  LEU  39           1HB      LEU  39   4.150  -5.711  -1.091
  268    HG   LEU  39           HG       LEU  39   4.267  -3.029  -2.407
  269   HD11  LEU  39          1HD1      LEU  39   1.869  -2.731  -1.842
  270   HD12  LEU  39          2HD1      LEU  39   1.766  -4.468  -1.551
  271   HD13  LEU  39          3HD1      LEU  39   2.158  -3.865  -3.161
  272   HD21  LEU  39          3HD2      LEU  39   3.280  -3.769   0.333
  273   HD22  LEU  39          1HD2      LEU  39   3.855  -2.206  -0.249
  274   HD23  LEU  39          2HD2      LEU  39   4.993  -3.533  -0.016
  275    H    GLU  40           H        GLU  40   5.592  -6.407  -4.505
  276    HA   GLU  40           HA       GLU  40   5.917  -9.072  -3.653
  277    HB2  GLU  40           2HB      GLU  40   6.082  -7.716  -6.323
  278    HB3  GLU  40           1HB      GLU  40   6.479  -9.420  -6.165
  279    HG2  GLU  40           2HG      GLU  40   4.216  -9.743  -5.125
  280    HG3  GLU  40           1HG      GLU  40   3.851  -8.084  -5.595
  281    H    ASN  41           H        ASN  41   8.247  -6.633  -4.623
  282    HA   ASN  41           HA       ASN  41  10.426  -8.540  -4.791
  283    HB2  ASN  41           2HB      ASN  41  10.085  -5.633  -5.328
  284    HB3  ASN  41           1HB      ASN  41  11.703  -6.199  -4.926
  285   HD21  ASN  41          1HD2      ASN  41   9.080  -6.390  -7.200
  286   HD22  ASN  41          2HD2      ASN  41   9.981  -7.115  -8.483
  287    H    GLY  42           H        GLY  42   9.265  -6.076  -2.541
  288    HA2  GLY  42           2HA      GLY  42   9.913  -6.926  -0.164
  289    HA3  GLY  42           1HA      GLY  42  11.535  -6.603  -0.757
  290    H    GLU  43           H        GLU  43  10.111  -4.288  -2.342
  291    HA   GLU  43           HA       GLU  43  10.808  -2.232  -0.522
  292    HB2  GLU  43           2HB      GLU  43   9.499  -2.290  -3.228
  293    HB3  GLU  43           1HB      GLU  43   9.599  -0.790  -2.318
  294    HG2  GLU  43           2HG      GLU  43  12.153  -1.532  -2.159
  295    HG3  GLU  43           1HG      GLU  43  11.722  -2.345  -3.665
  296    H    ASP  44           H        ASP  44   9.496  -2.801   1.286
  297    HA   ASP  44           HA       ASP  44   6.625  -2.287   1.044
  298    HB2  ASP  44           2HB      ASP  44   6.473  -3.234   3.317
  299    HB3  ASP  44           1HB      ASP  44   7.242  -4.344   2.193
  300    H    VAL  45           H        VAL  45   8.253  -0.085   0.693
  301    HA   VAL  45           HA       VAL  45   7.637   1.490   3.100
  302    HB   VAL  45           HB       VAL  45   9.748   2.850   1.902
  303   HG11  VAL  45          1HG1      VAL  45  11.002   2.118   3.948
  304   HG12  VAL  45          2HG1      VAL  45   9.624   1.084   4.329
  305   HG13  VAL  45          3HG1      VAL  45   9.418   2.835   4.243
  306   HG21  VAL  45          3HG2      VAL  45  10.653   0.007   2.249
  307   HG22  VAL  45          1HG2      VAL  45  11.545   1.371   1.578
  308   HG23  VAL  45          2HG2      VAL  45  10.202   0.668   0.677
  309    H    ALA  46           H        ALA  46   6.524   3.311   2.743
  310    HA   ALA  46           HA       ALA  46   6.205   4.184  -0.053
  311    HB1  ALA  46           1HB      ALA  46   4.162   5.076   1.855
  312    HB2  ALA  46           2HB      ALA  46   4.215   3.332   1.601
  313    HB3  ALA  46           3HB      ALA  46   3.988   4.415   0.229
  314    H    THR  47           H        THR  47   6.573   6.292  -0.560
  315    HA   THR  47           HA       THR  47   7.356   8.075   1.653
  316    HB   THR  47           HB       THR  47   8.468   8.122  -1.161
  317    HG1  THR  47           1HG      THR  47   9.376   6.353  -0.339
  318   HG21  THR  47          3HG2      THR  47   9.570   9.965  -0.626
  319   HG22  THR  47          1HG2      THR  47  10.146   9.251   0.880
  320   HG23  THR  47          2HG2      THR  47   8.584  10.066   0.832
  321    H    CYS  48           H        CYS  48   6.372   9.992   1.796
  322    HA   CYS  48           HA       CYS  48   4.312  10.626  -0.165
  323    HB2  CYS  48           2HB      CYS  48   3.783  10.627   2.267
  324    HB3  CYS  48           1HB      CYS  48   4.914  11.959   2.485
  325    HA   PRO  49           HA       PRO  49   7.157  13.443  -2.222
  326    HB2  PRO  49           2HB      PRO  49   4.589  14.420  -3.360
  327    HB3  PRO  49           1HB      PRO  49   6.075  13.939  -4.185
  328    HG2  PRO  49           2HG      PRO  49   3.950  12.345  -4.199
  329    HG3  PRO  49           1HG      PRO  49   5.583  11.674  -4.028
  330    HD2  PRO  49           2HD      PRO  49   3.476  12.098  -1.947
  331    HD3  PRO  49           1HD      PRO  49   4.623  10.754  -2.134
  332    H    SER  50           H        SER  50   4.413  14.323  -0.248
  333    HA   SER  50           HA       SER  50   4.968  17.155  -0.360
  334    HB2  SER  50           2HB      SER  50   3.013  15.485   1.216
  335    HB3  SER  50           1HB      SER  50   3.204  17.216   1.491
  336    HG   SER  50           HG       SER  50   2.753  17.467  -0.800
  337    H    CYS  51           H        CYS  51   4.661  15.069   2.535
  338    HA   CYS  51           HA       CYS  51   6.484  16.743   3.994
  339    HB2  CYS  51           2HB      CYS  51   6.137  15.140   5.844
  340    HB3  CYS  51           1HB      CYS  51   4.620  15.721   5.162
  341    H    SER  52           H        SER  52   6.781  13.812   2.153
  342    HA   SER  52           HA       SER  52   8.581  12.574   1.535
  343    HB2  SER  52           2HB      SER  52   9.627  15.061   1.762
  344    HB3  SER  52           1HB      SER  52  10.592  14.209   2.965
  345    HG   SER  52           HG       SER  52  11.210  12.741   1.364
  346    H    LEU  53           H        LEU  53   7.155  11.925   3.861
  347    HA   LEU  53           HA       LEU  53   9.126  11.080   5.836
  348    HB2  LEU  53           2HB      LEU  53   6.165  11.304   5.732
  349    HB3  LEU  53           1HB      LEU  53   6.829  10.057   6.770
  350    HG   LEU  53           HG       LEU  53   7.820  12.875   7.003
  351   HD11  LEU  53          1HD1      LEU  53   5.655  13.459   7.338
  352   HD12  LEU  53          2HD1      LEU  53   6.009  12.841   8.952
  353   HD13  LEU  53          3HD1      LEU  53   5.164  11.827   7.784
  354   HD21  LEU  53          3HD2      LEU  53   7.707  10.445   8.756
  355   HD22  LEU  53          1HD2      LEU  53   7.936  12.055   9.437
  356   HD23  LEU  53          2HD2      LEU  53   9.105  11.411   8.283
  357    H    ILE  54           H        ILE  54   8.530   8.740   6.752
  358    HA   ILE  54           HA       ILE  54   8.323   6.916   4.446
  359    HB   ILE  54           HB       ILE  54   9.906   5.397   5.720
  360   HG12  ILE  54          2HG1      ILE  54  10.655   7.955   7.151
  361   HG13  ILE  54          1HG1      ILE  54   9.693   6.674   7.884
  362   HG21  ILE  54          1HG2      ILE  54  11.657   6.163   4.498
  363   HG22  ILE  54          2HG2      ILE  54  11.437   7.834   5.015
  364   HG23  ILE  54          3HG2      ILE  54  10.386   7.149   3.775
  365   HD11  ILE  54          3HD1      ILE  54  12.577   6.821   7.376
  366   HD12  ILE  54          1HD1      ILE  54  11.827   5.264   7.025
  367   HD13  ILE  54          2HD1      ILE  54  11.681   5.970   8.634
  368    H    ILE  55           H        ILE  55   7.222   5.003   4.743
  369    HA   ILE  55           HA       ILE  55   6.123   4.409   7.393
  370    HB   ILE  55           HB       ILE  55   3.874   3.989   6.448
  371   HG12  ILE  55          2HG1      ILE  55   4.459   5.685   4.076
  372   HG13  ILE  55          1HG1      ILE  55   4.999   4.011   4.013
  373   HG21  ILE  55          1HG2      ILE  55   3.190   6.353   6.277
  374   HG22  ILE  55          2HG2      ILE  55   4.890   6.812   6.175
  375   HG23  ILE  55          3HG2      ILE  55   4.271   6.046   7.637
  376   HD11  ILE  55          3HD1      ILE  55   2.335   4.021   4.968
  377   HD12  ILE  55          1HD1      ILE  55   2.960   3.386   3.447
  378   HD13  ILE  55          2HD1      ILE  55   2.412   5.058   3.545
  379    H    LYS  56           H        LYS  56   5.209   2.227   7.548
  380    HA   LYS  56           HA       LYS  56   6.573   0.386   5.703
  381    HB2  LYS  56           2HB      LYS  56   6.759   0.489   8.411
  382    HB3  LYS  56           1HB      LYS  56   5.456  -0.675   8.221
  383    HG2  LYS  56           2HG      LYS  56   8.055  -0.953   6.749
  384    HG3  LYS  56           1HG      LYS  56   7.826  -1.574   8.386
  385    HD2  LYS  56           2HD      LYS  56   5.625  -2.566   7.150
  386    HD3  LYS  56           1HD      LYS  56   6.783  -2.568   5.818
  387    HE2  LYS  56           2HE      LYS  56   6.780  -4.693   7.058
  388    HE3  LYS  56           1HE      LYS  56   8.341  -3.878   7.129
  389    HZ1  LYS  56           3HZ      LYS  56   8.182  -3.587   9.335
  390    HZ2  LYS  56           1HZ      LYS  56   7.053  -4.846   9.265
  391    HZ3  LYS  56           2HZ      LYS  56   6.527  -3.240   9.296
  392    H    VAL  57           H        VAL  57   5.532  -1.048   4.537
  393    HA   VAL  57           HA       VAL  57   2.604  -1.119   4.780
  394    HB   VAL  57           HB       VAL  57   3.856  -2.129   2.290
  395   HG11  VAL  57          1HG1      VAL  57   1.950  -0.876   1.322
  396   HG12  VAL  57          2HG1      VAL  57   1.525  -0.342   2.948
  397   HG13  VAL  57          3HG1      VAL  57   1.459  -2.056   2.538
  398   HG21  VAL  57          3HG2      VAL  57   3.782   0.833   2.887
  399   HG22  VAL  57          1HG2      VAL  57   4.204   0.084   1.347
  400   HG23  VAL  57          2HG2      VAL  57   5.243  -0.142   2.752
  401    H    ILE  58           H        ILE  58   1.880  -2.899   5.745
  402    HA   ILE  58           HA       ILE  58   3.441  -5.364   5.629
  403    HB   ILE  58           HB       ILE  58   0.884  -4.895   7.164
  404   HG12  ILE  58          2HG1      ILE  58   2.582  -3.252   7.851
  405   HG13  ILE  58          1HG1      ILE  58   2.287  -4.435   9.121
  406   HG21  ILE  58          1HG2      ILE  58   2.210  -6.720   8.584
  407   HG22  ILE  58          2HG2      ILE  58   2.870  -7.085   6.991
  408   HG23  ILE  58          3HG2      ILE  58   1.128  -7.148   7.259
  409   HD11  ILE  58          3HD1      ILE  58   4.626  -4.030   9.001
  410   HD12  ILE  58          1HD1      ILE  58   4.642  -4.307   7.260
  411   HD13  ILE  58          2HD1      ILE  58   4.325  -5.646   8.363
  412    H    TYR  59           H        TYR  59   2.838  -7.172   4.557
  413    HA   TYR  59           HA       TYR  59   0.145  -7.462   3.501
  414    HB2  TYR  59           2HB      TYR  59   1.067  -7.862   1.169
  415    HB3  TYR  59           1HB      TYR  59   1.090  -6.186   1.712
  416    HD1  TYR  59           1HD      TYR  59   3.152  -9.138   0.976
  417    HD2  TYR  59           2HD      TYR  59   3.172  -5.042   2.126
  418    HE1  TYR  59           1HE      TYR  59   5.567  -9.031   0.534
  419    HE2  TYR  59           2HE      TYR  59   5.584  -4.923   1.684
  420    HH   TYR  59           HH       TYR  59   7.230  -6.863  -0.108
  421    H    ASP  60           H        ASP  60   0.172  -9.585   2.021
  422    HA   ASP  60           HA       ASP  60   1.293 -11.658   3.716
  423    HB2  ASP  60           2HB      ASP  60  -1.101 -11.603   2.696
  424    HB3  ASP  60           1HB      ASP  60  -0.316 -12.167   1.225
  425    H    LYS  61           H        LYS  61   3.445 -11.897   3.328
  426    HA   LYS  61           HA       LYS  61   4.701 -11.646   0.829
  427    HB2  LYS  61           2HB      LYS  61   5.519 -13.013   3.380
  428    HB3  LYS  61           1HB      LYS  61   6.544 -13.046   1.952
  429    HG2  LYS  61           2HG      LYS  61   5.573 -10.387   2.780
  430    HG3  LYS  61           1HG      LYS  61   6.710 -11.180   3.873
  431    HD2  LYS  61           2HD      LYS  61   7.901 -11.615   1.468
  432    HD3  LYS  61           1HD      LYS  61   7.135 -10.049   1.189
  433    HE2  LYS  61           2HE      LYS  61   8.454  -8.982   2.701
  434    HE3  LYS  61           1HE      LYS  61   8.590 -10.395   3.744
  435    HZ1  LYS  61           3HZ      LYS  61  10.194  -9.652   1.404
  436    HZ2  LYS  61           1HZ      LYS  61   9.981 -11.297   1.742
  437    HZ3  LYS  61           2HZ      LYS  61  10.689 -10.281   2.893
  438    H    ASP  62           H        ASP  62   3.118 -14.376   2.366
  439    HA   ASP  62           HA       ASP  62   4.147 -16.405   0.684
  440    HB2  ASP  62           2HB      ASP  62   1.614 -16.229   2.322
  441    HB3  ASP  62           1HB      ASP  62   2.053 -17.665   1.402
  442    H    GLN  63           H        GLN  63   1.435 -14.172   0.376
  443    HA   GLN  63           HA       GLN  63   0.417 -15.452  -2.006
  444    HB2  GLN  63           2HB      GLN  63  -0.261 -12.891  -0.572
  445    HB3  GLN  63           1HB      GLN  63  -0.998 -13.325  -2.109
  446    HG2  GLN  63           2HG      GLN  63  -1.387 -15.594  -0.657
  447    HG3  GLN  63           1HG      GLN  63  -1.503 -14.347   0.584
  448   HE21  GLN  63          1HE2      GLN  63  -2.945 -12.483   0.016
  449   HE22  GLN  63          2HE2      GLN  63  -4.419 -12.850  -0.805
  450    H    PHE  64           H        PHE  64   2.297 -12.541  -1.233
  451    HA   PHE  64           HA       PHE  64   2.449 -11.631  -3.935
  452    HB2  PHE  64           2HB      PHE  64   3.840 -10.882  -1.380
  453    HB3  PHE  64           1HB      PHE  64   4.422 -10.252  -2.917
  454    HD1  PHE  64           1HD      PHE  64   1.154 -10.660  -1.137
  455    HD2  PHE  64           2HD      PHE  64   3.662  -8.179  -3.520
  456    HE1  PHE  64           1HE      PHE  64  -0.530  -8.872  -1.042
  457    HE2  PHE  64           2HE      PHE  64   1.981  -6.387  -3.428
  458    HZ   PHE  64           HZ       PHE  64  -0.118  -6.730  -2.188
  459    H    VAL  65           H        VAL  65   5.199 -12.617  -1.863
  460    HA   VAL  65           HA       VAL  65   6.396 -13.869  -4.243
  461    HB   VAL  65           HB       VAL  65   7.651 -11.921  -3.525
  462   HG11  VAL  65          1HG1      VAL  65   6.957 -12.631  -0.964
  463   HG12  VAL  65          2HG1      VAL  65   8.114 -11.379  -1.411
  464   HG13  VAL  65          3HG1      VAL  65   8.679 -13.005  -1.028
  465   HG21  VAL  65          3HG2      VAL  65   9.026 -14.544  -2.969
  466   HG22  VAL  65          1HG2      VAL  65   9.870 -13.009  -3.165
  467   HG23  VAL  65          2HG2      VAL  65   8.941 -13.682  -4.505
  468    H    SER  66           H        SER  66   5.621 -15.935  -3.932
  469    HA   SER  66           HA       SER  66   5.924 -17.307  -1.417
  470    HB2  SER  66           2HB      SER  66   5.146 -19.303  -2.741
  471    HB3  SER  66           1HB      SER  66   4.050 -17.924  -2.808
  472    HG   SER  66           HG       SER  66   4.312 -17.909  -4.884
  473    H    GLY  67           H        GLY  67   8.156 -17.207  -0.973
  474    HA2  GLY  67           2HA      GLY  67  10.153 -18.047  -2.818
  475    HA3  GLY  67           1HA      GLY  67  10.369 -17.839  -1.086
  476    H    GLU  68           H        GLU  68  10.359 -19.596   0.235
  477    HA   GLU  68           HA       GLU  68  10.161 -22.213  -1.096
  478    HB2  GLU  68           2HB      GLU  68  11.819 -21.162   1.158
  479    HB3  GLU  68           1HB      GLU  68  11.431 -22.877   1.121
  480    HG2  GLU  68           2HG      GLU  68  12.818 -23.290  -0.590
  481    HG3  GLU  68           1HG      GLU  68  12.424 -21.782  -1.413
  482    H    THR  69           H        THR  69   7.852 -20.738  -0.134
  483    HA   THR  69           HA       THR  69   7.017 -22.001   2.321
  484    HB   THR  69           HB       THR  69   6.305 -19.705   1.791
  485    HG1  THR  69           1HG      THR  69   4.490 -20.060   2.786
  486   HG21  THR  69          3HG2      THR  69   5.807 -20.599  -0.759
  487   HG22  THR  69          1HG2      THR  69   5.318 -19.048  -0.078
  488   HG23  THR  69          2HG2      THR  69   4.196 -20.409  -0.067
  489    H    VAL  70           H        VAL  70   6.029 -23.884   2.496
  490    HA   VAL  70           HA       VAL  70   5.172 -25.274   0.068
  491    HB   VAL  70           HB       VAL  70   5.432 -26.413   2.855
  492   HG11  VAL  70          1HG1      VAL  70   4.063 -27.746   1.363
  493   HG12  VAL  70          2HG1      VAL  70   5.596 -28.558   1.676
  494   HG13  VAL  70          3HG1      VAL  70   5.335 -27.727   0.142
  495   HG21  VAL  70          3HG2      VAL  70   7.621 -27.304   2.085
  496   HG22  VAL  70          1HG2      VAL  70   7.591 -25.548   2.243
  497   HG23  VAL  70          2HG2      VAL  70   7.485 -26.292   0.647
  498    HA   PRO  71           HA       PRO  71   0.861 -24.558   0.802
  499    HB2  PRO  71           2HB      PRO  71   0.514 -27.342  -0.200
  500    HB3  PRO  71           1HB      PRO  71  -0.234 -25.844  -0.759
  501    HG2  PRO  71           2HG      PRO  71   1.701 -26.996  -2.169
  502    HG3  PRO  71           1HG      PRO  71   1.625 -25.231  -2.011
  503    HD2  PRO  71           2HD      PRO  71   3.413 -27.186  -0.624
  504    HD3  PRO  71           1HD      PRO  71   3.782 -25.563  -1.245
  505    H    ALA  72           H        ALA  72   1.093 -24.603   3.131
  506    HA   ALA  72           HA       ALA  72  -0.527 -26.523   4.403
  507    HB1  ALA  72           1HB      ALA  72   1.263 -27.473   5.927
  508    HB2  ALA  72           2HB      ALA  72   2.442 -26.865   4.765
  509    HB3  ALA  72           3HB      ALA  72   1.255 -28.071   4.268
  510    HA   PRO  73           HA       PRO  73  -0.696 -23.153   7.275
  511    HB2  PRO  73           2HB      PRO  73  -1.850 -24.351   9.398
  512    HB3  PRO  73           1HB      PRO  73  -2.734 -24.025   7.902
  513    HG2  PRO  73           2HG      PRO  73  -1.478 -26.575   8.843
  514    HG3  PRO  73           1HG      PRO  73  -3.061 -26.322   8.084
  515    HD2  PRO  73           2HD      PRO  73  -0.889 -27.208   6.711
  516    HD3  PRO  73           1HD      PRO  73  -2.170 -26.235   5.963
  517    H    SER  74           H        SER  74   0.680 -22.214   8.659
  518    HA   SER  74           HA       SER  74   1.942 -23.616  10.807
  519    HB2  SER  74           2HB      SER  74   3.422 -23.171   8.269
  520    HB3  SER  74           1HB      SER  74   4.289 -22.802   9.759
  521    HG   SER  74           HG       SER  74   3.403 -25.024  10.381
  522    H    ALA  75           H        ALA  75   2.429 -20.790   8.684
  523    HA   ALA  75           HA       ALA  75   3.451 -19.066  10.632
  524    HB1  ALA  75           1HB      ALA  75   3.789 -18.356   8.453
  525    HB2  ALA  75           2HB      ALA  75   2.544 -17.250   9.032
  526    HB3  ALA  75           3HB      ALA  75   2.105 -18.608   7.997
  527    H    ASN  76           H        ASN  76   0.089 -19.602   9.598
  528    HA   ASN  76           HA       ASN  76  -0.881 -18.674  12.146
  529    HB2  ASN  76           2HB      ASN  76  -2.347 -16.911  11.217
  530    HB3  ASN  76           1HB      ASN  76  -0.641 -16.528  11.009
  531   HD21  ASN  76          1HD2      ASN  76   0.293 -16.749   8.926
  532   HD22  ASN  76          2HD2      ASN  76  -0.692 -16.681   7.507
  533    H    LYS  77           H        LYS  77  -3.272 -18.897  12.323
  534    HA   LYS  77           HA       LYS  77  -4.531 -20.598  10.313
  535    HB2  LYS  77           2HB      LYS  77  -3.700 -21.488  13.025
  536    HB3  LYS  77           1HB      LYS  77  -5.288 -22.003  12.474
  537    HG2  LYS  77           2HG      LYS  77  -2.833 -22.405  10.799
  538    HG3  LYS  77           1HG      LYS  77  -3.315 -23.557  12.045
  539    HD2  LYS  77           2HD      LYS  77  -5.047 -22.673   9.735
  540    HD3  LYS  77           1HD      LYS  77  -4.128 -24.178   9.796
  541    HE2  LYS  77           2HE      LYS  77  -5.415 -24.654  11.962
  542    HE3  LYS  77           1HE      LYS  77  -6.491 -23.351  11.458
  543    HZ1  LYS  77           3HZ      LYS  77  -7.407 -25.393  10.707
  544    HZ2  LYS  77           1HZ      LYS  77  -5.945 -25.886  10.014
  545    HZ3  LYS  77           2HZ      LYS  77  -6.808 -24.596   9.341
  546    H    GLU  78           H        GLU  78  -5.810 -18.641  10.070
  547    HA   GLU  78           HA       GLU  78  -7.963 -18.522  12.064
  548    HB2  GLU  78           2HB      GLU  78  -6.154 -16.585  12.081
  549    HB3  GLU  78           1HB      GLU  78  -7.118 -15.983  10.740
  550    HG2  GLU  78           2HG      GLU  78  -8.854 -15.418  12.059
  551    HG3  GLU  78           1HG      GLU  78  -8.618 -16.785  13.146
  552    H    LEU  79           H        LEU  79  -9.435 -19.595  10.806
  553    HA   LEU  79           HA       LEU  79 -10.539 -18.082   8.586
  554    HB2  LEU  79           2HB      LEU  79 -10.526 -19.921   7.022
  555    HB3  LEU  79           1HB      LEU  79  -8.885 -19.552   7.515
  556    HG   LEU  79           HG       LEU  79 -10.332 -21.728   8.957
  557   HD11  LEU  79          1HD1      LEU  79  -8.903 -22.349   6.405
  558   HD12  LEU  79          2HD1      LEU  79 -10.616 -21.930   6.387
  559   HD13  LEU  79          3HD1      LEU  79 -10.061 -23.326   7.310
  560   HD21  LEU  79          3HD2      LEU  79  -8.212 -21.329   9.828
  561   HD22  LEU  79          1HD2      LEU  79  -7.502 -21.055   8.237
  562   HD23  LEU  79          2HD2      LEU  79  -7.951 -22.686   8.734
  563    H    VAL  80           H        VAL  80 -11.418 -18.793  11.292
  564    HA   VAL  80           HA       VAL  80 -13.728 -20.505  10.661
  565    HB   VAL  80           HB       VAL  80 -12.683 -19.842  13.417
  566   HG11  VAL  80          1HG1      VAL  80 -14.817 -20.536  13.810
  567   HG12  VAL  80          2HG1      VAL  80 -14.022 -22.108  13.749
  568   HG13  VAL  80          3HG1      VAL  80 -14.894 -21.506  12.339
  569   HG21  VAL  80          3HG2      VAL  80 -11.896 -21.955  11.481
  570   HG22  VAL  80          1HG2      VAL  80 -12.047 -22.413  13.178
  571   HG23  VAL  80          2HG2      VAL  80 -10.937 -21.127  12.706
  572    H    LYS  81           H        LYS  81 -15.505 -19.379  10.237
  573    HA   LYS  81           HA       LYS  81 -16.639 -17.567  12.088
  574    HB2  LYS  81           2HB      LYS  81 -16.648 -15.533  10.659
  575    HB3  LYS  81           1HB      LYS  81 -15.044 -15.967  11.233
  576    HG2  LYS  81           2HG      LYS  81 -15.087 -17.256   8.859
  577    HG3  LYS  81           1HG      LYS  81 -16.118 -15.869   8.502
  578    HD2  LYS  81           2HD      LYS  81 -14.419 -14.344   8.884
  579    HD3  LYS  81           1HD      LYS  81 -13.505 -15.462   9.897
  580    HE2  LYS  81           2HE      LYS  81 -13.252 -16.854   7.740
  581    HE3  LYS  81           1HE      LYS  81 -13.733 -15.376   6.908
  582    HZ1  LYS  81           3HZ      LYS  81 -11.846 -14.384   8.434
  583    HZ2  LYS  81           1HZ      LYS  81 -11.495 -15.094   6.938
  584    HZ3  LYS  81           2HZ      LYS  81 -11.270 -15.973   8.365
  585    H    LEU  82           H        LEU  82 -18.566 -18.585  11.938
  586    HA   LEU  82           HA       LEU  82 -19.698 -19.398   9.424
  587    HB2  LEU  82           2HB      LEU  82 -20.517 -19.542  12.284
  588    HB3  LEU  82           1HB      LEU  82 -21.772 -19.681  11.070
  589    HG   LEU  82           HG       LEU  82 -20.961 -21.872  11.843
  590   HD11  LEU  82          1HD1      LEU  82 -21.622 -21.186   9.348
  591   HD12  LEU  82          2HD1      LEU  82 -21.188 -22.832   9.811
  592   HD13  LEU  82          3HD1      LEU  82 -19.988 -21.783   9.054
  593   HD21  LEU  82          3HD2      LEU  82 -18.379 -21.434  10.413
  594   HD22  LEU  82          1HD2      LEU  82 -18.787 -22.601  11.669
  595   HD23  LEU  82          2HD2      LEU  82 -18.546 -20.905  12.086
  596    H    GLU  83           H        GLU  83 -21.669 -18.636   8.497
  597    HA   GLU  83           HA       GLU  83 -22.775 -16.123   9.434
  598    HB2  GLU  83           2HB      GLU  83 -20.682 -15.857   7.788
  599    HB3  GLU  83           1HB      GLU  83 -21.938 -16.080   6.579
  600    HG2  GLU  83           2HG      GLU  83 -23.093 -14.152   7.280
  601    HG3  GLU  83           1HG      GLU  83 -22.158 -14.037   8.769
  602    H    HIS  84           H        HIS  84 -24.600 -15.387   7.995
  603    HA   HIS  84           HA       HIS  84 -25.898 -17.638   6.613
  604    HB2  HIS  84           2HB      HIS  84 -26.933 -15.990   8.872
  605    HB3  HIS  84           1HB      HIS  84 -28.069 -16.453   7.608
  606    HD1  HIS  84           1HD      HIS  84 -25.686 -18.045  10.085
  607    HD2  HIS  84           2HD      HIS  84 -29.041 -18.993   7.823
  608    HE1  HIS  84           1HE      HIS  84 -26.383 -20.339  10.844
  609    HE2  HIS  84           2HE      HIS  84 -28.455 -20.864   9.511
  Start of MODEL    8
    1    H1   MET   1           1HT      MET   1  13.392   0.818   9.724
    2    H2   MET   1           2HT      MET   1  14.035   0.085  11.135
    3    H3   MET   1           3HT      MET   1  13.606  -0.881   9.785
    4    HA   MET   1           HA       MET   1  15.897  -0.716   9.757
    5    HB2  MET   1           2HB      MET   1  14.402   1.005   7.812
    6    HB3  MET   1           1HB      MET   1  16.155   0.913   7.704
    7    HG2  MET   1           2HG      MET   1  15.521  -0.736   6.251
    8    HG3  MET   1           1HG      MET   1  15.753  -1.655   7.739
    9    HE1  MET   1           2HE      MET   1  12.638  -2.731   5.280
   10    HE2  MET   1           3HE      MET   1  13.837  -3.646   6.195
   11    HE3  MET   1           1HE      MET   1  14.352  -2.350   5.115
   12    H    ALA   2           H        ALA   2  14.637   2.642   9.653
   13    HA   ALA   2           HA       ALA   2  16.938   3.433  11.311
   14    HB1  ALA   2           1HB      ALA   2  16.752   4.136   8.718
   15    HB2  ALA   2           2HB      ALA   2  17.547   5.119   9.945
   16    HB3  ALA   2           3HB      ALA   2  15.890   5.481   9.467
   17    H    VAL   3           H        VAL   3  14.028   5.118  10.069
   18    HA   VAL   3           HA       VAL   3  12.940   5.321  12.754
   19    HB   VAL   3           HB       VAL   3  12.673   7.836  12.521
   20   HG11  VAL   3          1HG1      VAL   3  14.360   6.537  13.971
   21   HG12  VAL   3          2HG1      VAL   3  14.624   8.261  13.712
   22   HG13  VAL   3          3HG1      VAL   3  15.558   7.079  12.796
   23   HG21  VAL   3          3HG2      VAL   3  15.113   7.946  10.864
   24   HG22  VAL   3          1HG2      VAL   3  13.732   9.039  10.929
   25   HG23  VAL   3          2HG2      VAL   3  13.619   7.531  10.024
   26    H    PHE   4           H        PHE   4  11.367   3.992  11.564
   27    HA   PHE   4           HA       PHE   4   9.841   5.083   9.419
   28    HB2  PHE   4           2HB      PHE   4   9.660   2.676  11.156
   29    HB3  PHE   4           1HB      PHE   4   8.187   3.194  10.351
   30    HD1  PHE   4           1HD      PHE   4  11.625   1.993   9.835
   31    HD2  PHE   4           2HD      PHE   4   7.891   2.912   8.013
   32    HE1  PHE   4           1HE      PHE   4  12.344   0.835   7.786
   33    HE2  PHE   4           2HE      PHE   4   8.602   1.757   5.963
   34    HZ   PHE   4           HZ       PHE   4  10.832   0.716   5.844
   35    H    HIS   5           H        HIS   5   7.476   5.460   9.526
   36    HA   HIS   5           HA       HIS   5   6.850   7.160  11.816
   37    HB2  HIS   5           2HB      HIS   5   6.563   7.809   9.313
   38    HB3  HIS   5           1HB      HIS   5   5.095   6.842   9.394
   39    HD1  HIS   5           1HD      HIS   5   3.185   8.386   9.595
   40    HD2  HIS   5           2HD      HIS   5   6.425   9.643  11.873
   41    HE1  HIS   5           1HE      HIS   5   2.399  10.447  10.801
   42    HE2  HIS   5           2HE      HIS   5   4.335  11.114  12.269
   43    H    ASP   6           H        ASP   6   4.984   4.830   9.839
   44    HA   ASP   6           HA       ASP   6   4.111   3.379  12.157
   45    HB2  ASP   6           2HB      ASP   6   2.348   5.413  10.880
   46    HB3  ASP   6           1HB      ASP   6   1.610   3.878  11.325
   47    H    GLU   7           H        GLU   7   3.513   1.322  11.623
   48    HA   GLU   7           HA       GLU   7   3.607   0.618   8.789
   49    HB2  GLU   7           2HB      GLU   7   3.391  -1.302  11.108
   50    HB3  GLU   7           1HB      GLU   7   3.945  -1.639   9.475
   51    HG2  GLU   7           2HG      GLU   7   6.012  -1.366  10.203
   52    HG3  GLU   7           1HG      GLU   7   5.655   0.348  10.410
   53    H    VAL   8           H        VAL   8   1.897  -0.115   7.634
   54    HA   VAL   8           HA       VAL   8  -0.594  -0.746   9.056
   55    HB   VAL   8           HB       VAL   8  -0.543   1.028   6.612
   56   HG11  VAL   8          1HG1      VAL   8  -2.850   1.272   6.895
   57   HG12  VAL   8          2HG1      VAL   8  -2.809   0.646   8.541
   58   HG13  VAL   8          3HG1      VAL   8  -2.568  -0.445   7.178
   59   HG21  VAL   8          3HG2      VAL   8  -0.637   1.727   9.531
   60   HG22  VAL   8          1HG2      VAL   8  -1.314   2.793   8.300
   61   HG23  VAL   8          2HG2      VAL   8   0.402   2.387   8.270
   62    H    GLU   9           H        GLU   9  -1.858  -2.293   8.121
   63    HA   GLU   9           HA       GLU   9  -0.639  -4.091   6.308
   64    HB2  GLU   9           2HB      GLU   9  -3.469  -3.898   7.345
   65    HB3  GLU   9           1HB      GLU   9  -2.905  -5.206   6.314
   66    HG2  GLU   9           2HG      GLU   9  -1.252  -5.828   8.006
   67    HG3  GLU   9           1HG      GLU   9  -1.820  -4.518   9.038
   68    H    ILE  10           H        ILE  10  -0.953  -4.470   4.173
   69    HA   ILE  10           HA       ILE  10  -1.575  -2.380   2.457
   70    HB   ILE  10           HB       ILE  10  -0.224  -4.369   1.849
   71   HG12  ILE  10          2HG1      ILE  10  -1.659  -4.667  -0.445
   72   HG13  ILE  10          1HG1      ILE  10  -2.346  -3.175   0.186
   73   HG21  ILE  10          1HG2      ILE  10  -2.906  -5.732   1.708
   74   HG22  ILE  10          2HG2      ILE  10  -1.545  -6.149   2.749
   75   HG23  ILE  10          3HG2      ILE  10  -1.424  -6.378   1.005
   76   HD11  ILE  10          3HD1      ILE  10  -0.140  -3.322  -1.357
   77   HD12  ILE  10          1HD1      ILE  10   0.576  -3.294   0.253
   78   HD13  ILE  10          2HD1      ILE  10  -0.504  -1.996  -0.255
   79    H    GLU  11           H        GLU  11  -3.701  -4.764   3.894
   80    HA   GLU  11           HA       GLU  11  -5.880  -4.597   2.144
   81    HB2  GLU  11           2HB      GLU  11  -7.258  -5.302   4.093
   82    HB3  GLU  11           1HB      GLU  11  -5.831  -6.298   3.845
   83    HG2  GLU  11           2HG      GLU  11  -4.952  -5.750   5.828
   84    HG3  GLU  11           1HG      GLU  11  -5.415  -4.057   5.679
   85    H    ASP  12           H        ASP  12  -4.790  -2.417   4.660
   86    HA   ASP  12           HA       ASP  12  -7.190  -0.851   4.742
   87    HB2  ASP  12           2HB      ASP  12  -5.091  -1.095   6.428
   88    HB3  ASP  12           1HB      ASP  12  -4.631   0.383   5.588
   89    H    PHE  13           H        PHE  13  -4.211  -0.791   2.903
   90    HA   PHE  13           HA       PHE  13  -4.353   1.839   1.901
   91    HB2  PHE  13           2HB      PHE  13  -2.983  -0.682   1.044
   92    HB3  PHE  13           1HB      PHE  13  -3.030   0.677  -0.071
   93    HD1  PHE  13           2HD      PHE  13  -2.351   0.175   3.580
   94    HD2  PHE  13           1HD      PHE  13  -1.143   1.953  -0.095
   95    HE1  PHE  13           2HE      PHE  13  -0.391   1.154   4.698
   96    HE2  PHE  13           1HE      PHE  13   0.818   2.931   1.018
   97    HZ   PHE  13           HZ       PHE  13   1.196   2.533   3.418
   98    H    GLN  14           H        GLN  14  -4.658   2.309  -0.499
   99    HA   GLN  14           HA       GLN  14  -7.208   1.127  -1.355
  100    HB2  GLN  14           2HB      GLN  14  -5.944   3.798  -1.647
  101    HB3  GLN  14           1HB      GLN  14  -6.926   3.240  -2.994
  102    HG2  GLN  14           2HG      GLN  14  -8.510   4.327  -1.790
  103    HG3  GLN  14           1HG      GLN  14  -8.659   2.719  -1.083
  104   HE21  GLN  14          1HE2      GLN  14  -9.662   4.131   0.622
  105   HE22  GLN  14          2HE2      GLN  14  -8.615   4.734   1.857
  106    H    TYR  15           H        TYR  15  -6.974  -0.495  -2.771
  107    HA   TYR  15           HA       TYR  15  -4.680  -0.897  -4.375
  108    HB2  TYR  15           2HB      TYR  15  -6.121  -2.760  -3.707
  109    HB3  TYR  15           1HB      TYR  15  -7.452  -2.087  -4.643
  110    HD1  TYR  15           1HD      TYR  15  -3.916  -3.212  -5.100
  111    HD2  TYR  15           2HD      TYR  15  -7.813  -2.904  -6.778
  112    HE1  TYR  15           1HE      TYR  15  -3.161  -4.479  -7.066
  113    HE2  TYR  15           2HE      TYR  15  -7.071  -4.171  -8.750
  114    HH   TYR  15           HH       TYR  15  -4.943  -6.024  -9.056
  115    H    ASP  16           H        ASP  16  -4.126  -0.087  -6.287
  116    HA   ASP  16           HA       ASP  16  -6.095   1.536  -7.736
  117    HB2  ASP  16           2HB      ASP  16  -3.665   2.304  -6.929
  118    HB3  ASP  16           1HB      ASP  16  -3.206   1.589  -8.471
  119    H    GLU  17           H        GLU  17  -7.163   0.117  -9.024
  120    HA   GLU  17           HA       GLU  17  -6.068  -2.090 -10.355
  121    HB2  GLU  17           2HB      GLU  17  -8.095  -1.768 -11.918
  122    HB3  GLU  17           1HB      GLU  17  -8.393  -2.112 -10.221
  123    HG2  GLU  17           2HG      GLU  17  -9.211  -0.018  -9.796
  124    HG3  GLU  17           1HG      GLU  17  -8.272   0.730 -11.085
  125    H    ASP  18           H        ASP  18  -6.018   1.287 -11.169
  126    HA   ASP  18           HA       ASP  18  -5.706   1.323 -13.890
  127    HB2  ASP  18           2HB      ASP  18  -5.636   3.248 -12.116
  128    HB3  ASP  18           1HB      ASP  18  -3.893   3.014 -12.205
  129    H    SER  19           H        SER  19  -3.077   0.859 -11.502
  130    HA   SER  19           HA       SER  19  -1.641  -0.774 -13.423
  131    HB2  SER  19           2HB      SER  19  -1.025   1.706 -13.793
  132    HB3  SER  19           1HB      SER  19  -0.160   1.579 -12.261
  133    HG   SER  19           HG       SER  19   1.379   0.915 -13.559
  134    H    GLU  20           H        GLU  20  -2.853  -1.284 -10.864
  135    HA   GLU  20           HA       GLU  20  -2.470  -2.275  -8.856
  136    HB2  GLU  20           2HB      GLU  20   0.160  -3.110 -10.074
  137    HB3  GLU  20           1HB      GLU  20  -0.731  -3.928  -8.800
  138    HG2  GLU  20           2HG      GLU  20  -2.075  -4.984 -10.246
  139    HG3  GLU  20           1HG      GLU  20  -2.229  -3.574 -11.293
  140    H    THR  21           H        THR  21  -2.290  -0.138  -7.862
  141    HA   THR  21           HA       THR  21   0.329   0.187  -6.579
  142    HB   THR  21           HB       THR  21  -1.294   2.525  -7.610
  143    HG1  THR  21           1HG      THR  21  -0.361   2.127  -9.431
  144   HG21  THR  21          3HG2      THR  21   0.081   3.106  -5.695
  145   HG22  THR  21          1HG2      THR  21   0.708   3.840  -7.170
  146   HG23  THR  21          2HG2      THR  21   1.496   2.416  -6.489
  147    H    TYR  22           H        TYR  22   0.250   1.142  -4.477
  148    HA   TYR  22           HA       TYR  22  -2.455   1.245  -3.303
  149    HB2  TYR  22           2HB      TYR  22   0.069   0.203  -1.999
  150    HB3  TYR  22           1HB      TYR  22  -1.507   0.327  -1.224
  151    HD1  TYR  22           1HD      TYR  22   0.443  -1.450  -3.793
  152    HD2  TYR  22           2HD      TYR  22  -3.227  -1.296  -1.642
  153    HE1  TYR  22           1HE      TYR  22  -0.122  -3.697  -4.607
  154    HE2  TYR  22           2HE      TYR  22  -3.800  -3.547  -2.451
  155    HH   TYR  22           HH       TYR  22  -2.409  -5.001  -4.990
  156    H    PHE  23           H        PHE  23  -2.919   2.913  -1.911
  157    HA   PHE  23           HA       PHE  23  -0.750   4.822  -1.334
  158    HB2  PHE  23           2HB      PHE  23  -3.548   5.592  -2.190
  159    HB3  PHE  23           1HB      PHE  23  -2.224   6.693  -1.827
  160    HD1  PHE  23           1HD      PHE  23  -3.214   3.956  -4.137
  161    HD2  PHE  23           2HD      PHE  23  -0.804   7.411  -3.522
  162    HE1  PHE  23           1HE      PHE  23  -2.528   3.892  -6.494
  163    HE2  PHE  23           2HE      PHE  23  -0.115   7.353  -5.882
  164    HZ   PHE  23           HZ       PHE  23  -0.977   5.592  -7.373
  165    H    TYR  24           H        TYR  24  -1.133   6.251   0.479
  166    HA   TYR  24           HA       TYR  24  -3.206   5.348   2.352
  167    HB2  TYR  24           2HB      TYR  24  -0.813   4.368   2.756
  168    HB3  TYR  24           1HB      TYR  24  -0.462   5.972   3.391
  169    HD1  TYR  24           2HD      TYR  24  -3.063   3.302   3.713
  170    HD2  TYR  24           1HD      TYR  24  -0.773   6.316   5.658
  171    HE1  TYR  24           2HE      TYR  24  -4.061   2.663   5.864
  172    HE2  TYR  24           1HE      TYR  24  -1.766   5.684   7.816
  173    HH   TYR  24           HH       TYR  24  -3.582   2.824   8.248
  174    HA   PRO  25           HA       PRO  25  -3.869   9.718   2.766
  175    HB2  PRO  25           2HB      PRO  25  -5.316   9.701   5.070
  176    HB3  PRO  25           1HB      PRO  25  -5.982   9.225   3.504
  177    HG2  PRO  25           2HG      PRO  25  -4.953   7.505   5.728
  178    HG3  PRO  25           1HG      PRO  25  -6.402   7.293   4.727
  179    HD2  PRO  25           2HD      PRO  25  -4.120   5.919   4.278
  180    HD3  PRO  25           1HD      PRO  25  -5.208   6.408   2.964
  181    H    CYS  26           H        CYS  26  -2.428  11.173   3.422
  182    HA   CYS  26           HA       CYS  26  -0.963  10.701   5.922
  183    HB2  CYS  26           2HB      CYS  26  -0.048  11.338   3.387
  184    HB3  CYS  26           1HB      CYS  26   0.015  12.877   4.241
  185    HA   PRO  27           HA       PRO  27  -3.065  14.066   7.884
  186    HB2  PRO  27           2HB      PRO  27  -1.181  14.767   9.722
  187    HB3  PRO  27           1HB      PRO  27  -2.204  13.335   9.876
  188    HG2  PRO  27           2HG      PRO  27   0.618  13.551   8.908
  189    HG3  PRO  27           1HG      PRO  27  -0.108  12.339   9.978
  190    HD2  PRO  27           2HD      PRO  27   0.353  11.862   7.359
  191    HD3  PRO  27           1HD      PRO  27  -1.030  11.156   8.225
  192    H    CYS  28           H        CYS  28   0.006  14.472   6.313
  193    HA   CYS  28           HA       CYS  28   0.269  17.278   6.728
  194    HB2  CYS  28           2HB      CYS  28   1.983  17.178   4.986
  195    HB3  CYS  28           1HB      CYS  28   2.188  15.859   6.132
  196    H    GLY  29           H        GLY  29  -1.385  15.291   4.354
  197    HA2  GLY  29           2HA      GLY  29  -3.367  16.734   3.485
  198    HA3  GLY  29           1HA      GLY  29  -2.066  17.663   2.758
  199    H    ASP  30           H        ASP  30  -0.372  15.509   2.052
  200    HA   ASP  30           HA       ASP  30  -1.742  14.586  -0.331
  201    HB2  ASP  30           2HB      ASP  30   1.057  14.853   0.580
  202    HB3  ASP  30           1HB      ASP  30   0.745  13.485  -0.482
  203    H    ASN  31           H        ASN  31  -0.651  12.178  -0.915
  204    HA   ASN  31           HA       ASN  31  -1.263  10.406   1.343
  205    HB2  ASN  31           2HB      ASN  31  -2.362   9.992  -1.446
  206    HB3  ASN  31           1HB      ASN  31  -2.669   8.989  -0.033
  207   HD21  ASN  31          1HD2      ASN  31  -3.182  12.186  -1.417
  208   HD22  ASN  31          2HD2      ASN  31  -4.620  12.539  -0.524
  209    H    PHE  32           H        PHE  32   0.072   8.703   1.530
  210    HA   PHE  32           HA       PHE  32   2.464   8.537   0.077
  211    HB2  PHE  32           2HB      PHE  32   1.058   6.755   2.026
  212    HB3  PHE  32           1HB      PHE  32   2.442   6.119   1.146
  213    HD1  PHE  32           2HD      PHE  32   4.613   7.498   1.246
  214    HD2  PHE  32           1HD      PHE  32   1.380   7.982   3.969
  215    HE1  PHE  32           2HE      PHE  32   6.139   8.542   2.866
  216    HE2  PHE  32           1HE      PHE  32   2.902   9.028   5.595
  217    HZ   PHE  32           HZ       PHE  32   5.286   9.309   5.044
  218    H    SER  33           H        SER  33   3.242   6.619  -1.176
  219    HA   SER  33           HA       SER  33   1.177   5.154  -2.620
  220    HB2  SER  33           2HB      SER  33   2.122   5.794  -4.829
  221    HB3  SER  33           1HB      SER  33   1.408   7.159  -3.971
  222    HG   SER  33           HG       SER  33   3.424   7.916  -3.497
  223    H    ILE  34           H        ILE  34   1.812   3.182  -3.341
  224    HA   ILE  34           HA       ILE  34   4.619   2.492  -3.553
  225    HB   ILE  34           HB       ILE  34   4.225   2.136  -1.169
  226   HG12  ILE  34          2HG1      ILE  34   4.242  -0.669  -2.118
  227   HG13  ILE  34          1HG1      ILE  34   5.427   0.399  -2.865
  228   HG21  ILE  34          1HG2      ILE  34   1.687   1.520  -1.800
  229   HG22  ILE  34          2HG2      ILE  34   2.445   1.084  -0.270
  230   HG23  ILE  34          3HG2      ILE  34   2.346  -0.100  -1.573
  231   HD11  ILE  34          3HD1      ILE  34   5.422   0.791  -0.031
  232   HD12  ILE  34          1HD1      ILE  34   6.729   0.263  -1.089
  233   HD13  ILE  34          2HD1      ILE  34   5.612  -0.921  -0.410
  234    H    THR  35           H        THR  35   4.854   1.203  -5.277
  235    HA   THR  35           HA       THR  35   2.586   0.169  -6.668
  236    HB   THR  35           HB       THR  35   4.203  -0.728  -8.269
  237    HG1  THR  35           1HG      THR  35   6.251   0.173  -6.532
  238   HG21  THR  35          3HG2      THR  35   3.775   1.872  -7.938
  239   HG22  THR  35          1HG2      THR  35   4.888   1.235  -9.147
  240   HG23  THR  35          2HG2      THR  35   5.508   1.839  -7.609
  241    H    LYS  36           H        LYS  36   2.043  -1.992  -7.115
  242    HA   LYS  36           HA       LYS  36   2.161  -3.756  -4.927
  243    HB2  LYS  36           2HB      LYS  36   0.469  -3.664  -6.882
  244    HB3  LYS  36           1HB      LYS  36   1.625  -4.669  -7.744
  245    HG2  LYS  36           2HG      LYS  36   0.729  -5.505  -5.029
  246    HG3  LYS  36           1HG      LYS  36  -0.347  -5.741  -6.407
  247    HD2  LYS  36           2HD      LYS  36   2.437  -6.599  -6.827
  248    HD3  LYS  36           1HD      LYS  36   1.543  -7.519  -5.617
  249    HE2  LYS  36           2HE      LYS  36   1.318  -8.553  -7.799
  250    HE3  LYS  36           1HE      LYS  36  -0.237  -7.923  -7.257
  251    HZ1  LYS  36           3HZ      LYS  36   0.464  -7.485  -9.659
  252    HZ2  LYS  36           1HZ      LYS  36   1.524  -6.331  -9.019
  253    HZ3  LYS  36           2HZ      LYS  36  -0.143  -6.179  -8.773
  254    H    GLU  37           H        GLU  37   4.090  -3.527  -7.872
  255    HA   GLU  37           HA       GLU  37   5.455  -5.971  -7.671
  256    HB2  GLU  37           2HB      GLU  37   5.408  -4.249  -9.604
  257    HB3  GLU  37           1HB      GLU  37   6.733  -3.471  -8.749
  258    HG2  GLU  37           2HG      GLU  37   8.162  -5.286  -9.065
  259    HG3  GLU  37           1HG      GLU  37   6.835  -6.380  -9.456
  260    H    ASP  38           H        ASP  38   6.108  -2.796  -6.245
  261    HA   ASP  38           HA       ASP  38   8.663  -3.252  -5.224
  262    HB2  ASP  38           2HB      ASP  38   6.404  -1.437  -4.534
  263    HB3  ASP  38           1HB      ASP  38   7.646  -1.655  -3.306
  264    H    LEU  39           H        LEU  39   5.496  -3.853  -3.726
  265    HA   LEU  39           HA       LEU  39   6.466  -4.856  -1.285
  266    HB2  LEU  39           2HB      LEU  39   3.891  -5.643  -2.639
  267    HB3  LEU  39           1HB      LEU  39   4.250  -5.717  -0.923
  268    HG   LEU  39           HG       LEU  39   4.302  -3.087  -2.361
  269   HD11  LEU  39          1HD1      LEU  39   2.169  -4.010  -2.953
  270   HD12  LEU  39          2HD1      LEU  39   1.939  -2.785  -1.705
  271   HD13  LEU  39          3HD1      LEU  39   1.872  -4.498  -1.284
  272   HD21  LEU  39          3HD2      LEU  39   5.145  -3.502   0.030
  273   HD22  LEU  39          1HD2      LEU  39   3.441  -3.661   0.453
  274   HD23  LEU  39          2HD2      LEU  39   4.040  -2.154  -0.242
  275    H    GLU  40           H        GLU  40   5.592  -6.511  -4.311
  276    HA   GLU  40           HA       GLU  40   5.957  -9.141  -3.399
  277    HB2  GLU  40           2HB      GLU  40   6.251  -7.957  -6.159
  278    HB3  GLU  40           1HB      GLU  40   6.303  -9.684  -5.829
  279    HG2  GLU  40           2HG      GLU  40   4.038  -9.609  -4.964
  280    HG3  GLU  40           1HG      GLU  40   3.981  -7.867  -5.224
  281    H    ASN  41           H        ASN  41   8.272  -6.716  -4.396
  282    HA   ASN  41           HA       ASN  41  10.448  -8.636  -4.556
  283    HB2  ASN  41           2HB      ASN  41  10.101  -5.747  -5.168
  284    HB3  ASN  41           1HB      ASN  41  11.717  -6.278  -4.711
  285   HD21  ASN  41          1HD2      ASN  41  10.772  -5.273  -7.259
  286   HD22  ASN  41          2HD2      ASN  41  11.095  -6.511  -8.421
  287    H    GLY  42           H        GLY  42   9.289  -6.110  -2.368
  288    HA2  GLY  42           2HA      GLY  42   9.926  -6.919   0.029
  289    HA3  GLY  42           1HA      GLY  42  11.549  -6.605  -0.565
  290    H    GLU  43           H        GLU  43  10.112  -4.323  -2.190
  291    HA   GLU  43           HA       GLU  43  10.825  -2.238  -0.407
  292    HB2  GLU  43           2HB      GLU  43   9.525  -2.333  -3.115
  293    HB3  GLU  43           1HB      GLU  43   9.639  -0.817  -2.231
  294    HG2  GLU  43           2HG      GLU  43  12.175  -1.548  -2.043
  295    HG3  GLU  43           1HG      GLU  43  11.760  -2.439  -3.509
  296    H    ASP  44           H        ASP  44   9.493  -2.757   1.409
  297    HA   ASP  44           HA       ASP  44   6.629  -2.219   1.140
  298    HB2  ASP  44           2HB      ASP  44   6.563  -2.963   3.561
  299    HB3  ASP  44           1HB      ASP  44   7.069  -4.190   2.405
  300    H    VAL  45           H        VAL  45   8.329  -0.028   0.735
  301    HA   VAL  45           HA       VAL  45   7.686   1.613   3.089
  302    HB   VAL  45           HB       VAL  45   9.770   2.969   1.898
  303   HG11  VAL  45          1HG1      VAL  45   9.557   2.919   4.224
  304   HG12  VAL  45          2HG1      VAL  45  11.077   2.087   3.896
  305   HG13  VAL  45          3HG1      VAL  45   9.626   1.159   4.278
  306   HG21  VAL  45          3HG2      VAL  45  10.207   0.830   0.592
  307   HG22  VAL  45          1HG2      VAL  45  10.699   0.122   2.132
  308   HG23  VAL  45          2HG2      VAL  45  11.569   1.512   1.483
  309    H    ALA  46           H        ALA  46   6.637   3.468   2.712
  310    HA   ALA  46           HA       ALA  46   6.233   4.254  -0.099
  311    HB1  ALA  46           1HB      ALA  46   4.279   5.301   1.800
  312    HB2  ALA  46           2HB      ALA  46   4.300   3.539   1.725
  313    HB3  ALA  46           3HB      ALA  46   4.035   4.482   0.258
  314    H    THR  47           H        THR  47   6.563   6.356  -0.679
  315    HA   THR  47           HA       THR  47   7.573   8.156   1.424
  316    HB   THR  47           HB       THR  47   8.432   8.283  -1.464
  317    HG1  THR  47           1HG      THR  47   9.166   6.314  -0.929
  318   HG21  THR  47          3HG2      THR  47   9.165  10.217  -0.454
  319   HG22  THR  47          1HG2      THR  47  10.547   9.141  -0.254
  320   HG23  THR  47          2HG2      THR  47   9.449   9.427   1.097
  321    H    CYS  48           H        CYS  48   6.668  10.116   1.600
  322    HA   CYS  48           HA       CYS  48   4.464  10.767  -0.190
  323    HB2  CYS  48           2HB      CYS  48   4.593  10.919   2.484
  324    HB3  CYS  48           1HB      CYS  48   5.152  12.542   2.095
  325    HA   PRO  49           HA       PRO  49   6.943  13.777  -2.332
  326    HB2  PRO  49           2HB      PRO  49   5.015  14.920  -3.814
  327    HB3  PRO  49           1HB      PRO  49   5.587  13.277  -4.127
  328    HG2  PRO  49           2HG      PRO  49   3.121  14.186  -2.703
  329    HG3  PRO  49           1HG      PRO  49   3.324  12.851  -3.849
  330    HD2  PRO  49           2HD      PRO  49   3.236  12.543  -1.123
  331    HD3  PRO  49           1HD      PRO  49   4.049  11.414  -2.225
  332    H    SER  50           H        SER  50   4.740  14.518   0.107
  333    HA   SER  50           HA       SER  50   5.214  17.407  -0.167
  334    HB2  SER  50           2HB      SER  50   2.818  16.198   0.132
  335    HB3  SER  50           1HB      SER  50   3.240  16.446   1.827
  336    HG   SER  50           HG       SER  50   2.851  18.490   1.584
  337    H    CYS  51           H        CYS  51   4.697  15.105   2.533
  338    HA   CYS  51           HA       CYS  51   6.376  16.683   4.262
  339    HB2  CYS  51           2HB      CYS  51   5.849  15.048   5.975
  340    HB3  CYS  51           1HB      CYS  51   4.382  15.512   5.119
  341    H    SER  52           H        SER  52   6.820  13.910   2.213
  342    HA   SER  52           HA       SER  52   8.653  12.689   1.659
  343    HB2  SER  52           2HB      SER  52  10.462  14.444   3.275
  344    HB3  SER  52           1HB      SER  52  10.731  13.720   1.691
  345    HG   SER  52           HG       SER  52   9.288  15.241   0.817
  346    H    LEU  53           H        LEU  53   7.151  11.894   3.886
  347    HA   LEU  53           HA       LEU  53   9.095  10.986   5.877
  348    HB2  LEU  53           2HB      LEU  53   6.108  11.137   5.758
  349    HB3  LEU  53           1HB      LEU  53   6.860  10.003   6.861
  350    HG   LEU  53           HG       LEU  53   7.641  12.898   6.903
  351   HD11  LEU  53          1HD1      LEU  53   5.872  12.743   8.932
  352   HD12  LEU  53          2HD1      LEU  53   5.082  11.708   7.742
  353   HD13  LEU  53          3HD1      LEU  53   5.484  13.375   7.333
  354   HD21  LEU  53          3HD2      LEU  53   7.726  12.075   9.436
  355   HD22  LEU  53          1HD2      LEU  53   9.072  11.843   8.318
  356   HD23  LEU  53          2HD2      LEU  53   7.955  10.517   8.641
  357    H    ILE  54           H        ILE  54   8.376   8.619   6.720
  358    HA   ILE  54           HA       ILE  54   8.138   6.880   4.354
  359    HB   ILE  54           HB       ILE  54   9.739   5.301   5.368
  360   HG12  ILE  54          2HG1      ILE  54  10.374   7.526   7.316
  361   HG13  ILE  54          1HG1      ILE  54   9.430   6.099   7.723
  362   HG21  ILE  54          1HG2      ILE  54  10.317   7.307   3.782
  363   HG22  ILE  54          2HG2      ILE  54  11.595   6.310   4.480
  364   HG23  ILE  54          3HG2      ILE  54  11.217   7.881   5.186
  365   HD11  ILE  54          3HD1      ILE  54  11.602   5.674   8.490
  366   HD12  ILE  54          1HD1      ILE  54  12.333   6.263   6.997
  367   HD13  ILE  54          2HD1      ILE  54  11.441   4.742   7.000
  368    H    ILE  55           H        ILE  55   7.003   4.976   4.609
  369    HA   ILE  55           HA       ILE  55   5.920   4.349   7.258
  370    HB   ILE  55           HB       ILE  55   3.657   3.982   6.290
  371   HG12  ILE  55          2HG1      ILE  55   4.360   5.764   3.998
  372   HG13  ILE  55          1HG1      ILE  55   4.744   4.052   3.870
  373   HG21  ILE  55          1HG2      ILE  55   4.727   6.797   6.164
  374   HG22  ILE  55          2HG2      ILE  55   4.084   5.969   7.582
  375   HG23  ILE  55          3HG2      ILE  55   3.019   6.365   6.233
  376   HD11  ILE  55          3HD1      ILE  55   2.147   4.038   4.767
  377   HD12  ILE  55          1HD1      ILE  55   2.676   3.810   3.100
  378   HD13  ILE  55          2HD1      ILE  55   2.192   5.409   3.658
  379    H    LYS  56           H        LYS  56   5.462   2.184   7.603
  380    HA   LYS  56           HA       LYS  56   6.586   0.365   5.620
  381    HB2  LYS  56           2HB      LYS  56   6.957   0.416   8.268
  382    HB3  LYS  56           1HB      LYS  56   5.553  -0.641   8.221
  383    HG2  LYS  56           2HG      LYS  56   8.100  -1.114   6.682
  384    HG3  LYS  56           1HG      LYS  56   7.712  -1.846   8.240
  385    HD2  LYS  56           2HD      LYS  56   5.509  -2.550   6.934
  386    HD3  LYS  56           1HD      LYS  56   6.583  -2.386   5.543
  387    HE2  LYS  56           2HE      LYS  56   8.207  -3.848   6.922
  388    HE3  LYS  56           1HE      LYS  56   6.780  -4.259   7.874
  389    HZ1  LYS  56           3HZ      LYS  56   5.948  -4.596   5.308
  390    HZ2  LYS  56           1HZ      LYS  56   6.456  -5.832   6.348
  391    HZ3  LYS  56           2HZ      LYS  56   7.547  -5.147   5.252
  392    H    VAL  57           H        VAL  57   5.522  -1.036   4.458
  393    HA   VAL  57           HA       VAL  57   2.608  -1.142   4.782
  394    HB   VAL  57           HB       VAL  57   3.806  -2.197   2.286
  395   HG11  VAL  57          1HG1      VAL  57   1.422  -2.131   2.558
  396   HG12  VAL  57          2HG1      VAL  57   1.877  -0.933   1.345
  397   HG13  VAL  57          3HG1      VAL  57   1.478  -0.422   2.986
  398   HG21  VAL  57          3HG2      VAL  57   3.739   0.775   2.822
  399   HG22  VAL  57          1HG2      VAL  57   4.134  -0.007   1.292
  400   HG23  VAL  57          2HG2      VAL  57   5.200  -0.200   2.681
  401    H    ILE  58           H        ILE  58   1.856  -2.929   5.715
  402    HA   ILE  58           HA       ILE  58   3.457  -5.376   5.659
  403    HB   ILE  58           HB       ILE  58   0.894  -4.902   7.181
  404   HG12  ILE  58          2HG1      ILE  58   2.626  -3.252   7.826
  405   HG13  ILE  58          1HG1      ILE  58   2.264  -4.381   9.126
  406   HG21  ILE  58          1HG2      ILE  58   2.921  -7.073   7.080
  407   HG22  ILE  58          2HG2      ILE  58   1.169  -7.166   7.250
  408   HG23  ILE  58          3HG2      ILE  58   2.164  -6.711   8.631
  409   HD11  ILE  58          3HD1      ILE  58   4.297  -5.485   8.893
  410   HD12  ILE  58          1HD1      ILE  58   4.705  -3.782   8.691
  411   HD13  ILE  58          2HD1      ILE  58   4.574  -4.830   7.279
  412    H    TYR  59           H        TYR  59   2.875  -7.205   4.615
  413    HA   TYR  59           HA       TYR  59   0.191  -7.566   3.578
  414    HB2  TYR  59           2HB      TYR  59   1.132  -7.926   1.222
  415    HB3  TYR  59           1HB      TYR  59   1.008  -6.257   1.772
  416    HD1  TYR  59           2HD      TYR  59   3.013  -5.001   2.393
  417    HD2  TYR  59           1HD      TYR  59   3.286  -8.946   0.830
  418    HE1  TYR  59           2HE      TYR  59   5.400  -4.661   1.971
  419    HE2  TYR  59           1HE      TYR  59   5.684  -8.622   0.409
  420    HH   TYR  59           HH       TYR  59   7.489  -7.271   0.928
  421    H    ASP  60           H        ASP  60   0.266  -9.658   2.073
  422    HA   ASP  60           HA       ASP  60   1.528 -11.705   3.703
  423    HB2  ASP  60           2HB      ASP  60  -0.915 -11.642   2.591
  424    HB3  ASP  60           1HB      ASP  60  -0.043 -12.447   1.289
  425    H    LYS  61           H        LYS  61   3.661 -11.853   3.236
  426    HA   LYS  61           HA       LYS  61   4.831 -11.508   0.710
  427    HB2  LYS  61           2HB      LYS  61   5.709 -12.703   3.293
  428    HB3  LYS  61           1HB      LYS  61   6.663 -13.061   1.860
  429    HG2  LYS  61           2HG      LYS  61   6.451 -10.406   1.588
  430    HG3  LYS  61           1HG      LYS  61   6.340 -10.531   3.344
  431    HD2  LYS  61           2HD      LYS  61   8.419 -12.208   2.816
  432    HD3  LYS  61           1HD      LYS  61   8.623 -10.997   1.550
  433    HE2  LYS  61           2HE      LYS  61   9.896 -10.333   3.481
  434    HE3  LYS  61           1HE      LYS  61   8.534  -9.231   3.286
  435    HZ1  LYS  61           3HZ      LYS  61   9.145 -10.314   5.601
  436    HZ2  LYS  61           1HZ      LYS  61   8.141 -11.549   5.022
  437    HZ3  LYS  61           2HZ      LYS  61   7.547  -9.972   5.170
  438    H    ASP  62           H        ASP  62   3.345 -14.310   2.203
  439    HA   ASP  62           HA       ASP  62   4.408 -16.288   0.484
  440    HB2  ASP  62           2HB      ASP  62   1.905 -16.172   2.161
  441    HB3  ASP  62           1HB      ASP  62   2.311 -17.580   1.186
  442    H    GLN  63           H        GLN  63   1.684 -14.087   0.202
  443    HA   GLN  63           HA       GLN  63   0.753 -15.356  -2.245
  444    HB2  GLN  63           2HB      GLN  63  -0.223 -12.985  -0.655
  445    HB3  GLN  63           1HB      GLN  63  -0.925 -13.448  -2.198
  446    HG2  GLN  63           2HG      GLN  63  -1.150 -15.786  -1.019
  447    HG3  GLN  63           1HG      GLN  63  -1.070 -14.804   0.442
  448   HE21  GLN  63          1HE2      GLN  63  -3.269 -16.392  -0.724
  449   HE22  GLN  63          2HE2      GLN  63  -4.590 -15.293  -0.890
  450    H    PHE  64           H        PHE  64   2.181 -12.258  -1.233
  451    HA   PHE  64           HA       PHE  64   2.263 -11.111  -3.822
  452    HB2  PHE  64           2HB      PHE  64   3.475 -10.487  -1.174
  453    HB3  PHE  64           1HB      PHE  64   4.215  -9.756  -2.594
  454    HD1  PHE  64           1HD      PHE  64   0.839 -10.268  -1.084
  455    HD2  PHE  64           2HD      PHE  64   3.427  -7.720  -3.303
  456    HE1  PHE  64           1HE      PHE  64  -0.890  -8.517  -1.083
  457    HE2  PHE  64           2HE      PHE  64   1.704  -5.966  -3.304
  458    HZ   PHE  64           HZ       PHE  64  -0.458  -6.361  -2.194
  459    H    VAL  65           H        VAL  65   4.879 -12.549  -1.851
  460    HA   VAL  65           HA       VAL  65   6.680 -12.574  -4.108
  461    HB   VAL  65           HB       VAL  65   7.092 -13.927  -1.438
  462   HG11  VAL  65          1HG1      VAL  65   9.314 -12.749  -3.002
  463   HG12  VAL  65          2HG1      VAL  65   8.580 -14.222  -3.637
  464   HG13  VAL  65          3HG1      VAL  65   9.266 -14.209  -2.013
  465   HG21  VAL  65          3HG2      VAL  65   6.845 -11.822  -0.634
  466   HG22  VAL  65          1HG2      VAL  65   7.198 -11.065  -2.186
  467   HG23  VAL  65          2HG2      VAL  65   8.514 -11.675  -1.183
  468    H    SER  66           H        SER  66   5.456 -13.891  -5.562
  469    HA   SER  66           HA       SER  66   5.125 -16.704  -4.834
  470    HB2  SER  66           2HB      SER  66   4.050 -16.727  -7.215
  471    HB3  SER  66           1HB      SER  66   3.179 -15.963  -5.886
  472    HG   SER  66           HG       SER  66   3.291 -14.153  -6.933
  473    H    GLY  67           H        GLY  67   7.291 -17.398  -4.852
  474    HA2  GLY  67           2HA      GLY  67   8.762 -17.147  -7.378
  475    HA3  GLY  67           1HA      GLY  67   9.434 -17.669  -5.842
  476    H    GLU  68           H        GLU  68   8.158 -19.761  -5.014
  477    HA   GLU  68           HA       GLU  68   8.445 -21.698  -7.191
  478    HB2  GLU  68           2HB      GLU  68   9.611 -21.736  -4.794
  479    HB3  GLU  68           1HB      GLU  68   8.124 -22.567  -4.358
  480    HG2  GLU  68           2HG      GLU  68   9.227 -24.405  -4.979
  481    HG3  GLU  68           1HG      GLU  68   8.827 -23.894  -6.619
  482    H    THR  69           H        THR  69   5.986 -20.019  -6.620
  483    HA   THR  69           HA       THR  69   4.078 -22.174  -6.929
  484    HB   THR  69           HB       THR  69   3.688 -20.139  -4.720
  485    HG1  THR  69           1HG      THR  69   4.572 -22.814  -4.672
  486   HG21  THR  69          3HG2      THR  69   1.955 -22.216  -5.889
  487   HG22  THR  69          1HG2      THR  69   1.541 -20.690  -5.110
  488   HG23  THR  69          2HG2      THR  69   1.976 -22.090  -4.130
  489    H    VAL  70           H        VAL  70   2.912 -21.621  -8.649
  490    HA   VAL  70           HA       VAL  70   2.031 -18.834  -8.924
  491    HB   VAL  70           HB       VAL  70   3.949 -19.137 -10.420
  492   HG11  VAL  70          1HG1      VAL  70   2.486 -20.996 -12.196
  493   HG12  VAL  70          2HG1      VAL  70   3.210 -21.678 -10.740
  494   HG13  VAL  70          3HG1      VAL  70   4.218 -20.823 -11.907
  495   HG21  VAL  70          3HG2      VAL  70   2.806 -18.494 -12.557
  496   HG22  VAL  70          1HG2      VAL  70   2.310 -17.568 -11.141
  497   HG23  VAL  70          2HG2      VAL  70   1.270 -18.847 -11.766
  498    HA   PRO  71           HA       PRO  71  -1.892 -20.833  -9.566
  499    HB2  PRO  71           2HB      PRO  71  -3.344 -18.661 -10.232
  500    HB3  PRO  71           1HB      PRO  71  -2.764 -18.936  -8.584
  501    HG2  PRO  71           2HG      PRO  71  -1.644 -17.159 -10.716
  502    HG3  PRO  71           1HG      PRO  71  -1.849 -16.838  -8.985
  503    HD2  PRO  71           2HD      PRO  71   0.525 -17.572 -10.115
  504    HD3  PRO  71           1HD      PRO  71   0.093 -17.919  -8.430
  505    H    ALA  72           H        ALA  72  -3.602 -21.048 -11.255
  506    HA   ALA  72           HA       ALA  72  -2.962 -20.210 -13.942
  507    HB1  ALA  72           1HB      ALA  72  -2.469 -22.996 -13.016
  508    HB2  ALA  72           2HB      ALA  72  -1.556 -22.002 -14.150
  509    HB3  ALA  72           3HB      ALA  72  -3.077 -22.740 -14.652
  510    HA   PRO  73           HA       PRO  73  -7.328 -20.272 -14.566
  511    HB2  PRO  73           2HB      PRO  73  -6.763 -21.523 -17.207
  512    HB3  PRO  73           1HB      PRO  73  -7.659 -20.048 -16.827
  513    HG2  PRO  73           2HG      PRO  73  -5.210 -19.923 -17.860
  514    HG3  PRO  73           1HG      PRO  73  -5.734 -18.775 -16.615
  515    HD2  PRO  73           2HD      PRO  73  -3.943 -21.154 -16.370
  516    HD3  PRO  73           1HD      PRO  73  -3.844 -19.575 -15.563
  517    H    SER  74           H        SER  74  -8.956 -21.624 -14.053
  518    HA   SER  74           HA       SER  74  -8.859 -24.431 -14.822
  519    HB2  SER  74           2HB      SER  74  -9.292 -23.698 -11.920
  520    HB3  SER  74           1HB      SER  74  -9.085 -25.307 -12.611
  521    HG   SER  74           HG       SER  74  -7.198 -24.280 -11.542
  522    H    ALA  75           H        ALA  75 -10.652 -23.917 -16.133
  523    HA   ALA  75           HA       ALA  75 -13.150 -23.478 -14.631
  524    HB1  ALA  75           1HB      ALA  75 -12.428 -22.417 -17.359
  525    HB2  ALA  75           2HB      ALA  75 -12.698 -21.483 -15.887
  526    HB3  ALA  75           3HB      ALA  75 -14.040 -22.338 -16.649
  527    H    ASN  76           H        ASN  76 -15.064 -24.458 -15.523
  528    HA   ASN  76           HA       ASN  76 -16.267 -26.198 -16.349
  529    HB2  ASN  76           2HB      ASN  76 -15.000 -25.181 -18.500
  530    HB3  ASN  76           1HB      ASN  76 -14.336 -26.811 -18.518
  531   HD21  ASN  76          1HD2      ASN  76 -16.066 -28.556 -18.185
  532   HD22  ASN  76          2HD2      ASN  76 -17.514 -28.357 -19.107
  533    H    LYS  77           H        LYS  77 -13.983 -26.682 -14.458
  534    HA   LYS  77           HA       LYS  77 -14.160 -29.522 -14.417
  535    HB2  LYS  77           2HB      LYS  77 -11.770 -28.266 -15.620
  536    HB3  LYS  77           1HB      LYS  77 -11.441 -29.506 -14.418
  537    HG2  LYS  77           2HG      LYS  77 -13.290 -30.781 -15.887
  538    HG3  LYS  77           1HG      LYS  77 -12.580 -29.742 -17.124
  539    HD2  LYS  77           2HD      LYS  77 -11.084 -31.415 -17.318
  540    HD3  LYS  77           1HD      LYS  77 -10.346 -30.658 -15.905
  541    HE2  LYS  77           2HE      LYS  77 -12.142 -32.228 -14.680
  542    HE3  LYS  77           1HE      LYS  77 -11.869 -33.184 -16.136
  543    HZ1  LYS  77           3HZ      LYS  77 -10.254 -33.982 -14.743
  544    HZ2  LYS  77           1HZ      LYS  77  -9.988 -32.492 -13.988
  545    HZ3  LYS  77           2HZ      LYS  77  -9.385 -32.771 -15.544
  546    H    GLU  78           H        GLU  78 -15.026 -28.609 -12.367
  547    HA   GLU  78           HA       GLU  78 -12.915 -28.607 -10.353
  548    HB2  GLU  78           2HB      GLU  78 -14.917 -26.383 -10.716
  549    HB3  GLU  78           1HB      GLU  78 -14.121 -26.679  -9.178
  550    HG2  GLU  78           2HG      GLU  78 -12.002 -26.611 -10.885
  551    HG3  GLU  78           1HG      GLU  78 -13.098 -25.447 -11.625
  552    H    LEU  79           H        LEU  79 -13.689 -30.661  -9.794
  553    HA   LEU  79           HA       LEU  79 -16.175 -30.597  -8.231
  554    HB2  LEU  79           2HB      LEU  79 -16.664 -32.917  -8.983
  555    HB3  LEU  79           1HB      LEU  79 -16.800 -31.711 -10.248
  556    HG   LEU  79           HG       LEU  79 -14.249 -33.246  -9.966
  557   HD11  LEU  79          1HD1      LEU  79 -16.341 -34.342 -11.755
  558   HD12  LEU  79          2HD1      LEU  79 -16.481 -34.691 -10.031
  559   HD13  LEU  79          3HD1      LEU  79 -15.026 -35.159 -10.911
  560   HD21  LEU  79          3HD2      LEU  79 -15.650 -31.633 -12.017
  561   HD22  LEU  79          1HD2      LEU  79 -14.697 -33.003 -12.585
  562   HD23  LEU  79          2HD2      LEU  79 -13.933 -31.734 -11.629
  563    H    VAL  80           H        VAL  80 -13.443 -30.323  -7.364
  564    HA   VAL  80           HA       VAL  80 -12.904 -32.873  -6.026
  565    HB   VAL  80           HB       VAL  80 -11.055 -31.725  -7.234
  566   HG11  VAL  80          1HG1      VAL  80 -10.343 -29.636  -6.794
  567   HG12  VAL  80          2HG1      VAL  80 -10.648 -29.782  -5.062
  568   HG13  VAL  80          3HG1      VAL  80 -11.977 -29.432  -6.166
  569   HG21  VAL  80          3HG2      VAL  80 -10.898 -33.221  -5.062
  570   HG22  VAL  80          1HG2      VAL  80 -10.254 -31.734  -4.368
  571   HG23  VAL  80          2HG2      VAL  80  -9.465 -32.469  -5.764
  572    H    LYS  81           H        LYS  81 -15.088 -30.950  -5.296
  573    HA   LYS  81           HA       LYS  81 -14.346 -30.603  -2.469
  574    HB2  LYS  81           2HB      LYS  81 -15.605 -28.666  -4.352
  575    HB3  LYS  81           1HB      LYS  81 -16.183 -28.677  -2.693
  576    HG2  LYS  81           2HG      LYS  81 -14.533 -27.067  -2.649
  577    HG3  LYS  81           1HG      LYS  81 -13.690 -28.499  -2.056
  578    HD2  LYS  81           2HD      LYS  81 -13.245 -28.742  -4.707
  579    HD3  LYS  81           1HD      LYS  81 -13.337 -26.986  -4.566
  580    HE2  LYS  81           2HE      LYS  81 -11.568 -28.750  -2.876
  581    HE3  LYS  81           1HE      LYS  81 -11.036 -27.898  -4.324
  582    HZ1  LYS  81           3HZ      LYS  81 -11.583 -25.804  -3.256
  583    HZ2  LYS  81           1HZ      LYS  81 -10.485 -26.676  -2.310
  584    HZ3  LYS  81           2HZ      LYS  81 -12.117 -26.614  -1.870
  585    H    LEU  82           H        LEU  82 -15.696 -32.834  -3.796
  586    HA   LEU  82           HA       LEU  82 -18.303 -32.685  -2.427
  587    HB2  LEU  82           2HB      LEU  82 -18.073 -32.895  -5.086
  588    HB3  LEU  82           1HB      LEU  82 -17.923 -34.593  -4.679
  589    HG   LEU  82           HG       LEU  82 -20.110 -34.290  -3.365
  590   HD11  LEU  82          1HD1      LEU  82 -21.381 -32.432  -3.610
  591   HD12  LEU  82          2HD1      LEU  82 -20.758 -32.080  -5.221
  592   HD13  LEU  82          3HD1      LEU  82 -19.800 -31.677  -3.797
  593   HD21  LEU  82          3HD2      LEU  82 -21.362 -34.211  -5.710
  594   HD22  LEU  82          1HD2      LEU  82 -20.422 -35.609  -5.188
  595   HD23  LEU  82          2HD2      LEU  82 -19.715 -34.435  -6.299
  596    H    GLU  83           H        GLU  83 -15.754 -33.556  -1.329
  597    HA   GLU  83           HA       GLU  83 -15.934 -36.453  -1.160
  598    HB2  GLU  83           2HB      GLU  83 -13.757 -35.077  -1.271
  599    HB3  GLU  83           1HB      GLU  83 -14.059 -34.704   0.419
  600    HG2  GLU  83           2HG      GLU  83 -14.331 -37.420   0.375
  601    HG3  GLU  83           1HG      GLU  83 -13.062 -37.150  -0.818
  602    H    HIS  84           H        HIS  84 -15.919 -33.732   1.158
  603    HA   HIS  84           HA       HIS  84 -16.862 -33.456   3.204
  604    HB2  HIS  84           2HB      HIS  84 -18.868 -34.339   1.594
  605    HB3  HIS  84           1HB      HIS  84 -18.896 -35.572   2.849
  606    HD1  HIS  84           1HD      HIS  84 -19.946 -32.141   2.129
  607    HD2  HIS  84           2HD      HIS  84 -19.363 -34.494   5.503
  608    HE1  HIS  84           1HE      HIS  84 -21.140 -30.949   3.992
  609    HE2  HIS  84           2HE      HIS  84 -20.852 -32.440   6.004
  Start of MODEL    9
    1    H1   MET   1           1HT      MET   1  20.128   3.551   7.904
    2    H2   MET   1           2HT      MET   1  20.253   1.854   8.126
    3    H3   MET   1           3HT      MET   1  20.100   2.890   9.486
    4    HA   MET   1           HA       MET   1  18.074   2.542   7.372
    5    HB2  MET   1           2HB      MET   1  18.313   1.377  10.157
    6    HB3  MET   1           1HB      MET   1  16.832   1.347   9.210
    7    HG2  MET   1           2HG      MET   1  18.135   0.112   7.438
    8    HG3  MET   1           1HG      MET   1  19.428  -0.046   8.626
    9    HE1  MET   1           2HE      MET   1  17.932  -3.653   8.530
   10    HE2  MET   1           3HE      MET   1  19.439  -2.752   8.682
   11    HE3  MET   1           1HE      MET   1  18.412  -2.518   7.269
   12    H    ALA   2           H        ALA   2  16.058   3.566   7.864
   13    HA   ALA   2           HA       ALA   2  16.356   5.903   9.630
   14    HB1  ALA   2           1HB      ALA   2  15.902   6.852   7.610
   15    HB2  ALA   2           2HB      ALA   2  14.248   6.605   8.172
   16    HB3  ALA   2           3HB      ALA   2  14.975   5.465   7.038
   17    H    VAL   3           H        VAL   3  14.643   6.540  10.989
   18    HA   VAL   3           HA       VAL   3  13.198   4.361  12.157
   19    HB   VAL   3           HB       VAL   3  12.851   7.305  12.765
   20   HG11  VAL   3          1HG1      VAL   3  11.109   6.309  13.864
   21   HG12  VAL   3          2HG1      VAL   3  12.370   6.134  15.084
   22   HG13  VAL   3          3HG1      VAL   3  11.954   4.771  14.044
   23   HG21  VAL   3          3HG2      VAL   3  15.201   6.708  12.995
   24   HG22  VAL   3          1HG2      VAL   3  14.768   5.325  13.999
   25   HG23  VAL   3          2HG2      VAL   3  14.471   6.963  14.580
   26    H    PHE   4           H        PHE   4  11.481   3.533  11.144
   27    HA   PHE   4           HA       PHE   4   9.870   4.900   9.278
   28    HB2  PHE   4           2HB      PHE   4   9.768   2.275  10.666
   29    HB3  PHE   4           1HB      PHE   4   8.249   2.873  10.005
   30    HD1  PHE   4           1HD      PHE   4  11.662   1.785   9.184
   31    HD2  PHE   4           2HD      PHE   4   7.871   2.968   7.650
   32    HE1  PHE   4           1HE      PHE   4  12.305   0.955   6.957
   33    HE2  PHE   4           2HE      PHE   4   8.510   2.141   5.424
   34    HZ   PHE   4           HZ       PHE   4  10.729   1.133   5.075
   35    H    HIS   5           H        HIS   5   7.860   5.846   9.426
   36    HA   HIS   5           HA       HIS   5   7.200   7.087  11.895
   37    HB2  HIS   5           2HB      HIS   5   6.722   7.839   9.413
   38    HB3  HIS   5           1HB      HIS   5   5.232   6.929   9.631
   39    HD1  HIS   5           1HD      HIS   5   6.970   9.256  12.091
   40    HD2  HIS   5           2HD      HIS   5   3.391   8.883  10.012
   41    HE1  HIS   5           1HE      HIS   5   5.516  11.134  12.913
   42    HE2  HIS   5           2HE      HIS   5   3.330  10.848  11.692
   43    H    ASP   6           H        ASP   6   5.198   4.891   9.900
   44    HA   ASP   6           HA       ASP   6   4.474   3.318  12.211
   45    HB2  ASP   6           2HB      ASP   6   2.616   5.329  11.023
   46    HB3  ASP   6           1HB      ASP   6   1.939   3.773  11.484
   47    H    GLU   7           H        GLU   7   3.464   1.343  11.664
   48    HA   GLU   7           HA       GLU   7   3.687   0.644   8.820
   49    HB2  GLU   7           2HB      GLU   7   3.396  -1.291  11.119
   50    HB3  GLU   7           1HB      GLU   7   3.949  -1.628   9.485
   51    HG2  GLU   7           2HG      GLU   7   5.969  -1.581  10.461
   52    HG3  GLU   7           1HG      GLU   7   5.805   0.157  10.221
   53    H    VAL   8           H        VAL   8   1.960  -0.014   7.650
   54    HA   VAL   8           HA       VAL   8  -0.575  -0.506   9.063
   55    HB   VAL   8           HB       VAL   8  -0.399   1.115   6.518
   56   HG11  VAL   8          1HG1      VAL   8  -2.503  -0.221   7.153
   57   HG12  VAL   8          2HG1      VAL   8  -2.692   1.481   6.737
   58   HG13  VAL   8          3HG1      VAL   8  -2.709   0.981   8.426
   59   HG21  VAL   8          3HG2      VAL   8   0.649   2.372   8.322
   60   HG22  VAL   8          1HG2      VAL   8  -0.759   2.097   9.350
   61   HG23  VAL   8          2HG2      VAL   8  -0.907   3.082   7.894
   62    H    GLU   9           H        GLU   9  -1.891  -2.048   8.188
   63    HA   GLU   9           HA       GLU   9  -0.715  -3.999   6.504
   64    HB2  GLU   9           2HB      GLU   9  -3.604  -3.669   7.346
   65    HB3  GLU   9           1HB      GLU   9  -2.927  -5.103   6.587
   66    HG2  GLU   9           2HG      GLU   9  -1.675  -5.661   8.475
   67    HG3  GLU   9           1HG      GLU   9  -1.828  -4.045   9.165
   68    H    ILE  10           H        ILE  10  -1.012  -4.482   4.380
   69    HA   ILE  10           HA       ILE  10  -1.552  -2.453   2.553
   70    HB   ILE  10           HB       ILE  10  -0.226  -4.483   2.050
   71   HG12  ILE  10          2HG1      ILE  10  -1.229  -4.848  -0.276
   72   HG13  ILE  10          1HG1      ILE  10  -2.497  -3.729   0.215
   73   HG21  ILE  10          1HG2      ILE  10  -1.663  -6.158   3.065
   74   HG22  ILE  10          2HG2      ILE  10  -1.358  -6.543   1.372
   75   HG23  ILE  10          3HG2      ILE  10  -2.906  -5.849   1.853
   76   HD11  ILE  10          3HD1      ILE  10  -0.311  -2.951  -1.066
   77   HD12  ILE  10          1HD1      ILE  10   0.299  -2.843   0.584
   78   HD13  ILE  10          2HD1      ILE  10  -1.133  -1.929   0.113
   79    H    GLU  11           H        GLU  11  -3.739  -4.757   4.043
   80    HA   GLU  11           HA       GLU  11  -5.901  -4.596   2.269
   81    HB2  GLU  11           2HB      GLU  11  -5.663  -5.186   5.201
   82    HB3  GLU  11           1HB      GLU  11  -7.253  -5.031   4.463
   83    HG2  GLU  11           2HG      GLU  11  -6.931  -6.892   3.094
   84    HG3  GLU  11           1HG      GLU  11  -5.184  -6.875   3.328
   85    H    ASP  12           H        ASP  12  -4.836  -2.416   4.820
   86    HA   ASP  12           HA       ASP  12  -7.194  -0.795   4.822
   87    HB2  ASP  12           2HB      ASP  12  -5.243  -1.049   6.602
   88    HB3  ASP  12           1HB      ASP  12  -4.556   0.297   5.699
   89    H    PHE  13           H        PHE  13  -4.199  -0.815   3.004
   90    HA   PHE  13           HA       PHE  13  -4.252   1.810   1.986
   91    HB2  PHE  13           2HB      PHE  13  -2.934  -0.750   1.214
   92    HB3  PHE  13           1HB      PHE  13  -3.016   0.511  -0.007
   93    HD1  PHE  13           2HD      PHE  13  -2.140   0.182   3.616
   94    HD2  PHE  13           1HD      PHE  13  -1.219   1.910  -0.164
   95    HE1  PHE  13           2HE      PHE  13  -0.147   1.247   4.589
   96    HE2  PHE  13           1HE      PHE  13   0.776   2.972   0.802
   97    HZ   PHE  13           HZ       PHE  13   1.314   2.642   3.182
   98    H    GLN  14           H        GLN  14  -4.627   2.374  -0.338
   99    HA   GLN  14           HA       GLN  14  -7.174   1.218  -1.219
  100    HB2  GLN  14           2HB      GLN  14  -6.497   3.822  -0.883
  101    HB3  GLN  14           1HB      GLN  14  -6.099   3.619  -2.583
  102    HG2  GLN  14           2HG      GLN  14  -8.771   3.102  -1.296
  103    HG3  GLN  14           1HG      GLN  14  -8.348   4.456  -2.339
  104   HE21  GLN  14          1HE2      GLN  14  -9.407   1.216  -2.191
  105   HE22  GLN  14          2HE2      GLN  14  -9.494   0.923  -3.892
  106    H    TYR  15           H        TYR  15  -6.976  -0.380  -2.668
  107    HA   TYR  15           HA       TYR  15  -4.680  -0.774  -4.282
  108    HB2  TYR  15           2HB      TYR  15  -6.127  -2.646  -3.629
  109    HB3  TYR  15           1HB      TYR  15  -7.451  -1.968  -4.572
  110    HD1  TYR  15           1HD      TYR  15  -3.901  -3.065  -5.009
  111    HD2  TYR  15           2HD      TYR  15  -7.784  -2.769  -6.724
  112    HE1  TYR  15           1HE      TYR  15  -3.114  -4.294  -6.984
  113    HE2  TYR  15           2HE      TYR  15  -7.008  -4.002  -8.704
  114    HH   TYR  15           HH       TYR  15  -4.158  -5.734  -8.804
  115    H    ASP  16           H        ASP  16  -4.113   0.234  -6.076
  116    HA   ASP  16           HA       ASP  16  -6.134   1.751  -7.568
  117    HB2  ASP  16           2HB      ASP  16  -3.838   2.697  -6.602
  118    HB3  ASP  16           1HB      ASP  16  -3.211   2.040  -8.110
  119    H    GLU  17           H        GLU  17  -6.980  -0.043  -8.703
  120    HA   GLU  17           HA       GLU  17  -5.541  -1.914 -10.177
  121    HB2  GLU  17           2HB      GLU  17  -7.644  -2.062 -11.602
  122    HB3  GLU  17           1HB      GLU  17  -7.842  -2.335  -9.877
  123    HG2  GLU  17           2HG      GLU  17  -8.855  -0.245  -9.549
  124    HG3  GLU  17           1HG      GLU  17  -8.322   0.353 -11.122
  125    H    ASP  18           H        ASP  18  -6.304   1.410 -10.951
  126    HA   ASP  18           HA       ASP  18  -6.084   1.534 -13.674
  127    HB2  ASP  18           2HB      ASP  18  -4.859   3.496 -11.719
  128    HB3  ASP  18           1HB      ASP  18  -5.194   3.809 -13.416
  129    H    SER  19           H        SER  19  -3.396   1.316 -11.343
  130    HA   SER  19           HA       SER  19  -1.686   0.327 -13.480
  131    HB2  SER  19           2HB      SER  19  -1.553   2.979 -12.978
  132    HB3  SER  19           1HB      SER  19  -0.371   2.391 -11.809
  133    HG   SER  19           HG       SER  19   0.560   2.844 -13.861
  134    H    GLU  20           H        GLU  20  -2.886  -0.787 -11.009
  135    HA   GLU  20           HA       GLU  20  -2.362  -2.043  -9.179
  136    HB2  GLU  20           2HB      GLU  20   0.205  -2.567 -10.679
  137    HB3  GLU  20           1HB      GLU  20  -0.575  -3.619  -9.506
  138    HG2  GLU  20           2HG      GLU  20  -2.509  -3.800 -11.080
  139    HG3  GLU  20           1HG      GLU  20  -1.544  -2.922 -12.265
  140    H    THR  21           H        THR  21  -2.123   0.171  -8.096
  141    HA   THR  21           HA       THR  21   0.462   0.206  -6.702
  142    HB   THR  21           HB       THR  21  -0.936   2.722  -7.646
  143    HG1  THR  21           1HG      THR  21   1.224   1.278  -8.759
  144   HG21  THR  21          3HG2      THR  21   1.095   3.878  -7.056
  145   HG22  THR  21          1HG2      THR  21   1.831   2.367  -6.517
  146   HG23  THR  21          2HG2      THR  21   0.451   3.036  -5.648
  147    H    TYR  22           H        TYR  22   0.364   1.134  -4.554
  148    HA   TYR  22           HA       TYR  22  -2.382   1.264  -3.475
  149    HB2  TYR  22           2HB      TYR  22   0.100   0.226  -2.090
  150    HB3  TYR  22           1HB      TYR  22  -1.494   0.363  -1.358
  151    HD1  TYR  22           1HD      TYR  22   0.433  -1.379  -3.997
  152    HD2  TYR  22           2HD      TYR  22  -3.120  -1.328  -1.656
  153    HE1  TYR  22           1HE      TYR  22  -0.111  -3.641  -4.783
  154    HE2  TYR  22           2HE      TYR  22  -3.673  -3.592  -2.436
  155    HH   TYR  22           HH       TYR  22  -1.977  -5.658  -3.413
  156    H    PHE  23           H        PHE  23  -2.898   2.933  -2.107
  157    HA   PHE  23           HA       PHE  23  -0.754   4.856  -1.475
  158    HB2  PHE  23           2HB      PHE  23  -3.551   5.585  -2.379
  159    HB3  PHE  23           1HB      PHE  23  -2.259   6.709  -1.975
  160    HD1  PHE  23           2HD      PHE  23  -2.995   3.882  -4.295
  161    HD2  PHE  23           1HD      PHE  23  -0.955   7.567  -3.676
  162    HE1  PHE  23           2HE      PHE  23  -2.250   3.859  -6.636
  163    HE2  PHE  23           1HE      PHE  23  -0.209   7.549  -6.021
  164    HZ   PHE  23           HZ       PHE  23  -0.855   5.693  -7.503
  165    H    TYR  24           H        TYR  24  -1.167   6.260   0.349
  166    HA   TYR  24           HA       TYR  24  -3.259   5.338   2.191
  167    HB2  TYR  24           2HB      TYR  24  -0.997   4.246   2.661
  168    HB3  TYR  24           1HB      TYR  24  -0.439   5.846   3.134
  169    HD1  TYR  24           2HD      TYR  24  -2.976   3.247   3.906
  170    HD2  TYR  24           1HD      TYR  24  -0.867   6.673   5.292
  171    HE1  TYR  24           2HE      TYR  24  -3.890   2.893   6.158
  172    HE2  TYR  24           1HE      TYR  24  -1.774   6.326   7.550
  173    HH   TYR  24           HH       TYR  24  -4.356   4.442   8.227
  174    HA   PRO  25           HA       PRO  25  -3.873   9.713   2.649
  175    HB2  PRO  25           2HB      PRO  25  -5.335   9.683   4.949
  176    HB3  PRO  25           1HB      PRO  25  -5.998   9.260   3.367
  177    HG2  PRO  25           2HG      PRO  25  -5.024   7.463   5.556
  178    HG3  PRO  25           1HG      PRO  25  -6.471   7.309   4.541
  179    HD2  PRO  25           2HD      PRO  25  -4.227   5.889   4.068
  180    HD3  PRO  25           1HD      PRO  25  -5.281   6.453   2.754
  181    H    CYS  26           H        CYS  26  -2.400  11.133   3.328
  182    HA   CYS  26           HA       CYS  26  -0.899  10.578   5.780
  183    HB2  CYS  26           2HB      CYS  26  -0.083  11.435   3.275
  184    HB3  CYS  26           1HB      CYS  26  -0.054  12.910   4.238
  185    HA   PRO  27           HA       PRO  27  -3.053  13.703   8.052
  186    HB2  PRO  27           2HB      PRO  27  -1.126  14.358   9.865
  187    HB3  PRO  27           1HB      PRO  27  -2.084  12.875   9.954
  188    HG2  PRO  27           2HG      PRO  27   0.687  13.280   8.896
  189    HG3  PRO  27           1HG      PRO  27   0.054  11.967   9.905
  190    HD2  PRO  27           2HD      PRO  27   0.424  11.691   7.245
  191    HD3  PRO  27           1HD      PRO  27  -0.893  10.871   8.110
  192    H    CYS  28           H        CYS  28  -0.076  14.362   6.386
  193    HA   CYS  28           HA       CYS  28   0.024  17.161   6.979
  194    HB2  CYS  28           2HB      CYS  28   1.761  17.262   5.255
  195    HB3  CYS  28           1HB      CYS  28   2.046  15.911   6.347
  196    H    GLY  29           H        GLY  29  -1.270  15.203   4.321
  197    HA2  GLY  29           2HA      GLY  29  -3.399  16.646   3.579
  198    HA3  GLY  29           1HA      GLY  29  -2.099  17.561   2.833
  199    H    ASP  30           H        ASP  30  -0.407  15.602   1.959
  200    HA   ASP  30           HA       ASP  30  -1.845  14.575  -0.325
  201    HB2  ASP  30           2HB      ASP  30   0.677  15.507   0.002
  202    HB3  ASP  30           1HB      ASP  30   0.978  13.778   0.126
  203    H    ASN  31           H        ASN  31  -0.759  12.199  -0.967
  204    HA   ASN  31           HA       ASN  31  -1.227  10.428   1.334
  205    HB2  ASN  31           2HB      ASN  31  -2.327   9.936  -1.443
  206    HB3  ASN  31           1HB      ASN  31  -2.571   8.930  -0.022
  207   HD21  ASN  31          1HD2      ASN  31  -4.307  10.648  -1.918
  208   HD22  ASN  31          2HD2      ASN  31  -5.351  11.486  -0.827
  209    H    PHE  32           H        PHE  32   0.023   8.616   1.438
  210    HA   PHE  32           HA       PHE  32   2.481   8.553   0.040
  211    HB2  PHE  32           2HB      PHE  32   1.065   6.689   1.919
  212    HB3  PHE  32           1HB      PHE  32   2.501   6.131   1.072
  213    HD1  PHE  32           1HD      PHE  32   4.616   7.573   1.298
  214    HD2  PHE  32           2HD      PHE  32   1.269   7.872   3.906
  215    HE1  PHE  32           1HE      PHE  32   6.046   8.608   3.008
  216    HE2  PHE  32           2HE      PHE  32   2.694   8.913   5.622
  217    HZ   PHE  32           HZ       PHE  32   5.086   9.282   5.172
  218    H    SER  33           H        SER  33   3.277   6.574  -1.180
  219    HA   SER  33           HA       SER  33   1.234   5.147  -2.681
  220    HB2  SER  33           2HB      SER  33   2.607   5.820  -4.837
  221    HB3  SER  33           1HB      SER  33   1.319   6.858  -4.228
  222    HG   SER  33           HG       SER  33   4.115   7.161  -3.879
  223    H    ILE  34           H        ILE  34   1.875   3.184  -3.415
  224    HA   ILE  34           HA       ILE  34   4.684   2.484  -3.581
  225    HB   ILE  34           HB       ILE  34   4.244   2.084  -1.211
  226   HG12  ILE  34          2HG1      ILE  34   4.293  -0.630  -2.507
  227   HG13  ILE  34          1HG1      ILE  34   5.630   0.495  -2.719
  228   HG21  ILE  34          1HG2      ILE  34   1.706   1.495  -1.888
  229   HG22  ILE  34          2HG2      ILE  34   2.442   1.029  -0.355
  230   HG23  ILE  34          3HG2      ILE  34   2.354  -0.131  -1.681
  231   HD11  ILE  34          3HD1      ILE  34   6.402   0.150  -0.651
  232   HD12  ILE  34          1HD1      ILE  34   5.443  -1.326  -0.734
  233   HD13  ILE  34          2HD1      ILE  34   4.787   0.107   0.057
  234    H    THR  35           H        THR  35   4.958   1.206  -5.296
  235    HA   THR  35           HA       THR  35   2.724   0.215  -6.775
  236    HB   THR  35           HB       THR  35   4.458  -0.738  -8.289
  237    HG1  THR  35           1HG      THR  35   6.612  -0.433  -7.800
  238   HG21  THR  35          3HG2      THR  35   5.308   1.275  -9.133
  239   HG22  THR  35          1HG2      THR  35   5.263   2.055  -7.551
  240   HG23  THR  35          2HG2      THR  35   3.760   1.694  -8.400
  241    H    LYS  36           H        LYS  36   2.203  -1.950  -7.292
  242    HA   LYS  36           HA       LYS  36   2.203  -3.760  -5.149
  243    HB2  LYS  36           2HB      LYS  36   0.538  -3.823  -6.960
  244    HB3  LYS  36           1HB      LYS  36   1.782  -4.330  -8.092
  245    HG2  LYS  36           2HG      LYS  36   0.962  -6.374  -7.634
  246    HG3  LYS  36           1HG      LYS  36   2.052  -6.263  -6.251
  247    HD2  LYS  36           2HD      LYS  36   0.259  -5.559  -4.820
  248    HD3  LYS  36           1HD      LYS  36  -0.845  -5.434  -6.190
  249    HE2  LYS  36           2HE      LYS  36  -0.001  -8.015  -6.403
  250    HE3  LYS  36           1HE      LYS  36   0.011  -7.787  -4.655
  251    HZ1  LYS  36           3HZ      LYS  36  -2.353  -6.715  -5.311
  252    HZ2  LYS  36           1HZ      LYS  36  -2.144  -8.330  -4.847
  253    HZ3  LYS  36           2HZ      LYS  36  -2.227  -7.924  -6.487
  254    H    GLU  37           H        GLU  37   4.324  -3.495  -7.965
  255    HA   GLU  37           HA       GLU  37   5.720  -5.910  -7.674
  256    HB2  GLU  37           2HB      GLU  37   5.753  -4.141  -9.591
  257    HB3  GLU  37           1HB      GLU  37   7.056  -3.409  -8.665
  258    HG2  GLU  37           2HG      GLU  37   8.493  -5.164  -9.035
  259    HG3  GLU  37           1HG      GLU  37   7.188  -6.316  -9.318
  260    H    ASP  38           H        ASP  38   6.221  -2.735  -6.178
  261    HA   ASP  38           HA       ASP  38   8.728  -3.177  -5.018
  262    HB2  ASP  38           2HB      ASP  38   6.416  -1.385  -4.407
  263    HB3  ASP  38           1HB      ASP  38   7.647  -1.577  -3.166
  264    H    LEU  39           H        LEU  39   5.473  -3.790  -3.711
  265    HA   LEU  39           HA       LEU  39   6.320  -4.849  -1.235
  266    HB2  LEU  39           2HB      LEU  39   3.781  -5.553  -2.702
  267    HB3  LEU  39           1HB      LEU  39   4.068  -5.649  -0.975
  268    HG   LEU  39           HG       LEU  39   4.312  -2.983  -2.286
  269   HD11  LEU  39          1HD1      LEU  39   1.647  -4.145  -1.520
  270   HD12  LEU  39          2HD1      LEU  39   2.233  -4.049  -3.180
  271   HD13  LEU  39          3HD1      LEU  39   1.973  -2.575  -2.249
  272   HD21  LEU  39          3HD2      LEU  39   3.558  -2.181  -0.170
  273   HD22  LEU  39          1HD2      LEU  39   4.806  -3.391   0.128
  274   HD23  LEU  39          2HD2      LEU  39   3.106  -3.805   0.348
  275    H    GLU  40           H        GLU  40   5.707  -6.357  -4.385
  276    HA   GLU  40           HA       GLU  40   5.902  -9.044  -3.523
  277    HB2  GLU  40           2HB      GLU  40   6.439  -7.810  -6.226
  278    HB3  GLU  40           1HB      GLU  40   6.357  -9.540  -5.926
  279    HG2  GLU  40           2HG      GLU  40   4.050  -9.398  -5.331
  280    HG3  GLU  40           1HG      GLU  40   4.098  -7.636  -5.361
  281    H    ASN  41           H        ASN  41   8.332  -6.644  -4.303
  282    HA   ASN  41           HA       ASN  41  10.471  -8.618  -4.377
  283    HB2  ASN  41           2HB      ASN  41  10.217  -5.725  -5.013
  284    HB3  ASN  41           1HB      ASN  41  11.799  -6.293  -4.490
  285   HD21  ASN  41          1HD2      ASN  41  13.064  -6.678  -6.153
  286   HD22  ASN  41          2HD2      ASN  41  12.588  -7.392  -7.651
  287    H    GLY  42           H        GLY  42   9.283  -6.058  -2.241
  288    HA2  GLY  42           2HA      GLY  42   9.814  -6.883   0.181
  289    HA3  GLY  42           1HA      GLY  42  11.463  -6.590  -0.352
  290    H    GLU  43           H        GLU  43  10.131  -4.279  -2.030
  291    HA   GLU  43           HA       GLU  43  10.790  -2.203  -0.217
  292    HB2  GLU  43           2HB      GLU  43   9.520  -2.245  -2.949
  293    HB3  GLU  43           1HB      GLU  43   9.697  -0.746  -2.050
  294    HG2  GLU  43           2HG      GLU  43  11.920  -2.583  -2.909
  295    HG3  GLU  43           1HG      GLU  43  11.504  -1.029  -3.632
  296    H    ASP  44           H        ASP  44   9.419  -2.736   1.556
  297    HA   ASP  44           HA       ASP  44   6.554  -2.219   1.236
  298    HB2  ASP  44           2HB      ASP  44   6.538  -2.924   3.717
  299    HB3  ASP  44           1HB      ASP  44   6.874  -4.159   2.513
  300    H    VAL  45           H        VAL  45   8.282  -0.021   0.887
  301    HA   VAL  45           HA       VAL  45   7.562   1.606   3.228
  302    HB   VAL  45           HB       VAL  45   9.980   1.257   3.232
  303   HG11  VAL  45          1HG1      VAL  45   9.868   1.214   0.534
  304   HG12  VAL  45          2HG1      VAL  45  11.350   1.464   1.455
  305   HG13  VAL  45          3HG1      VAL  45  10.472   2.849   0.806
  306   HG21  VAL  45          3HG2      VAL  45   9.423   4.081   2.362
  307   HG22  VAL  45          1HG2      VAL  45  10.635   3.513   3.511
  308   HG23  VAL  45          2HG2      VAL  45   8.923   3.436   3.925
  309    H    ALA  46           H        ALA  46   6.542   3.471   2.837
  310    HA   ALA  46           HA       ALA  46   6.172   4.243   0.020
  311    HB1  ALA  46           1HB      ALA  46   4.224   3.541   1.809
  312    HB2  ALA  46           2HB      ALA  46   3.974   4.530   0.371
  313    HB3  ALA  46           3HB      ALA  46   4.226   5.301   1.936
  314    H    THR  47           H        THR  47   6.553   6.325  -0.579
  315    HA   THR  47           HA       THR  47   7.546   8.141   1.519
  316    HB   THR  47           HB       THR  47   8.413   8.211  -1.373
  317    HG1  THR  47           1HG      THR  47   9.550   6.777   0.792
  318   HG21  THR  47          3HG2      THR  47   9.303   9.556   1.119
  319   HG22  THR  47          1HG2      THR  47   9.164  10.186  -0.522
  320   HG23  THR  47          2HG2      THR  47  10.514   9.135  -0.092
  321    H    CYS  48           H        CYS  48   6.623  10.076   1.701
  322    HA   CYS  48           HA       CYS  48   4.502  10.783  -0.193
  323    HB2  CYS  48           2HB      CYS  48   3.995  10.614   2.260
  324    HB3  CYS  48           1HB      CYS  48   5.078  11.976   2.530
  325    HA   PRO  49           HA       PRO  49   7.453  13.717  -1.962
  326    HB2  PRO  49           2HB      PRO  49   4.954  14.679  -3.252
  327    HB3  PRO  49           1HB      PRO  49   6.505  14.250  -3.981
  328    HG2  PRO  49           2HG      PRO  49   4.418  12.621  -4.204
  329    HG3  PRO  49           1HG      PRO  49   6.047  11.971  -3.927
  330    HD2  PRO  49           2HD      PRO  49   3.786  12.313  -1.994
  331    HD3  PRO  49           1HD      PRO  49   4.949  10.977  -2.144
  332    H    SER  50           H        SER  50   4.565  14.441  -0.147
  333    HA   SER  50           HA       SER  50   4.988  17.291  -0.119
  334    HB2  SER  50           2HB      SER  50   2.995  15.409   1.040
  335    HB3  SER  50           1HB      SER  50   3.206  16.962   1.850
  336    HG   SER  50           HG       SER  50   2.295  16.407  -0.745
  337    H    CYS  51           H        CYS  51   4.692  15.080   2.683
  338    HA   CYS  51           HA       CYS  51   6.402  16.788   4.253
  339    HB2  CYS  51           2HB      CYS  51   5.983  15.185   6.071
  340    HB3  CYS  51           1HB      CYS  51   4.491  15.719   5.308
  341    H    SER  52           H        SER  52   6.836  13.895   2.385
  342    HA   SER  52           HA       SER  52   8.684  12.705   1.819
  343    HB2  SER  52           2HB      SER  52  10.358  14.628   3.437
  344    HB3  SER  52           1HB      SER  52  10.858  13.644   2.062
  345    HG   SER  52           HG       SER  52   9.680  14.957   0.710
  346    H    LEU  53           H        LEU  53   7.161  11.855   3.955
  347    HA   LEU  53           HA       LEU  53   9.061  10.949   5.996
  348    HB2  LEU  53           2HB      LEU  53   6.135  11.350   5.875
  349    HB3  LEU  53           1HB      LEU  53   6.664   9.950   6.787
  350    HG   LEU  53           HG       LEU  53   8.211  11.569   8.046
  351   HD11  LEU  53          1HD1      LEU  53   6.297  13.729   7.474
  352   HD12  LEU  53          2HD1      LEU  53   7.447  13.369   6.187
  353   HD13  LEU  53          3HD1      LEU  53   8.029  13.798   7.796
  354   HD21  LEU  53          3HD2      LEU  53   6.100  10.504   8.892
  355   HD22  LEU  53          1HD2      LEU  53   5.253  11.977   8.422
  356   HD23  LEU  53          2HD2      LEU  53   6.521  12.041   9.646
  357    H    ILE  54           H        ILE  54   8.305   8.595   6.820
  358    HA   ILE  54           HA       ILE  54   8.091   6.844   4.457
  359    HB   ILE  54           HB       ILE  54   9.678   5.269   5.552
  360   HG12  ILE  54          2HG1      ILE  54  10.333   7.605   7.364
  361   HG13  ILE  54          1HG1      ILE  54   9.411   6.192   7.865
  362   HG21  ILE  54          1HG2      ILE  54  10.425   6.741   3.763
  363   HG22  ILE  54          2HG2      ILE  54  11.709   6.500   4.947
  364   HG23  ILE  54          3HG2      ILE  54  10.789   8.005   4.937
  365   HD11  ILE  54          3HD1      ILE  54  11.365   4.781   7.326
  366   HD12  ILE  54          1HD1      ILE  54  11.681   5.965   8.595
  367   HD13  ILE  54          2HD1      ILE  54  12.277   6.245   6.959
  368    H    ILE  55           H        ILE  55   6.939   4.957   4.715
  369    HA   ILE  55           HA       ILE  55   5.856   4.328   7.362
  370    HB   ILE  55           HB       ILE  55   3.585   3.994   6.436
  371   HG12  ILE  55          2HG1      ILE  55   4.400   5.653   4.062
  372   HG13  ILE  55          1HG1      ILE  55   4.501   3.897   4.011
  373   HG21  ILE  55          1HG2      ILE  55   4.605   6.814   6.139
  374   HG22  ILE  55          2HG2      ILE  55   4.166   6.035   7.658
  375   HG23  ILE  55          3HG2      ILE  55   2.934   6.330   6.431
  376   HD11  ILE  55          3HD1      ILE  55   2.080   3.823   4.609
  377   HD12  ILE  55          1HD1      ILE  55   2.436   4.538   3.037
  378   HD13  ILE  55          2HD1      ILE  55   2.042   5.573   4.410
  379    H    LYS  56           H        LYS  56   5.407   2.168   7.697
  380    HA   LYS  56           HA       LYS  56   6.526   0.366   5.699
  381    HB2  LYS  56           2HB      LYS  56   6.788   0.440   8.414
  382    HB3  LYS  56           1HB      LYS  56   5.540  -0.782   8.223
  383    HG2  LYS  56           2HG      LYS  56   8.219  -0.835   6.853
  384    HG3  LYS  56           1HG      LYS  56   7.812  -1.719   8.326
  385    HD2  LYS  56           2HD      LYS  56   5.831  -2.618   6.841
  386    HD3  LYS  56           1HD      LYS  56   6.912  -2.172   5.520
  387    HE2  LYS  56           2HE      LYS  56   8.641  -3.600   6.377
  388    HE3  LYS  56           1HE      LYS  56   7.697  -3.945   7.826
  389    HZ1  LYS  56           3HZ      LYS  56   6.327  -4.561   5.362
  390    HZ2  LYS  56           1HZ      LYS  56   6.509  -5.495   6.764
  391    HZ3  LYS  56           2HZ      LYS  56   7.734  -5.469   5.599
  392    H    VAL  57           H        VAL  57   5.468  -1.077   4.570
  393    HA   VAL  57           HA       VAL  57   2.554  -1.185   4.905
  394    HB   VAL  57           HB       VAL  57   3.736  -2.216   2.393
  395   HG11  VAL  57          1HG1      VAL  57   1.349  -2.141   2.717
  396   HG12  VAL  57          2HG1      VAL  57   1.799  -0.976   1.471
  397   HG13  VAL  57          3HG1      VAL  57   1.425  -0.422   3.102
  398   HG21  VAL  57          3HG2      VAL  57   4.166   0.572   3.316
  399   HG22  VAL  57          1HG2      VAL  57   3.608   0.355   1.657
  400   HG23  VAL  57          2HG2      VAL  57   5.103  -0.409   2.189
  401    H    ILE  58           H        ILE  58   1.844  -2.963   5.872
  402    HA   ILE  58           HA       ILE  58   3.435  -5.414   5.781
  403    HB   ILE  58           HB       ILE  58   0.900  -4.931   7.350
  404   HG12  ILE  58          2HG1      ILE  58   2.601  -3.279   7.996
  405   HG13  ILE  58          1HG1      ILE  58   2.338  -4.452   9.282
  406   HG21  ILE  58          1HG2      ILE  58   1.228  -6.935   8.350
  407   HG22  ILE  58          2HG2      ILE  58   2.984  -6.824   8.255
  408   HG23  ILE  58          3HG2      ILE  58   2.052  -7.290   6.833
  409   HD11  ILE  58          3HD1      ILE  58   4.766  -3.675   8.234
  410   HD12  ILE  58          1HD1      ILE  58   4.477  -5.253   7.501
  411   HD13  ILE  58          2HD1      ILE  58   4.466  -5.081   9.256
  412    H    TYR  59           H        TYR  59   2.842  -7.227   4.717
  413    HA   TYR  59           HA       TYR  59   0.131  -7.590   3.750
  414    HB2  TYR  59           2HB      TYR  59   1.014  -7.924   1.366
  415    HB3  TYR  59           1HB      TYR  59   0.888  -6.261   1.936
  416    HD1  TYR  59           2HD      TYR  59   3.201  -8.967   1.045
  417    HD2  TYR  59           1HD      TYR  59   2.863  -4.942   2.378
  418    HE1  TYR  59           2HE      TYR  59   5.585  -8.617   0.565
  419    HE2  TYR  59           1HE      TYR  59   5.239  -4.578   1.902
  420    HH   TYR  59           HH       TYR  59   7.420  -7.024   1.405
  421    H    ASP  60           H        ASP  60   0.163  -9.654   2.219
  422    HA   ASP  60           HA       ASP  60   1.432 -11.743   3.783
  423    HB2  ASP  60           2HB      ASP  60  -0.990 -11.793   2.953
  424    HB3  ASP  60           1HB      ASP  60  -0.325 -12.129   1.356
  425    H    LYS  61           H        LYS  61   3.549 -11.983   3.313
  426    HA   LYS  61           HA       LYS  61   4.755 -11.529   0.821
  427    HB2  LYS  61           2HB      LYS  61   5.629 -13.150   3.206
  428    HB3  LYS  61           1HB      LYS  61   6.628 -12.986   1.769
  429    HG2  LYS  61           2HG      LYS  61   5.615 -10.475   2.940
  430    HG3  LYS  61           1HG      LYS  61   6.803 -11.365   3.894
  431    HD2  LYS  61           2HD      LYS  61   7.942 -11.465   1.433
  432    HD3  LYS  61           1HD      LYS  61   7.116  -9.908   1.353
  433    HE2  LYS  61           2HE      LYS  61   8.339  -9.027   3.124
  434    HE3  LYS  61           1HE      LYS  61   8.788 -10.620   3.732
  435    HZ1  LYS  61           3HZ      LYS  61  10.660  -9.518   2.686
  436    HZ2  LYS  61           1HZ      LYS  61   9.805  -9.371   1.234
  437    HZ3  LYS  61           2HZ      LYS  61  10.234 -10.901   1.813
  438    H    ASP  62           H        ASP  62   3.170 -14.388   2.117
  439    HA   ASP  62           HA       ASP  62   4.203 -16.271   0.277
  440    HB2  ASP  62           2HB      ASP  62   2.764 -16.578   2.473
  441    HB3  ASP  62           1HB      ASP  62   1.423 -16.555   1.336
  442    H    GLN  63           H        GLN  63   1.539 -13.986   0.102
  443    HA   GLN  63           HA       GLN  63   0.586 -15.056  -2.426
  444    HB2  GLN  63           2HB      GLN  63  -0.297 -12.866  -0.579
  445    HB3  GLN  63           1HB      GLN  63  -0.899 -12.912  -2.231
  446    HG2  GLN  63           2HG      GLN  63  -1.755 -15.178  -1.843
  447    HG3  GLN  63           1HG      GLN  63  -1.177 -15.100  -0.181
  448   HE21  GLN  63          1HE2      GLN  63  -3.793 -15.636  -0.675
  449   HE22  GLN  63          2HE2      GLN  63  -4.774 -14.293  -0.207
  450    H    PHE  64           H        PHE  64   2.277 -12.174  -1.229
  451    HA   PHE  64           HA       PHE  64   2.412 -10.881  -3.769
  452    HB2  PHE  64           2HB      PHE  64   3.634 -10.436  -1.082
  453    HB3  PHE  64           1HB      PHE  64   4.375  -9.646  -2.470
  454    HD1  PHE  64           2HD      PHE  64   1.246  -9.962  -0.530
  455    HD2  PHE  64           1HD      PHE  64   3.381  -7.762  -3.482
  456    HE1  PHE  64           2HE      PHE  64  -0.445  -8.180  -0.418
  457    HE2  PHE  64           1HE      PHE  64   1.694  -5.975  -3.374
  458    HZ   PHE  64           HZ       PHE  64  -0.222  -6.181  -1.842
  459    H    VAL  65           H        VAL  65   4.528 -13.111  -2.035
  460    HA   VAL  65           HA       VAL  65   6.504 -12.940  -4.196
  461    HB   VAL  65           HB       VAL  65   6.785 -14.433  -1.583
  462   HG11  VAL  65          1HG1      VAL  65   8.231 -14.991  -3.636
  463   HG12  VAL  65          2HG1      VAL  65   9.043 -14.692  -2.101
  464   HG13  VAL  65          3HG1      VAL  65   9.005 -13.435  -3.336
  465   HG21  VAL  65          3HG2      VAL  65   6.755 -12.349  -0.699
  466   HG22  VAL  65          1HG2      VAL  65   7.151 -11.572  -2.232
  467   HG23  VAL  65          2HG2      VAL  65   8.422 -12.330  -1.274
  468    H    SER  66           H        SER  66   5.552 -14.123  -5.803
  469    HA   SER  66           HA       SER  66   4.966 -15.939  -7.026
  470    HB2  SER  66           2HB      SER  66   7.147 -16.810  -6.239
  471    HB3  SER  66           1HB      SER  66   6.346 -17.519  -4.838
  472    HG   SER  66           HG       SER  66   5.398 -18.997  -6.101
  473    H    GLY  67           H        GLY  67   2.770 -15.319  -6.402
  474    HA2  GLY  67           2HA      GLY  67   1.317 -17.600  -5.419
  475    HA3  GLY  67           1HA      GLY  67   1.246 -16.223  -4.329
  476    H    GLU  68           H        GLU  68   0.949 -14.074  -5.823
  477    HA   GLU  68           HA       GLU  68  -1.449 -14.604  -7.461
  478    HB2  GLU  68           2HB      GLU  68  -1.604 -13.367  -5.153
  479    HB3  GLU  68           1HB      GLU  68  -0.994 -11.991  -6.060
  480    HG2  GLU  68           2HG      GLU  68  -3.141 -11.564  -6.467
  481    HG3  GLU  68           1HG      GLU  68  -3.009 -12.845  -7.670
  482    H    THR  69           H        THR  69   1.092 -14.629  -8.630
  483    HA   THR  69           HA       THR  69   1.876 -12.123  -9.688
  484    HB   THR  69           HB       THR  69   3.431 -13.985  -9.622
  485    HG1  THR  69           1HG      THR  69   4.318 -13.640 -11.581
  486   HG21  THR  69          3HG2      THR  69   3.113 -16.032 -10.435
  487   HG22  THR  69          1HG2      THR  69   2.398 -15.433 -11.931
  488   HG23  THR  69          2HG2      THR  69   1.405 -15.597 -10.484
  489    H    VAL  70           H        VAL  70   1.705 -11.354 -11.868
  490    HA   VAL  70           HA       VAL  70  -0.951 -11.647 -12.929
  491    HB   VAL  70           HB       VAL  70   0.160  -9.446 -12.856
  492   HG11  VAL  70          1HG1      VAL  70   2.396 -10.680 -13.721
  493   HG12  VAL  70          2HG1      VAL  70   2.126  -8.941 -13.823
  494   HG13  VAL  70          3HG1      VAL  70   1.823  -9.965 -15.227
  495   HG21  VAL  70          3HG2      VAL  70  -0.543 -10.418 -15.624
  496   HG22  VAL  70          1HG2      VAL  70  -0.410  -8.724 -15.151
  497   HG23  VAL  70          2HG2      VAL  70  -1.647  -9.747 -14.422
  498    HA   PRO  71           HA       PRO  71  -0.301 -14.912 -15.855
  499    HB2  PRO  71           2HB      PRO  71  -2.132 -13.302 -17.568
  500    HB3  PRO  71           1HB      PRO  71  -2.242 -14.998 -17.089
  501    HG2  PRO  71           2HG      PRO  71  -3.818 -13.167 -15.972
  502    HG3  PRO  71           1HG      PRO  71  -3.135 -14.491 -15.011
  503    HD2  PRO  71           2HD      PRO  71  -2.332 -11.619 -15.122
  504    HD3  PRO  71           1HD      PRO  71  -2.353 -12.734 -13.741
  505    H    ALA  72           H        ALA  72   1.352 -15.177 -17.201
  506    HA   ALA  72           HA       ALA  72   2.838 -14.892 -18.898
  507    HB1  ALA  72           1HB      ALA  72   2.225 -13.784 -20.781
  508    HB2  ALA  72           2HB      ALA  72   1.658 -12.367 -19.899
  509    HB3  ALA  72           3HB      ALA  72   0.652 -13.813 -19.982
  510    HA   PRO  73           HA       PRO  73   5.776 -12.104 -17.142
  511    HB2  PRO  73           2HB      PRO  73   7.557 -11.814 -19.170
  512    HB3  PRO  73           1HB      PRO  73   7.412 -13.302 -18.229
  513    HG2  PRO  73           2HG      PRO  73   6.296 -12.649 -20.928
  514    HG3  PRO  73           1HG      PRO  73   7.062 -14.147 -20.367
  515    HD2  PRO  73           2HD      PRO  73   4.369 -13.850 -20.574
  516    HD3  PRO  73           1HD      PRO  73   5.132 -14.905 -19.366
  517    H    SER  74           H        SER  74   4.133 -10.368 -17.100
  518    HA   SER  74           HA       SER  74   4.607  -8.312 -19.155
  519    HB2  SER  74           2HB      SER  74   2.210  -9.374 -18.451
  520    HB3  SER  74           1HB      SER  74   2.282  -7.998 -17.348
  521    HG   SER  74           HG       SER  74   2.650  -6.663 -19.184
  522    H    ALA  75           H        ALA  75   5.964  -6.778 -18.513
  523    HA   ALA  75           HA       ALA  75   5.535  -5.400 -16.008
  524    HB1  ALA  75           1HB      ALA  75   7.913  -7.152 -16.443
  525    HB2  ALA  75           2HB      ALA  75   6.944  -6.908 -14.990
  526    HB3  ALA  75           3HB      ALA  75   8.089  -5.669 -15.504
  527    H    ASN  76           H        ASN  76   5.318  -4.629 -18.744
  528    HA   ASN  76           HA       ASN  76   7.616  -2.843 -19.130
  529    HB2  ASN  76           2HB      ASN  76   5.624  -4.084 -20.965
  530    HB3  ASN  76           1HB      ASN  76   6.235  -2.489 -21.394
  531   HD21  ASN  76          1HD2      ASN  76   8.721  -2.340 -21.107
  532   HD22  ASN  76          2HD2      ASN  76   9.613  -3.651 -21.796
  533    H    LYS  77           H        LYS  77   7.437  -0.733 -18.728
  534    HA   LYS  77           HA       LYS  77   4.784   0.513 -18.773
  535    HB2  LYS  77           2HB      LYS  77   5.465   1.790 -16.671
  536    HB3  LYS  77           1HB      LYS  77   5.006   0.104 -16.465
  537    HG2  LYS  77           2HG      LYS  77   7.354  -0.534 -16.351
  538    HG3  LYS  77           1HG      LYS  77   7.828   1.149 -16.589
  539    HD2  LYS  77           2HD      LYS  77   6.281   1.542 -14.502
  540    HD3  LYS  77           1HD      LYS  77   6.603  -0.167 -14.210
  541    HE2  LYS  77           2HE      LYS  77   9.002   0.270 -14.248
  542    HE3  LYS  77           1HE      LYS  77   8.696   1.974 -14.580
  543    HZ1  LYS  77           3HZ      LYS  77   8.377   0.477 -12.085
  544    HZ2  LYS  77           1HZ      LYS  77   7.301   1.750 -12.379
  545    HZ3  LYS  77           2HZ      LYS  77   8.965   2.042 -12.337
  546    H    GLU  78           H        GLU  78   5.649   1.288 -20.829
  547    HA   GLU  78           HA       GLU  78   7.616   3.461 -20.540
  548    HB2  GLU  78           2HB      GLU  78   7.686   1.425 -22.303
  549    HB3  GLU  78           1HB      GLU  78   6.744   2.577 -23.239
  550    HG2  GLU  78           2HG      GLU  78   8.672   4.220 -22.552
  551    HG3  GLU  78           1HG      GLU  78   9.575   2.722 -22.338
  552    H    LEU  79           H        LEU  79   4.950   3.859 -19.660
  553    HA   LEU  79           HA       LEU  79   3.522   5.289 -21.724
  554    HB2  LEU  79           2HB      LEU  79   1.891   5.784 -19.928
  555    HB3  LEU  79           1HB      LEU  79   2.209   4.072 -20.128
  556    HG   LEU  79           HG       LEU  79   3.859   5.404 -18.081
  557   HD11  LEU  79          1HD1      LEU  79   2.264   6.018 -16.604
  558   HD12  LEU  79          2HD1      LEU  79   1.123   4.794 -17.158
  559   HD13  LEU  79          3HD1      LEU  79   1.329   6.287 -18.074
  560   HD21  LEU  79          3HD2      LEU  79   2.607   2.795 -18.613
  561   HD22  LEU  79          1HD2      LEU  79   2.668   3.269 -16.916
  562   HD23  LEU  79          2HD2      LEU  79   4.154   3.182 -17.861
  563    H    VAL  80           H        VAL  80   5.447   6.713 -22.089
  564    HA   VAL  80           HA       VAL  80   5.270   9.090 -20.357
  565    HB   VAL  80           HB       VAL  80   7.815   8.162 -21.698
  566   HG11  VAL  80          1HG1      VAL  80   8.869   9.944 -20.749
  567   HG12  VAL  80          2HG1      VAL  80   7.755  10.020 -19.383
  568   HG13  VAL  80          3HG1      VAL  80   7.265  10.646 -20.957
  569   HG21  VAL  80          3HG2      VAL  80   7.640   6.522 -20.110
  570   HG22  VAL  80          1HG2      VAL  80   6.683   7.524 -19.019
  571   HG23  VAL  80          2HG2      VAL  80   8.420   7.784 -19.159
  572    H    LYS  81           H        LYS  81   4.222  10.561 -21.547
  573    HA   LYS  81           HA       LYS  81   4.308  10.641 -24.407
  574    HB2  LYS  81           2HB      LYS  81   3.027  12.285 -22.264
  575    HB3  LYS  81           1HB      LYS  81   3.171  12.977 -23.871
  576    HG2  LYS  81           2HG      LYS  81   1.630  11.579 -24.767
  577    HG3  LYS  81           1HG      LYS  81   2.044  10.248 -23.684
  578    HD2  LYS  81           2HD      LYS  81   0.668  11.007 -22.008
  579    HD3  LYS  81           1HD      LYS  81   0.783  12.688 -22.530
  580    HE2  LYS  81           2HE      LYS  81  -0.930  12.492 -23.988
  581    HE3  LYS  81           1HE      LYS  81  -0.499  10.842 -24.437
  582    HZ1  LYS  81           3HZ      LYS  81  -1.597  11.337 -21.758
  583    HZ2  LYS  81           1HZ      LYS  81  -1.721   9.961 -22.736
  584    HZ3  LYS  81           2HZ      LYS  81  -2.653  11.329 -23.079
  585    H    LEU  82           H        LEU  82   6.094  11.264 -25.445
  586    HA   LEU  82           HA       LEU  82   7.784  12.579 -26.216
  587    HB2  LEU  82           2HB      LEU  82   5.982  14.399 -25.434
  588    HB3  LEU  82           1HB      LEU  82   7.259  14.784 -24.297
  589    HG   LEU  82           HG       LEU  82   8.015  14.569 -27.166
  590   HD11  LEU  82          1HD1      LEU  82   7.377  17.149 -27.140
  591   HD12  LEU  82          2HD1      LEU  82   6.101  16.551 -26.078
  592   HD13  LEU  82          3HD1      LEU  82   6.266  15.904 -27.711
  593   HD21  LEU  82          3HD2      LEU  82   9.190  16.778 -26.261
  594   HD22  LEU  82          1HD2      LEU  82   9.855  15.171 -25.970
  595   HD23  LEU  82          2HD2      LEU  82   8.915  15.976 -24.714
  596    H    GLU  83           H        GLU  83   9.950  13.111 -25.694
  597    HA   GLU  83           HA       GLU  83  10.827  13.106 -22.949
  598    HB2  GLU  83           2HB      GLU  83  10.465  10.635 -23.901
  599    HB3  GLU  83           1HB      GLU  83  12.076  10.924 -24.538
  600    HG2  GLU  83           2HG      GLU  83  12.529  11.691 -22.050
  601    HG3  GLU  83           1HG      GLU  83  11.165  10.620 -21.736
  602    H    HIS  84           H        HIS  84  12.177  12.313 -26.168
  603    HA   HIS  84           HA       HIS  84  13.925  14.654 -25.964
  604    HB2  HIS  84           2HB      HIS  84  15.193  12.677 -25.142
  605    HB3  HIS  84           1HB      HIS  84  14.925  11.887 -26.691
  606    HD1  HIS  84           1HD      HIS  84  16.539  15.074 -25.375
  607    HD2  HIS  84           2HD      HIS  84  16.894  12.343 -28.487
  608    HE1  HIS  84           1HE      HIS  84  18.589  15.773 -26.653
  609    HE2  HIS  84           2HE      HIS  84  18.721  14.170 -28.592
  Start of MODEL   10
    1    H1   MET   1           1HT      MET   1  12.799  -1.584  10.071
    2    H2   MET   1           2HT      MET   1  13.143  -2.949   9.091
    3    H3   MET   1           3HT      MET   1  13.159  -1.375   8.407
    4    HA   MET   1           HA       MET   1  15.018  -2.525  10.376
    5    HB2  MET   1           2HB      MET   1  15.091  -1.826   7.469
    6    HB3  MET   1           1HB      MET   1  16.569  -1.658   8.409
    7    HG2  MET   1           2HG      MET   1  14.970  -4.196   8.390
    8    HG3  MET   1           1HG      MET   1  16.208  -3.850   7.183
    9    HE1  MET   1           2HE      MET   1  17.068  -6.598   9.694
   10    HE2  MET   1           3HE      MET   1  15.464  -5.921   9.420
   11    HE3  MET   1           1HE      MET   1  16.256  -5.708  10.981
   12    H    ALA   2           H        ALA   2  14.372   0.414   8.420
   13    HA   ALA   2           HA       ALA   2  16.041   2.018  10.146
   14    HB1  ALA   2           1HB      ALA   2  14.240   3.257   8.125
   15    HB2  ALA   2           2HB      ALA   2  15.570   2.244   7.564
   16    HB3  ALA   2           3HB      ALA   2  15.901   3.659   8.562
   17    H    VAL   3           H        VAL   3  15.007   4.302  10.726
   18    HA   VAL   3           HA       VAL   3  12.969   3.749  12.668
   19    HB   VAL   3           HB       VAL   3  13.082   6.242  13.114
   20   HG11  VAL   3          1HG1      VAL   3  14.794   5.909  14.553
   21   HG12  VAL   3          2HG1      VAL   3  15.855   5.243  13.312
   22   HG13  VAL   3          3HG1      VAL   3  14.596   4.237  14.027
   23   HG21  VAL   3          3HG2      VAL   3  15.630   6.437  11.650
   24   HG22  VAL   3          1HG2      VAL   3  14.379   7.650  11.923
   25   HG23  VAL   3          2HG2      VAL   3  14.177   6.447  10.650
   26    H    PHE   4           H        PHE   4  11.267   3.052  11.253
   27    HA   PHE   4           HA       PHE   4  10.067   4.876   9.387
   28    HB2  PHE   4           2HB      PHE   4   9.491   2.128  10.388
   29    HB3  PHE   4           1HB      PHE   4   8.164   3.027   9.660
   30    HD1  PHE   4           1HD      PHE   4  11.753   2.246   8.948
   31    HD2  PHE   4           2HD      PHE   4   7.809   2.729   7.430
   32    HE1  PHE   4           1HE      PHE   4  12.536   1.584   6.711
   33    HE2  PHE   4           2HE      PHE   4   8.582   2.068   5.194
   34    HZ   PHE   4           HZ       PHE   4  10.949   1.493   4.830
   35    H    HIS   5           H        HIS   5   7.809   5.587   9.529
   36    HA   HIS   5           HA       HIS   5   7.277   6.824  12.066
   37    HB2  HIS   5           2HB      HIS   5   6.819   7.776   9.702
   38    HB3  HIS   5           1HB      HIS   5   5.363   6.789   9.738
   39    HD1  HIS   5           1HD      HIS   5   6.631   8.638  12.767
   40    HD2  HIS   5           2HD      HIS   5   3.612   8.917   9.923
   41    HE1  HIS   5           1HE      HIS   5   5.088  10.440  13.598
   42    HE2  HIS   5           2HE      HIS   5   3.307  10.640  11.828
   43    H    ASP   6           H        ASP   6   5.275   4.700   9.995
   44    HA   ASP   6           HA       ASP   6   4.484   3.096  12.254
   45    HB2  ASP   6           2HB      ASP   6   2.683   5.175  11.114
   46    HB3  ASP   6           1HB      ASP   6   1.966   3.612  11.492
   47    H    GLU   7           H        GLU   7   3.731   1.091  11.651
   48    HA   GLU   7           HA       GLU   7   3.871   0.488   8.791
   49    HB2  GLU   7           2HB      GLU   7   3.602  -1.506  11.043
   50    HB3  GLU   7           1HB      GLU   7   4.135  -1.807   9.399
   51    HG2  GLU   7           2HG      GLU   7   6.164  -1.783  10.348
   52    HG3  GLU   7           1HG      GLU   7   6.002  -0.039  10.152
   53    H    VAL   8           H        VAL   8   2.148  -0.092   7.593
   54    HA   VAL   8           HA       VAL   8  -0.384  -0.664   8.981
   55    HB   VAL   8           HB       VAL   8  -0.208   1.016   6.478
   56   HG11  VAL   8          1HG1      VAL   8  -2.343   0.289   6.400
   57   HG12  VAL   8          2HG1      VAL   8  -2.596   1.564   7.591
   58   HG13  VAL   8          3HG1      VAL   8  -2.387  -0.104   8.118
   59   HG21  VAL   8          3HG2      VAL   8  -0.606   2.965   7.803
   60   HG22  VAL   8          1HG2      VAL   8   0.804   2.145   8.473
   61   HG23  VAL   8          2HG2      VAL   8  -0.763   2.004   9.273
   62    H    GLU   9           H        GLU   9  -1.688  -2.187   8.063
   63    HA   GLU   9           HA       GLU   9  -0.486  -4.069   6.307
   64    HB2  GLU   9           2HB      GLU   9  -3.375  -3.863   7.175
   65    HB3  GLU   9           1HB      GLU   9  -2.618  -5.266   6.436
   66    HG2  GLU   9           2HG      GLU   9  -1.528  -5.864   8.343
   67    HG3  GLU   9           1HG      GLU   9  -1.418  -4.207   8.935
   68    H    ILE  10           H        ILE  10  -0.832  -4.503   4.178
   69    HA   ILE  10           HA       ILE  10  -1.468  -2.445   2.417
   70    HB   ILE  10           HB       ILE  10  -0.133  -4.440   1.815
   71   HG12  ILE  10          2HG1      ILE  10  -1.673  -4.820  -0.413
   72   HG13  ILE  10          1HG1      ILE  10  -2.303  -3.292   0.192
   73   HG21  ILE  10          1HG2      ILE  10  -1.136  -6.534   1.280
   74   HG22  ILE  10          2HG2      ILE  10  -2.758  -5.886   1.522
   75   HG23  ILE  10          3HG2      ILE  10  -1.674  -6.088   2.899
   76   HD11  ILE  10          3HD1      ILE  10  -0.131  -3.590  -1.425
   77   HD12  ILE  10          1HD1      ILE  10   0.606  -3.412   0.168
   78   HD13  ILE  10          2HD1      ILE  10  -0.491  -2.172  -0.441
   79    H    GLU  11           H        GLU  11  -3.569  -4.802   3.942
   80    HA   GLU  11           HA       GLU  11  -5.781  -4.650   2.230
   81    HB2  GLU  11           2HB      GLU  11  -7.122  -5.353   4.197
   82    HB3  GLU  11           1HB      GLU  11  -5.691  -6.342   3.947
   83    HG2  GLU  11           2HG      GLU  11  -4.794  -5.763   5.915
   84    HG3  GLU  11           1HG      GLU  11  -5.290  -4.079   5.764
   85    H    ASP  12           H        ASP  12  -4.649  -2.469   4.735
   86    HA   ASP  12           HA       ASP  12  -7.035  -0.892   4.842
   87    HB2  ASP  12           2HB      ASP  12  -4.889  -1.120   6.481
   88    HB3  ASP  12           1HB      ASP  12  -4.465   0.359   5.624
   89    H    PHE  13           H        PHE  13  -4.107  -0.869   2.926
   90    HA   PHE  13           HA       PHE  13  -4.247   1.753   1.903
   91    HB2  PHE  13           2HB      PHE  13  -2.916  -0.787   1.053
   92    HB3  PHE  13           1HB      PHE  13  -2.984   0.548  -0.087
   93    HD1  PHE  13           2HD      PHE  13  -2.072  -0.099   3.480
   94    HD2  PHE  13           1HD      PHE  13  -1.243   2.032  -0.111
   95    HE1  PHE  13           2HE      PHE  13  -0.082   0.897   4.531
   96    HE2  PHE  13           1HE      PHE  13   0.747   3.027   0.933
   97    HZ   PHE  13           HZ       PHE  13   1.329   2.461   3.258
   98    H    GLN  14           H        GLN  14  -4.543   2.145  -0.545
   99    HA   GLN  14           HA       GLN  14  -7.097   0.927  -1.362
  100    HB2  GLN  14           2HB      GLN  14  -6.588   3.568  -0.969
  101    HB3  GLN  14           1HB      GLN  14  -6.220   3.424  -2.682
  102    HG2  GLN  14           2HG      GLN  14  -8.475   2.337  -2.959
  103    HG3  GLN  14           1HG      GLN  14  -8.816   2.818  -1.298
  104   HE21  GLN  14          1HE2      GLN  14  -9.972   3.611  -3.951
  105   HE22  GLN  14          2HE2      GLN  14  -9.911   5.338  -3.952
  106    H    TYR  15           H        TYR  15  -6.845  -0.580  -2.891
  107    HA   TYR  15           HA       TYR  15  -4.535  -0.805  -4.511
  108    HB2  TYR  15           2HB      TYR  15  -5.899  -2.763  -3.973
  109    HB3  TYR  15           1HB      TYR  15  -7.261  -2.080  -4.855
  110    HD1  TYR  15           1HD      TYR  15  -3.696  -3.072  -5.389
  111    HD2  TYR  15           2HD      TYR  15  -7.592  -2.720  -7.059
  112    HE1  TYR  15           1HE      TYR  15  -2.905  -4.165  -7.442
  113    HE2  TYR  15           2HE      TYR  15  -6.815  -3.812  -9.119
  114    HH   TYR  15           HH       TYR  15  -4.076  -4.008 -10.183
  115    H    ASP  16           H        ASP  16  -4.000   0.235  -6.308
  116    HA   ASP  16           HA       ASP  16  -6.031   1.855  -7.665
  117    HB2  ASP  16           2HB      ASP  16  -3.734   2.742  -6.764
  118    HB3  ASP  16           1HB      ASP  16  -3.094   2.044  -8.247
  119    H    GLU  17           H        GLU  17  -7.024   0.387  -9.008
  120    HA   GLU  17           HA       GLU  17  -5.817  -1.609 -10.535
  121    HB2  GLU  17           2HB      GLU  17  -7.856  -1.335 -12.040
  122    HB3  GLU  17           1HB      GLU  17  -8.160  -1.698 -10.346
  123    HG2  GLU  17           2HG      GLU  17  -8.855   0.497  -9.891
  124    HG3  GLU  17           1HG      GLU  17  -8.190   1.109 -11.406
  125    H    ASP  18           H        ASP  18  -5.965   1.815 -11.078
  126    HA   ASP  18           HA       ASP  18  -5.672   2.100 -13.778
  127    HB2  ASP  18           2HB      ASP  18  -4.122   3.661 -11.700
  128    HB3  ASP  18           1HB      ASP  18  -4.481   4.179 -13.341
  129    H    SER  19           H        SER  19  -2.988   1.618 -11.463
  130    HA   SER  19           HA       SER  19  -1.477   0.271 -13.568
  131    HB2  SER  19           2HB      SER  19  -0.491   2.712 -12.077
  132    HB3  SER  19           1HB      SER  19   0.566   1.637 -12.994
  133    HG   SER  19           HG       SER  19  -0.762   3.667 -13.929
  134    H    GLU  20           H        GLU  20  -2.774  -0.589 -11.059
  135    HA   GLU  20           HA       GLU  20  -2.391  -1.873  -9.218
  136    HB2  GLU  20           2HB      GLU  20   0.182  -2.596 -10.620
  137    HB3  GLU  20           1HB      GLU  20  -0.695  -3.567  -9.446
  138    HG2  GLU  20           2HG      GLU  20  -2.082  -4.391 -10.989
  139    HG3  GLU  20           1HG      GLU  20  -2.279  -2.832 -11.787
  140    H    THR  21           H        THR  21  -2.072   0.268  -8.103
  141    HA   THR  21           HA       THR  21   0.512   0.237  -6.710
  142    HB   THR  21           HB       THR  21  -0.812   2.808  -7.599
  143    HG1  THR  21           1HG      THR  21   1.237   1.289  -8.816
  144   HG21  THR  21          3HG2      THR  21   1.249   3.881  -7.034
  145   HG22  THR  21          1HG2      THR  21   1.994   2.334  -6.629
  146   HG23  THR  21          2HG2      THR  21   0.683   2.969  -5.634
  147    H    TYR  22           H        TYR  22   0.442   1.182  -4.568
  148    HA   TYR  22           HA       TYR  22  -2.297   1.372  -3.481
  149    HB2  TYR  22           2HB      TYR  22   0.150   0.255  -2.090
  150    HB3  TYR  22           1HB      TYR  22  -1.456   0.406  -1.383
  151    HD1  TYR  22           2HD      TYR  22   0.445  -1.287  -4.086
  152    HD2  TYR  22           1HD      TYR  22  -3.062  -1.291  -1.674
  153    HE1  TYR  22           2HE      TYR  22  -0.125  -3.518  -4.932
  154    HE2  TYR  22           1HE      TYR  22  -3.640  -3.528  -2.513
  155    HH   TYR  22           HH       TYR  22  -1.999  -5.571  -3.581
  156    H    PHE  23           H        PHE  23  -2.755   3.028  -2.070
  157    HA   PHE  23           HA       PHE  23  -0.560   4.879  -1.418
  158    HB2  PHE  23           2HB      PHE  23  -3.310   5.732  -2.347
  159    HB3  PHE  23           1HB      PHE  23  -1.957   6.789  -1.963
  160    HD1  PHE  23           1HD      PHE  23  -2.967   4.056  -4.280
  161    HD2  PHE  23           2HD      PHE  23  -0.508   7.473  -3.644
  162    HE1  PHE  23           1HE      PHE  23  -2.236   3.962  -6.624
  163    HE2  PHE  23           2HE      PHE  23   0.226   7.384  -5.989
  164    HZ   PHE  23           HZ       PHE  23  -0.637   5.626  -7.484
  165    H    TYR  24           H        TYR  24  -0.883   6.217   0.441
  166    HA   TYR  24           HA       TYR  24  -3.044   5.339   2.238
  167    HB2  TYR  24           2HB      TYR  24  -0.627   4.418   2.689
  168    HB3  TYR  24           1HB      TYR  24  -0.349   6.026   3.352
  169    HD1  TYR  24           1HD      TYR  24  -2.510   3.022   3.658
  170    HD2  TYR  24           2HD      TYR  24  -1.093   6.578   5.520
  171    HE1  TYR  24           1HE      TYR  24  -3.540   2.319   5.774
  172    HE2  TYR  24           2HE      TYR  24  -2.118   5.881   7.641
  173    HH   TYR  24           HH       TYR  24  -4.186   4.267   8.245
  174    HA   PRO  25           HA       PRO  25  -3.761   9.703   2.638
  175    HB2  PRO  25           2HB      PRO  25  -5.337   9.668   4.847
  176    HB3  PRO  25           1HB      PRO  25  -5.905   9.167   3.249
  177    HG2  PRO  25           2HG      PRO  25  -4.978   7.484   5.544
  178    HG3  PRO  25           1HG      PRO  25  -6.362   7.238   4.464
  179    HD2  PRO  25           2HD      PRO  25  -4.020   5.909   4.165
  180    HD3  PRO  25           1HD      PRO  25  -5.059   6.340   2.791
  181    H    CYS  26           H        CYS  26  -2.358  11.161   3.380
  182    HA   CYS  26           HA       CYS  26  -0.995  10.667   5.926
  183    HB2  CYS  26           2HB      CYS  26  -0.032  11.463   3.452
  184    HB3  CYS  26           1HB      CYS  26  -0.061  12.960   4.383
  185    HA   PRO  27           HA       PRO  27  -3.298  13.851   7.963
  186    HB2  PRO  27           2HB      PRO  27  -1.513  14.542   9.898
  187    HB3  PRO  27           1HB      PRO  27  -2.468  13.054   9.946
  188    HG2  PRO  27           2HG      PRO  27   0.370  13.457   9.084
  189    HG3  PRO  27           1HG      PRO  27  -0.327  12.160  10.072
  190    HD2  PRO  27           2HD      PRO  27   0.237  11.838   7.449
  191    HD3  PRO  27           1HD      PRO  27  -1.131  11.020   8.235
  192    H    CYS  28           H        CYS  28  -0.212  14.461   6.493
  193    HA   CYS  28           HA       CYS  28  -0.127  17.263   7.052
  194    HB2  CYS  28           2HB      CYS  28   1.704  17.333   5.431
  195    HB3  CYS  28           1HB      CYS  28   1.915  15.997   6.557
  196    H    GLY  29           H        GLY  29  -1.233  15.297   4.307
  197    HA2  GLY  29           2HA      GLY  29  -3.314  16.774   3.449
  198    HA3  GLY  29           1HA      GLY  29  -1.952  17.637   2.753
  199    H    ASP  30           H        ASP  30  -0.275  15.726   1.881
  200    HA   ASP  30           HA       ASP  30  -1.701  14.653  -0.378
  201    HB2  ASP  30           2HB      ASP  30   0.941  15.451   0.117
  202    HB3  ASP  30           1HB      ASP  30   1.033  13.713  -0.162
  203    H    ASN  31           H        ASN  31  -0.461  12.261  -0.971
  204    HA   ASN  31           HA       ASN  31  -1.047  10.515   1.317
  205    HB2  ASN  31           2HB      ASN  31  -2.098   9.986  -1.469
  206    HB3  ASN  31           1HB      ASN  31  -2.426   9.053  -0.012
  207   HD21  ASN  31          1HD2      ASN  31  -2.927  12.184  -1.556
  208   HD22  ASN  31          2HD2      ASN  31  -4.377  12.573  -0.701
  209    H    PHE  32           H        PHE  32   0.095   8.641   1.452
  210    HA   PHE  32           HA       PHE  32   2.617   8.488   0.190
  211    HB2  PHE  32           2HB      PHE  32   1.024   6.604   1.910
  212    HB3  PHE  32           1HB      PHE  32   2.554   6.098   1.210
  213    HD1  PHE  32           2HD      PHE  32   4.605   7.561   1.706
  214    HD2  PHE  32           1HD      PHE  32   0.980   7.759   3.927
  215    HE1  PHE  32           2HE      PHE  32   5.816   8.588   3.583
  216    HE2  PHE  32           1HE      PHE  32   2.187   8.787   5.810
  217    HZ   PHE  32           HZ       PHE  32   4.608   9.201   5.639
  218    H    SER  33           H        SER  33   3.439   6.610  -1.089
  219    HA   SER  33           HA       SER  33   1.424   5.232  -2.695
  220    HB2  SER  33           2HB      SER  33   3.644   6.479  -4.245
  221    HB3  SER  33           1HB      SER  33   1.991   6.110  -4.741
  222    HG   SER  33           HG       SER  33   1.688   8.173  -4.432
  223    H    ILE  34           H        ILE  34   2.027   3.246  -3.414
  224    HA   ILE  34           HA       ILE  34   4.813   2.452  -3.473
  225    HB   ILE  34           HB       ILE  34   4.240   2.050  -1.122
  226   HG12  ILE  34          2HG1      ILE  34   4.305  -0.713  -2.214
  227   HG13  ILE  34          1HG1      ILE  34   5.569   0.380  -2.767
  228   HG21  ILE  34          1HG2      ILE  34   1.747   1.516  -1.898
  229   HG22  ILE  34          2HG2      ILE  34   2.417   0.928  -0.378
  230   HG23  ILE  34          3HG2      ILE  34   2.356  -0.135  -1.783
  231   HD11  ILE  34          3HD1      ILE  34   5.229   0.526   0.095
  232   HD12  ILE  34          1HD1      ILE  34   6.673   0.184  -0.858
  233   HD13  ILE  34          2HD1      ILE  34   5.560  -1.120  -0.444
  234    H    THR  35           H        THR  35   5.113   1.210  -5.202
  235    HA   THR  35           HA       THR  35   2.919   0.275  -6.773
  236    HB   THR  35           HB       THR  35   4.808  -0.786  -8.144
  237    HG1  THR  35           1HG      THR  35   6.758  -0.672  -7.390
  238   HG21  THR  35          3HG2      THR  35   3.823   1.607  -8.391
  239   HG22  THR  35          1HG2      THR  35   5.307   1.166  -9.233
  240   HG23  THR  35          2HG2      THR  35   5.385   2.108  -7.743
  241    H    LYS  36           H        LYS  36   2.346  -1.849  -7.313
  242    HA   LYS  36           HA       LYS  36   2.275  -3.711  -5.220
  243    HB2  LYS  36           2HB      LYS  36   0.650  -3.689  -7.072
  244    HB3  LYS  36           1HB      LYS  36   1.909  -4.206  -8.184
  245    HG2  LYS  36           2HG      LYS  36   1.001  -6.229  -7.782
  246    HG3  LYS  36           1HG      LYS  36   2.093  -6.185  -6.397
  247    HD2  LYS  36           2HD      LYS  36   0.312  -5.437  -4.958
  248    HD3  LYS  36           1HD      LYS  36  -0.785  -5.287  -6.331
  249    HE2  LYS  36           2HE      LYS  36   0.053  -7.885  -6.537
  250    HE3  LYS  36           1HE      LYS  36  -0.002  -7.649  -4.790
  251    HZ1  LYS  36           3HZ      LYS  36  -2.166  -7.761  -6.714
  252    HZ2  LYS  36           1HZ      LYS  36  -2.327  -6.560  -5.530
  253    HZ3  LYS  36           2HZ      LYS  36  -2.153  -8.181  -5.077
  254    H    GLU  37           H        GLU  37   4.436  -3.442  -8.008
  255    HA   GLU  37           HA       GLU  37   5.780  -5.885  -7.715
  256    HB2  GLU  37           2HB      GLU  37   5.859  -4.117  -9.628
  257    HB3  GLU  37           1HB      GLU  37   7.175  -3.415  -8.697
  258    HG2  GLU  37           2HG      GLU  37   8.094  -5.872  -8.741
  259    HG3  GLU  37           1HG      GLU  37   7.048  -6.009 -10.152
  260    H    ASP  38           H        ASP  38   6.362  -2.717  -6.225
  261    HA   ASP  38           HA       ASP  38   8.841  -3.228  -5.049
  262    HB2  ASP  38           2HB      ASP  38   6.574  -1.379  -4.454
  263    HB3  ASP  38           1HB      ASP  38   7.781  -1.609  -3.195
  264    H    LEU  39           H        LEU  39   5.571  -3.760  -3.768
  265    HA   LEU  39           HA       LEU  39   6.382  -4.835  -1.284
  266    HB2  LEU  39           2HB      LEU  39   3.829  -5.451  -2.764
  267    HB3  LEU  39           1HB      LEU  39   4.105  -5.577  -1.038
  268    HG   LEU  39           HG       LEU  39   4.468  -2.904  -2.295
  269   HD11  LEU  39          1HD1      LEU  39   1.909  -2.658  -1.738
  270   HD12  LEU  39          2HD1      LEU  39   1.894  -4.378  -2.129
  271   HD13  LEU  39          3HD1      LEU  39   2.455  -3.208  -3.322
  272   HD21  LEU  39          3HD2      LEU  39   3.604  -2.146  -0.165
  273   HD22  LEU  39          1HD2      LEU  39   4.911  -3.301   0.094
  274   HD23  LEU  39          2HD2      LEU  39   3.233  -3.804   0.305
  275    H    GLU  40           H        GLU  40   5.704  -6.331  -4.428
  276    HA   GLU  40           HA       GLU  40   5.831  -9.020  -3.569
  277    HB2  GLU  40           2HB      GLU  40   6.277  -7.729  -6.251
  278    HB3  GLU  40           1HB      GLU  40   6.386  -9.466  -6.016
  279    HG2  GLU  40           2HG      GLU  40   4.037  -9.324  -5.059
  280    HG3  GLU  40           1HG      GLU  40   3.986  -7.693  -5.723
  281    H    ASN  41           H        ASN  41   8.329  -6.686  -4.270
  282    HA   ASN  41           HA       ASN  41  10.392  -8.745  -4.369
  283    HB2  ASN  41           2HB      ASN  41  10.253  -5.854  -5.037
  284    HB3  ASN  41           1HB      ASN  41  11.808  -6.466  -4.482
  285   HD21  ASN  41          1HD2      ASN  41  12.736  -6.117  -6.507
  286   HD22  ASN  41          2HD2      ASN  41  12.398  -7.145  -7.854
  287    H    GLY  42           H        GLY  42   9.285  -6.142  -2.244
  288    HA2  GLY  42           2HA      GLY  42   9.793  -7.009   0.178
  289    HA3  GLY  42           1HA      GLY  42  11.444  -6.722  -0.352
  290    H    GLU  43           H        GLU  43  10.207  -4.391  -2.014
  291    HA   GLU  43           HA       GLU  43  10.847  -2.334  -0.185
  292    HB2  GLU  43           2HB      GLU  43   9.634  -2.359  -2.940
  293    HB3  GLU  43           1HB      GLU  43   9.815  -0.863  -2.037
  294    HG2  GLU  43           2HG      GLU  43  12.301  -1.768  -1.802
  295    HG3  GLU  43           1HG      GLU  43  11.859  -2.578  -3.305
  296    H    ASP  44           H        ASP  44   9.424  -2.819   1.559
  297    HA   ASP  44           HA       ASP  44   6.579  -2.270   1.155
  298    HB2  ASP  44           2HB      ASP  44   6.467  -2.933   3.632
  299    HB3  ASP  44           1HB      ASP  44   6.886  -4.194   2.482
  300    H    VAL  45           H        VAL  45   8.319  -0.092   0.795
  301    HA   VAL  45           HA       VAL  45   7.571   1.577   3.096
  302    HB   VAL  45           HB       VAL  45   9.986   1.255   3.127
  303   HG11  VAL  45          1HG1      VAL  45  11.439   1.874   1.358
  304   HG12  VAL  45          2HG1      VAL  45  10.123   2.608   0.442
  305   HG13  VAL  45          3HG1      VAL  45  10.186   0.858   0.643
  306   HG21  VAL  45          3HG2      VAL  45   8.736   3.544   3.523
  307   HG22  VAL  45          1HG2      VAL  45   9.713   4.047   2.144
  308   HG23  VAL  45          2HG2      VAL  45  10.493   3.431   3.601
  309    H    ALA  46           H        ALA  46   6.442   3.347   2.666
  310    HA   ALA  46           HA       ALA  46   6.196   4.173  -0.150
  311    HB1  ALA  46           1HB      ALA  46   4.172   3.232   1.340
  312    HB2  ALA  46           2HB      ALA  46   3.961   4.426   0.061
  313    HB3  ALA  46           3HB      ALA  46   4.062   4.946   1.742
  314    H    THR  47           H        THR  47   6.575   6.249  -0.673
  315    HA   THR  47           HA       THR  47   7.281   8.082   1.519
  316    HB   THR  47           HB       THR  47   8.203   8.366  -1.339
  317    HG1  THR  47           1HG      THR  47   9.140   6.490  -0.872
  318   HG21  THR  47          3HG2      THR  47  10.098   9.160   0.641
  319   HG22  THR  47          1HG2      THR  47   8.553   9.951   0.952
  320   HG23  THR  47          2HG2      THR  47   9.330  10.123  -0.622
  321    H    CYS  48           H        CYS  48   6.057   9.830   1.809
  322    HA   CYS  48           HA       CYS  48   3.846  10.349   0.046
  323    HB2  CYS  48           2HB      CYS  48   3.597  10.557   2.484
  324    HB3  CYS  48           1HB      CYS  48   4.774  11.867   2.496
  325    HA   PRO  49           HA       PRO  49   5.988  13.404  -2.374
  326    HB2  PRO  49           2HB      PRO  49   3.940  14.173  -3.932
  327    HB3  PRO  49           1HB      PRO  49   4.686  12.578  -4.087
  328    HG2  PRO  49           2HG      PRO  49   2.134  13.358  -2.749
  329    HG3  PRO  49           1HG      PRO  49   2.492  11.927  -3.730
  330    HD2  PRO  49           2HD      PRO  49   2.438  11.972  -0.970
  331    HD3  PRO  49           1HD      PRO  49   3.310  10.772  -1.944
  332    H    SER  50           H        SER  50   5.341  14.343   0.201
  333    HA   SER  50           HA       SER  50   5.000  17.142  -0.350
  334    HB2  SER  50           2HB      SER  50   2.802  15.549   0.772
  335    HB3  SER  50           1HB      SER  50   3.221  16.960   1.745
  336    HG   SER  50           HG       SER  50   1.771  17.668   0.257
  337    H    CYS  51           H        CYS  51   4.630  15.039   2.525
  338    HA   CYS  51           HA       CYS  51   6.435  16.705   4.037
  339    HB2  CYS  51           2HB      CYS  51   5.979  15.183   5.894
  340    HB3  CYS  51           1HB      CYS  51   4.480  15.684   5.116
  341    H    SER  52           H        SER  52   6.669  13.764   2.194
  342    HA   SER  52           HA       SER  52   8.440  12.482   1.586
  343    HB2  SER  52           2HB      SER  52   9.571  14.921   1.839
  344    HB3  SER  52           1HB      SER  52  10.465  14.051   3.085
  345    HG   SER  52           HG       SER  52  11.097  12.551   1.519
  346    H    LEU  53           H        LEU  53   6.955  11.869   3.911
  347    HA   LEU  53           HA       LEU  53   8.854  10.959   5.917
  348    HB2  LEU  53           2HB      LEU  53   5.886  11.119   5.694
  349    HB3  LEU  53           1HB      LEU  53   6.560   9.925   6.784
  350    HG   LEU  53           HG       LEU  53   7.336  12.825   6.954
  351   HD11  LEU  53          1HD1      LEU  53   5.198  13.251   7.466
  352   HD12  LEU  53          2HD1      LEU  53   5.579  12.465   8.998
  353   HD13  LEU  53          3HD1      LEU  53   4.809  11.548   7.703
  354   HD21  LEU  53          3HD2      LEU  53   7.750  10.377   8.567
  355   HD22  LEU  53          1HD2      LEU  53   7.464  11.878   9.447
  356   HD23  LEU  53          2HD2      LEU  53   8.809  11.764   8.312
  357    H    ILE  54           H        ILE  54   8.163   8.595   6.777
  358    HA   ILE  54           HA       ILE  54   8.057   6.808   4.438
  359    HB   ILE  54           HB       ILE  54   9.642   5.284   5.605
  360   HG12  ILE  54          2HG1      ILE  54  10.061   7.665   7.429
  361   HG13  ILE  54          1HG1      ILE  54   9.345   6.126   7.892
  362   HG21  ILE  54          1HG2      ILE  54  10.887   7.981   5.129
  363   HG22  ILE  54          2HG2      ILE  54  10.293   6.951   3.826
  364   HG23  ILE  54          3HG2      ILE  54  11.600   6.389   4.868
  365   HD11  ILE  54          3HD1      ILE  54  11.798   6.572   8.483
  366   HD12  ILE  54          1HD1      ILE  54  12.116   6.254   6.778
  367   HD13  ILE  54          2HD1      ILE  54  11.374   5.009   7.783
  368    H    ILE  55           H        ILE  55   6.954   4.897   4.677
  369    HA   ILE  55           HA       ILE  55   5.817   4.235   7.290
  370    HB   ILE  55           HB       ILE  55   3.571   3.848   6.252
  371   HG12  ILE  55          2HG1      ILE  55   4.235   5.793   4.096
  372   HG13  ILE  55          1HG1      ILE  55   4.740   4.123   3.863
  373   HG21  ILE  55          1HG2      ILE  55   2.876   6.198   6.362
  374   HG22  ILE  55          2HG2      ILE  55   4.566   6.693   6.290
  375   HG23  ILE  55          3HG2      ILE  55   3.976   5.770   7.672
  376   HD11  ILE  55          3HD1      ILE  55   2.710   3.832   3.001
  377   HD12  ILE  55          1HD1      ILE  55   2.090   5.316   3.722
  378   HD13  ILE  55          2HD1      ILE  55   2.149   3.833   4.673
  379    H    LYS  56           H        LYS  56   5.446   2.070   7.600
  380    HA   LYS  56           HA       LYS  56   6.561   0.303   5.568
  381    HB2  LYS  56           2HB      LYS  56   6.897   0.348   8.256
  382    HB3  LYS  56           1HB      LYS  56   5.600  -0.830   8.123
  383    HG2  LYS  56           2HG      LYS  56   8.107  -1.049   6.494
  384    HG3  LYS  56           1HG      LYS  56   7.988  -1.696   8.132
  385    HD2  LYS  56           2HD      LYS  56   5.884  -2.903   7.288
  386    HD3  LYS  56           1HD      LYS  56   6.473  -2.512   5.671
  387    HE2  LYS  56           2HE      LYS  56   7.353  -4.624   6.034
  388    HE3  LYS  56           1HE      LYS  56   8.690  -3.563   6.472
  389    HZ1  LYS  56           3HZ      LYS  56   7.877  -5.536   8.017
  390    HZ2  LYS  56           1HZ      LYS  56   6.856  -4.325   8.610
  391    HZ3  LYS  56           2HZ      LYS  56   8.532  -4.111   8.647
  392    H    VAL  57           H        VAL  57   5.504  -1.176   4.457
  393    HA   VAL  57           HA       VAL  57   2.591  -1.284   4.822
  394    HB   VAL  57           HB       VAL  57   3.755  -2.294   2.290
  395   HG11  VAL  57          1HG1      VAL  57   1.412  -0.576   3.067
  396   HG12  VAL  57          2HG1      VAL  57   1.380  -2.273   2.593
  397   HG13  VAL  57          3HG1      VAL  57   1.791  -1.032   1.407
  398   HG21  VAL  57          3HG2      VAL  57   4.151   0.492   3.228
  399   HG22  VAL  57          1HG2      VAL  57   3.578   0.280   1.573
  400   HG23  VAL  57          2HG2      VAL  57   5.091  -0.465   2.086
  401    H    ILE  58           H        ILE  58   1.922  -3.060   5.825
  402    HA   ILE  58           HA       ILE  58   3.508  -5.504   5.706
  403    HB   ILE  58           HB       ILE  58   0.946  -5.070   7.240
  404   HG12  ILE  58          2HG1      ILE  58   2.630  -3.382   7.889
  405   HG13  ILE  58          1HG1      ILE  58   2.319  -4.533   9.186
  406   HG21  ILE  58          1HG2      ILE  58   3.076  -7.167   7.234
  407   HG22  ILE  58          2HG2      ILE  58   1.322  -7.350   7.208
  408   HG23  ILE  58          3HG2      ILE  58   2.135  -6.861   8.694
  409   HD11  ILE  58          3HD1      ILE  58   4.701  -3.964   8.923
  410   HD12  ILE  58          1HD1      ILE  58   4.664  -4.667   7.306
  411   HD13  ILE  58          2HD1      ILE  58   4.375  -5.686   8.717
  412    H    TYR  59           H        TYR  59   2.944  -7.319   4.641
  413    HA   TYR  59           HA       TYR  59   0.254  -7.720   3.643
  414    HB2  TYR  59           2HB      TYR  59   1.151  -8.043   1.271
  415    HB3  TYR  59           1HB      TYR  59   1.012  -6.379   1.834
  416    HD1  TYR  59           1HD      TYR  59   3.351  -9.089   1.011
  417    HD2  TYR  59           2HD      TYR  59   2.975  -5.029   2.222
  418    HE1  TYR  59           1HE      TYR  59   5.730  -8.730   0.525
  419    HE2  TYR  59           2HE      TYR  59   5.343  -4.657   1.729
  420    HH   TYR  59           HH       TYR  59   7.203  -6.658  -0.087
  421    H    ASP  60           H        ASP  60   0.261  -9.819   2.215
  422    HA   ASP  60           HA       ASP  60   1.606 -11.844   3.787
  423    HB2  ASP  60           2HB      ASP  60  -0.838 -11.817   2.666
  424    HB3  ASP  60           1HB      ASP  60   0.053 -12.613   1.372
  425    H    LYS  61           H        LYS  61   3.727 -12.045   3.326
  426    HA   LYS  61           HA       LYS  61   4.926 -11.620   0.827
  427    HB2  LYS  61           2HB      LYS  61   5.890 -13.351   3.111
  428    HB3  LYS  61           1HB      LYS  61   6.875 -12.836   1.749
  429    HG2  LYS  61           2HG      LYS  61   5.514 -10.769   3.408
  430    HG3  LYS  61           1HG      LYS  61   6.962 -11.563   4.030
  431    HD2  LYS  61           2HD      LYS  61   8.278 -10.795   2.219
  432    HD3  LYS  61           1HD      LYS  61   6.855 -10.301   1.300
  433    HE2  LYS  61           2HE      LYS  61   7.364  -8.256   2.093
  434    HE3  LYS  61           1HE      LYS  61   6.525  -8.824   3.535
  435    HZ1  LYS  61           3HZ      LYS  61   9.362  -8.355   3.097
  436    HZ2  LYS  61           1HZ      LYS  61   8.972  -9.706   4.039
  437    HZ3  LYS  61           2HZ      LYS  61   8.438  -8.169   4.500
  438    H    ASP  62           H        ASP  62   3.376 -14.455   2.187
  439    HA   ASP  62           HA       ASP  62   4.400 -16.369   0.370
  440    HB2  ASP  62           2HB      ASP  62   2.115 -16.256   2.280
  441    HB3  ASP  62           1HB      ASP  62   2.075 -17.497   1.032
  442    H    GLN  63           H        GLN  63   1.541 -14.275   0.308
  443    HA   GLN  63           HA       GLN  63   0.560 -15.392  -2.157
  444    HB2  GLN  63           2HB      GLN  63  -0.220 -12.957  -0.559
  445    HB3  GLN  63           1HB      GLN  63  -1.003 -13.398  -2.068
  446    HG2  GLN  63           2HG      GLN  63  -1.274 -15.717  -0.817
  447    HG3  GLN  63           1HG      GLN  63  -1.157 -14.677   0.601
  448   HE21  GLN  63          1HE2      GLN  63  -3.190 -14.638   1.332
  449   HE22  GLN  63          2HE2      GLN  63  -4.564 -14.131   0.416
  450    H    PHE  64           H        PHE  64   2.249 -12.411  -1.212
  451    HA   PHE  64           HA       PHE  64   2.301 -11.275  -3.814
  452    HB2  PHE  64           2HB      PHE  64   3.735 -10.736  -1.244
  453    HB3  PHE  64           1HB      PHE  64   4.345 -10.003  -2.723
  454    HD1  PHE  64           1HD      PHE  64   1.187 -10.395  -0.780
  455    HD2  PHE  64           2HD      PHE  64   3.491  -7.971  -3.414
  456    HE1  PHE  64           1HE      PHE  64  -0.474  -8.595  -0.570
  457    HE2  PHE  64           2HE      PHE  64   1.833  -6.166  -3.207
  458    HZ   PHE  64           HZ       PHE  64  -0.154  -6.475  -1.784
  459    H    VAL  65           H        VAL  65   4.571 -13.347  -2.039
  460    HA   VAL  65           HA       VAL  65   6.218 -13.522  -4.482
  461    HB   VAL  65           HB       VAL  65   7.122 -14.175  -1.676
  462   HG11  VAL  65          1HG1      VAL  65   8.417 -14.135  -4.358
  463   HG12  VAL  65          2HG1      VAL  65   8.599 -15.281  -3.030
  464   HG13  VAL  65          3HG1      VAL  65   9.380 -13.702  -2.945
  465   HG21  VAL  65          3HG2      VAL  65   8.482 -11.968  -2.135
  466   HG22  VAL  65          1HG2      VAL  65   6.856 -11.909  -1.457
  467   HG23  VAL  65          2HG2      VAL  65   7.105 -11.601  -3.175
  468    H    SER  66           H        SER  66   5.094 -15.214  -5.461
  469    HA   SER  66           HA       SER  66   5.833 -17.831  -4.582
  470    HB2  SER  66           2HB      SER  66   3.172 -16.813  -3.893
  471    HB3  SER  66           1HB      SER  66   3.123 -18.327  -4.795
  472    HG   SER  66           HG       SER  66   3.353 -18.988  -2.753
  473    H    GLY  67           H        GLY  67   6.786 -17.577  -6.720
  474    HA2  GLY  67           2HA      GLY  67   4.854 -17.810  -8.936
  475    HA3  GLY  67           1HA      GLY  67   6.540 -17.332  -9.105
  476    H    GLU  68           H        GLU  68   7.908 -19.255  -7.789
  477    HA   GLU  68           HA       GLU  68   7.330 -21.637  -9.403
  478    HB2  GLU  68           2HB      GLU  68   9.629 -20.241  -9.232
  479    HB3  GLU  68           1HB      GLU  68   9.902 -21.399  -7.939
  480    HG2  GLU  68           2HG      GLU  68  10.729 -22.683  -9.566
  481    HG3  GLU  68           1HG      GLU  68   9.038 -23.032  -9.920
  482    H    THR  69           H        THR  69   5.862 -21.123  -6.954
  483    HA   THR  69           HA       THR  69   6.665 -23.512  -5.445
  484    HB   THR  69           HB       THR  69   7.365 -21.514  -4.184
  485    HG1  THR  69           1HG      THR  69   6.802 -22.503  -2.429
  486   HG21  THR  69          3HG2      THR  69   4.482 -20.807  -3.816
  487   HG22  THR  69          1HG2      THR  69   5.481 -20.048  -5.054
  488   HG23  THR  69          2HG2      THR  69   5.917 -19.894  -3.353
  489    H    VAL  70           H        VAL  70   4.934 -24.600  -4.332
  490    HA   VAL  70           HA       VAL  70   2.212 -23.842  -5.136
  491    HB   VAL  70           HB       VAL  70   3.246 -26.665  -5.434
  492   HG11  VAL  70          1HG1      VAL  70   0.868 -26.546  -5.042
  493   HG12  VAL  70          2HG1      VAL  70   1.166 -26.978  -6.726
  494   HG13  VAL  70          3HG1      VAL  70   0.688 -25.333  -6.310
  495   HG21  VAL  70          3HG2      VAL  70   3.028 -24.460  -7.464
  496   HG22  VAL  70          1HG2      VAL  70   2.989 -26.162  -7.923
  497   HG23  VAL  70          2HG2      VAL  70   4.406 -25.502  -7.109
  498    HA   PRO  71           HA       PRO  71   1.216 -24.781  -0.906
  499    HB2  PRO  71           2HB      PRO  71  -1.417 -25.662  -1.955
  500    HB3  PRO  71           1HB      PRO  71  -1.041 -24.423  -0.753
  501    HG2  PRO  71           2HG      PRO  71  -1.831 -23.755  -3.210
  502    HG3  PRO  71           1HG      PRO  71  -0.592 -22.814  -2.358
  503    HD2  PRO  71           2HD      PRO  71  -0.276 -24.834  -4.540
  504    HD3  PRO  71           1HD      PRO  71   0.582 -23.297  -4.294
  505    H    ALA  72           H        ALA  72   0.105 -26.602   0.396
  506    HA   ALA  72           HA       ALA  72   0.460 -29.222  -0.873
  507    HB1  ALA  72           1HB      ALA  72   1.916 -30.044   0.755
  508    HB2  ALA  72           2HB      ALA  72   1.595 -28.701   1.850
  509    HB3  ALA  72           3HB      ALA  72   2.545 -28.437   0.388
  510    HA   PRO  73           HA       PRO  73  -3.452 -29.650   1.338
  511    HB2  PRO  73           2HB      PRO  73  -4.072 -32.095   0.315
  512    HB3  PRO  73           1HB      PRO  73  -4.315 -30.590  -0.576
  513    HG2  PRO  73           2HG      PRO  73  -2.084 -32.575  -0.780
  514    HG3  PRO  73           1HG      PRO  73  -2.949 -31.726  -2.074
  515    HD2  PRO  73           2HD      PRO  73  -0.504 -30.956  -1.196
  516    HD3  PRO  73           1HD      PRO  73  -1.705 -29.804  -1.814
  517    H    SER  74           H        SER  74  -2.708 -29.871   3.449
  518    HA   SER  74           HA       SER  74  -2.174 -30.890   5.409
  519    HB2  SER  74           2HB      SER  74  -3.285 -33.283   3.927
  520    HB3  SER  74           1HB      SER  74  -2.862 -33.303   5.640
  521    HG   SER  74           HG       SER  74  -5.119 -32.818   5.116
  522    H    ALA  75           H        ALA  75  -0.075 -30.547   3.521
  523    HA   ALA  75           HA       ALA  75   1.783 -32.565   4.513
  524    HB1  ALA  75           1HB      ALA  75   1.007 -32.240   1.672
  525    HB2  ALA  75           2HB      ALA  75   1.547 -33.674   2.546
  526    HB3  ALA  75           3HB      ALA  75   2.722 -32.473   2.011
  527    H    ASN  76           H        ASN  76   4.108 -31.948   3.778
  528    HA   ASN  76           HA       ASN  76   4.413 -29.029   3.609
  529    HB2  ASN  76           2HB      ASN  76   5.612 -30.865   5.674
  530    HB3  ASN  76           1HB      ASN  76   6.380 -29.338   5.258
  531   HD21  ASN  76          1HD2      ASN  76   5.067 -30.332   7.742
  532   HD22  ASN  76          2HD2      ASN  76   3.897 -29.122   8.137
  533    H    LYS  77           H        LYS  77   6.621 -28.356   2.962
  534    HA   LYS  77           HA       LYS  77   7.615 -30.142   0.900
  535    HB2  LYS  77           2HB      LYS  77   7.918 -27.246   1.526
  536    HB3  LYS  77           1HB      LYS  77   9.198 -28.023   0.607
  537    HG2  LYS  77           2HG      LYS  77   7.221 -28.891  -0.864
  538    HG3  LYS  77           1HG      LYS  77   6.359 -27.532  -0.142
  539    HD2  LYS  77           2HD      LYS  77   7.267 -26.662  -2.120
  540    HD3  LYS  77           1HD      LYS  77   8.366 -26.111  -0.853
  541    HE2  LYS  77           2HE      LYS  77   9.064 -28.711  -2.020
  542    HE3  LYS  77           1HE      LYS  77   9.119 -27.368  -3.160
  543    HZ1  LYS  77           3HZ      LYS  77  10.890 -26.461  -2.137
  544    HZ2  LYS  77           1HZ      LYS  77  11.145 -28.035  -1.575
  545    HZ3  LYS  77           2HZ      LYS  77  10.385 -26.896  -0.583
  546    H    GLU  78           H        GLU  78   8.936 -31.698   1.636
  547    HA   GLU  78           HA       GLU  78  11.391 -30.848   2.979
  548    HB2  GLU  78           2HB      GLU  78   9.470 -32.926   3.998
  549    HB3  GLU  78           1HB      GLU  78  11.179 -32.996   4.402
  550    HG2  GLU  78           2HG      GLU  78  10.659 -30.434   5.027
  551    HG3  GLU  78           1HG      GLU  78   9.083 -31.156   5.341
  552    H    LEU  79           H        LEU  79  10.963 -31.517   0.262
  553    HA   LEU  79           HA       LEU  79  12.372 -34.096   0.055
  554    HB2  LEU  79           2HB      LEU  79  11.544 -34.135  -2.310
  555    HB3  LEU  79           1HB      LEU  79  10.302 -34.296  -1.084
  556    HG   LEU  79           HG       LEU  79  10.833 -31.567  -2.142
  557   HD11  LEU  79          1HD1      LEU  79   9.448 -33.744  -3.693
  558   HD12  LEU  79          2HD1      LEU  79  10.837 -32.782  -4.194
  559   HD13  LEU  79          3HD1      LEU  79   9.255 -32.022  -4.023
  560   HD21  LEU  79          3HD2      LEU  79   8.760 -31.125  -1.371
  561   HD22  LEU  79          1HD2      LEU  79   9.038 -32.564  -0.391
  562   HD23  LEU  79          2HD2      LEU  79   8.116 -32.682  -1.890
  563    H    VAL  80           H        VAL  80  13.689 -31.626   0.650
  564    HA   VAL  80           HA       VAL  80  15.159 -31.080  -1.842
  565    HB   VAL  80           HB       VAL  80  15.131 -29.406   0.677
  566   HG11  VAL  80          1HG1      VAL  80  16.108 -27.677  -0.782
  567   HG12  VAL  80          2HG1      VAL  80  16.176 -28.850  -2.097
  568   HG13  VAL  80          3HG1      VAL  80  17.139 -29.102  -0.641
  569   HG21  VAL  80          3HG2      VAL  80  13.838 -28.355  -1.746
  570   HG22  VAL  80          1HG2      VAL  80  13.357 -28.231  -0.054
  571   HG23  VAL  80          2HG2      VAL  80  12.993 -29.694  -0.969
  572    H    LYS  81           H        LYS  81  17.345 -31.407  -1.948
  573    HA   LYS  81           HA       LYS  81  18.526 -33.006   0.166
  574    HB2  LYS  81           2HB      LYS  81  20.473 -33.159  -1.449
  575    HB3  LYS  81           1HB      LYS  81  18.955 -33.847  -2.005
  576    HG2  LYS  81           2HG      LYS  81  18.733 -32.349  -3.676
  577    HG3  LYS  81           1HG      LYS  81  19.435 -31.031  -2.738
  578    HD2  LYS  81           2HD      LYS  81  21.258 -33.235  -3.500
  579    HD3  LYS  81           1HD      LYS  81  20.685 -32.198  -4.808
  580    HE2  LYS  81           2HE      LYS  81  22.004 -31.224  -2.275
  581    HE3  LYS  81           1HE      LYS  81  22.820 -31.428  -3.824
  582    HZ1  LYS  81           3HZ      LYS  81  22.275 -29.259  -4.015
  583    HZ2  LYS  81           1HZ      LYS  81  20.950 -29.365  -2.968
  584    HZ3  LYS  81           2HZ      LYS  81  20.806 -29.885  -4.571
  585    H    LEU  82           H        LEU  82  19.542 -32.096   1.817
  586    HA   LEU  82           HA       LEU  82  21.214 -29.726   1.317
  587    HB2  LEU  82           2HB      LEU  82  18.891 -29.467   2.594
  588    HB3  LEU  82           1HB      LEU  82  19.861 -29.997   3.954
  589    HG   LEU  82           HG       LEU  82  21.472 -28.064   3.119
  590   HD11  LEU  82          1HD1      LEU  82  20.362 -27.316   1.198
  591   HD12  LEU  82          2HD1      LEU  82  19.961 -26.124   2.434
  592   HD13  LEU  82          3HD1      LEU  82  18.785 -27.357   1.984
  593   HD21  LEU  82          3HD2      LEU  82  20.073 -28.395   5.291
  594   HD22  LEU  82          1HD2      LEU  82  19.010 -27.187   4.568
  595   HD23  LEU  82          2HD2      LEU  82  20.699 -26.795   4.886
  596    H    GLU  83           H        GLU  83  22.006 -32.494   1.417
  597    HA   GLU  83           HA       GLU  83  23.819 -32.368   3.728
  598    HB2  GLU  83           2HB      GLU  83  21.800 -34.110   3.766
  599    HB3  GLU  83           1HB      GLU  83  22.920 -35.053   2.794
  600    HG2  GLU  83           2HG      GLU  83  23.676 -35.792   4.758
  601    HG3  GLU  83           1HG      GLU  83  24.529 -34.252   4.830
  602    H    HIS  84           H        HIS  84  23.201 -34.046   0.636
  603    HA   HIS  84           HA       HIS  84  26.021 -33.668  -0.058
  604    HB2  HIS  84           2HB      HIS  84  25.410 -36.040   0.866
  605    HB3  HIS  84           1HB      HIS  84  24.691 -36.274  -0.723
  606    HD1  HIS  84           1HD      HIS  84  27.965 -34.505   0.025
  607    HD2  HIS  84           2HD      HIS  84  26.541 -37.928  -1.852
  608    HE1  HIS  84           1HE      HIS  84  29.961 -35.533  -1.102
  609    HE2  HIS  84           2HE      HIS  84  29.097 -37.660  -2.139
  Start of MODEL   11
    1    H1   MET   1           1HT      MET   1  14.180   1.913  19.172
    2    H2   MET   1           2HT      MET   1  12.725   1.823  18.267
    3    H3   MET   1           3HT      MET   1  13.962   2.917  17.802
    4    HA   MET   1           HA       MET   1  15.421   0.920  17.549
    5    HB2  MET   1           2HB      MET   1  12.731  -0.455  17.397
    6    HB3  MET   1           1HB      MET   1  14.315  -1.198  17.235
    7    HG2  MET   1           2HG      MET   1  14.540  -0.122  19.696
    8    HG3  MET   1           1HG      MET   1  12.807  -0.442  19.646
    9    HE1  MET   1           2HE      MET   1  15.446  -1.708  21.399
   10    HE2  MET   1           3HE      MET   1  14.820  -3.332  21.685
   11    HE3  MET   1           1HE      MET   1  13.771  -1.931  21.902
   12    H    ALA   2           H        ALA   2  12.132   1.186  16.147
   13    HA   ALA   2           HA       ALA   2  13.170   1.058  13.463
   14    HB1  ALA   2           1HB      ALA   2  10.444   1.274  14.667
   15    HB2  ALA   2           2HB      ALA   2  11.106   0.040  13.594
   16    HB3  ALA   2           3HB      ALA   2  10.675   1.626  12.954
   17    H    VAL   3           H        VAL   3  12.785   2.699  11.834
   18    HA   VAL   3           HA       VAL   3  12.761   5.431  12.947
   19    HB   VAL   3           HB       VAL   3  14.257   4.632  10.450
   20   HG11  VAL   3          1HG1      VAL   3  14.844   6.776  10.286
   21   HG12  VAL   3          2HG1      VAL   3  15.243   6.881  12.000
   22   HG13  VAL   3          3HG1      VAL   3  13.578   7.110  11.468
   23   HG21  VAL   3          3HG2      VAL   3  16.276   4.453  11.696
   24   HG22  VAL   3          1HG2      VAL   3  15.093   3.407  12.479
   25   HG23  VAL   3          2HG2      VAL   3  15.482   4.977  13.180
   26    H    PHE   4           H        PHE   4  10.483   3.887  11.960
   27    HA   PHE   4           HA       PHE   4   9.770   5.399   9.531
   28    HB2  PHE   4           2HB      PHE   4   9.085   2.677  10.523
   29    HB3  PHE   4           1HB      PHE   4   7.833   3.548   9.646
   30    HD1  PHE   4           1HD      PHE   4  11.526   3.455   9.113
   31    HD2  PHE   4           2HD      PHE   4   7.660   2.521   7.598
   32    HE1  PHE   4           1HE      PHE   4  12.534   2.749   6.983
   33    HE2  PHE   4           2HE      PHE   4   8.659   1.816   5.467
   34    HZ   PHE   4           HZ       PHE   4  11.100   1.927   5.156
   35    H    HIS   5           H        HIS   5   7.245   5.674   9.409
   36    HA   HIS   5           HA       HIS   5   6.507   7.249  11.726
   37    HB2  HIS   5           2HB      HIS   5   6.087   7.665   9.101
   38    HB3  HIS   5           1HB      HIS   5   4.574   6.862   9.498
   39    HD1  HIS   5           1HD      HIS   5   3.100   8.914   9.260
   40    HD2  HIS   5           2HD      HIS   5   6.231   9.452  11.940
   41    HE1  HIS   5           1HE      HIS   5   2.615  11.084  10.434
   42    HE2  HIS   5           2HE      HIS   5   4.463  11.330  12.128
   43    H    ASP   6           H        ASP   6   4.804   4.740   9.829
   44    HA   ASP   6           HA       ASP   6   4.042   3.270  12.155
   45    HB2  ASP   6           2HB      ASP   6   2.178   5.289  11.055
   46    HB3  ASP   6           1HB      ASP   6   1.481   3.700  11.350
   47    H    GLU   7           H        GLU   7   3.405   1.209  11.639
   48    HA   GLU   7           HA       GLU   7   3.523   0.489   8.815
   49    HB2  GLU   7           2HB      GLU   7   3.269  -1.373  11.181
   50    HB3  GLU   7           1HB      GLU   7   3.763  -1.787   9.549
   51    HG2  GLU   7           2HG      GLU   7   5.841  -1.626  10.310
   52    HG3  GLU   7           1HG      GLU   7   5.596   0.118  10.252
   53    H    VAL   8           H        VAL   8   1.818  -0.174   7.620
   54    HA   VAL   8           HA       VAL   8  -0.720  -0.754   8.989
   55    HB   VAL   8           HB       VAL   8  -0.550   0.943   6.496
   56   HG11  VAL   8          1HG1      VAL   8  -2.623  -0.468   7.028
   57   HG12  VAL   8          2HG1      VAL   8  -2.859   1.245   6.688
   58   HG13  VAL   8          3HG1      VAL   8  -2.890   0.666   8.353
   59   HG21  VAL   8          3HG2      VAL   8   0.418   2.061   8.527
   60   HG22  VAL   8          1HG2      VAL   8  -1.171   1.916   9.278
   61   HG23  VAL   8          2HG2      VAL   8  -0.973   2.880   7.815
   62    H    GLU   9           H        GLU   9  -1.990  -2.311   8.054
   63    HA   GLU   9           HA       GLU   9  -0.746  -4.176   6.320
   64    HB2  GLU   9           2HB      GLU   9  -3.589  -3.914   7.301
   65    HB3  GLU   9           1HB      GLU   9  -3.052  -5.237   6.276
   66    HG2  GLU   9           2HG      GLU   9  -1.457  -5.932   7.977
   67    HG3  GLU   9           1HG      GLU   9  -1.946  -4.582   9.000
   68    H    ILE  10           H        ILE  10  -1.013  -4.595   4.179
   69    HA   ILE  10           HA       ILE  10  -1.546  -2.534   2.405
   70    HB   ILE  10           HB       ILE  10  -0.244  -4.567   1.859
   71   HG12  ILE  10          2HG1      ILE  10  -1.285  -4.871  -0.481
   72   HG13  ILE  10          1HG1      ILE  10  -2.480  -3.690   0.045
   73   HG21  ILE  10          1HG2      ILE  10  -1.823  -6.200   2.849
   74   HG22  ILE  10          2HG2      ILE  10  -1.314  -6.616   1.213
   75   HG23  ILE  10          3HG2      ILE  10  -2.911  -5.922   1.488
   76   HD11  ILE  10          3HD1      ILE  10   0.414  -3.051   0.319
   77   HD12  ILE  10          1HD1      ILE  10  -0.963  -1.975   0.083
   78   HD13  ILE  10          2HD1      ILE  10  -0.360  -2.942  -1.262
   79    H    GLU  11           H        GLU  11  -3.753  -4.879   3.794
   80    HA   GLU  11           HA       GLU  11  -5.913  -4.624   2.028
   81    HB2  GLU  11           2HB      GLU  11  -5.633  -6.293   3.921
   82    HB3  GLU  11           1HB      GLU  11  -6.142  -5.015   5.013
   83    HG2  GLU  11           2HG      GLU  11  -8.264  -4.847   3.723
   84    HG3  GLU  11           1HG      GLU  11  -7.752  -6.254   2.794
   85    H    ASP  12           H        ASP  12  -4.842  -2.590   4.694
   86    HA   ASP  12           HA       ASP  12  -7.193  -0.972   4.795
   87    HB2  ASP  12           2HB      ASP  12  -5.193  -1.333   6.527
   88    HB3  ASP  12           1HB      ASP  12  -4.575   0.106   5.723
   89    H    PHE  13           H        PHE  13  -4.247  -0.919   2.925
   90    HA   PHE  13           HA       PHE  13  -4.325   1.780   2.080
   91    HB2  PHE  13           2HB      PHE  13  -3.033  -0.709   0.989
   92    HB3  PHE  13           1HB      PHE  13  -2.964   0.802   0.093
   93    HD1  PHE  13           2HD      PHE  13  -2.231  -0.598   3.470
   94    HD2  PHE  13           1HD      PHE  13  -1.234   2.274   0.491
   95    HE1  PHE  13           2HE      PHE  13  -0.269   0.085   4.788
   96    HE2  PHE  13           1HE      PHE  13   0.730   2.959   1.802
   97    HZ   PHE  13           HZ       PHE  13   1.214   1.866   3.955
   98    H    GLN  14           H        GLN  14  -4.603   2.363  -0.307
   99    HA   GLN  14           HA       GLN  14  -7.163   1.246  -1.219
  100    HB2  GLN  14           2HB      GLN  14  -5.918   3.935  -1.331
  101    HB3  GLN  14           1HB      GLN  14  -6.876   3.463  -2.728
  102    HG2  GLN  14           2HG      GLN  14  -8.828   3.215  -1.439
  103    HG3  GLN  14           1HG      GLN  14  -7.927   3.258   0.074
  104   HE21  GLN  14          1HE2      GLN  14  -9.394   4.919   0.741
  105   HE22  GLN  14          2HE2      GLN  14  -9.159   6.549   0.216
  106    H    TYR  15           H        TYR  15  -6.902  -0.316  -2.690
  107    HA   TYR  15           HA       TYR  15  -4.617  -0.608  -4.330
  108    HB2  TYR  15           2HB      TYR  15  -6.014  -2.525  -3.730
  109    HB3  TYR  15           1HB      TYR  15  -7.368  -1.839  -4.620
  110    HD1  TYR  15           1HD      TYR  15  -3.798  -2.804  -5.205
  111    HD2  TYR  15           2HD      TYR  15  -7.759  -2.647  -6.748
  112    HE1  TYR  15           1HE      TYR  15  -3.047  -3.980  -7.225
  113    HE2  TYR  15           2HE      TYR  15  -7.020  -3.824  -8.776
  114    HH   TYR  15           HH       TYR  15  -3.729  -4.285  -9.549
  115    H    ASP  16           H        ASP  16  -4.100   0.266  -6.220
  116    HA   ASP  16           HA       ASP  16  -6.105   1.923  -7.581
  117    HB2  ASP  16           2HB      ASP  16  -3.802   2.806  -6.723
  118    HB3  ASP  16           1HB      ASP  16  -3.162   2.028  -8.165
  119    H    GLU  17           H        GLU  17  -7.143   0.465  -8.885
  120    HA   GLU  17           HA       GLU  17  -5.995  -1.617 -10.346
  121    HB2  GLU  17           2HB      GLU  17  -8.032  -1.298 -11.877
  122    HB3  GLU  17           1HB      GLU  17  -8.327  -1.683 -10.188
  123    HG2  GLU  17           2HG      GLU  17  -9.284   0.316  -9.756
  124    HG3  GLU  17           1HG      GLU  17  -8.232   1.187 -10.870
  125    H    ASP  18           H        ASP  18  -6.048   1.793 -10.984
  126    HA   ASP  18           HA       ASP  18  -5.744   2.016 -13.688
  127    HB2  ASP  18           2HB      ASP  18  -5.571   3.763 -11.648
  128    HB3  ASP  18           1HB      ASP  18  -3.864   3.641 -12.062
  129    H    SER  19           H        SER  19  -3.084   1.452 -11.357
  130    HA   SER  19           HA       SER  19  -1.646  -0.040 -13.389
  131    HB2  SER  19           2HB      SER  19  -1.071   2.488 -13.560
  132    HB3  SER  19           1HB      SER  19  -0.157   2.221 -12.076
  133    HG   SER  19           HG       SER  19   1.293   1.803 -13.625
  134    H    GLU  20           H        GLU  20  -2.839  -0.709 -10.842
  135    HA   GLU  20           HA       GLU  20  -2.425  -1.832  -8.910
  136    HB2  GLU  20           2HB      GLU  20   0.203  -2.585 -10.180
  137    HB3  GLU  20           1HB      GLU  20  -0.727  -3.504  -9.004
  138    HG2  GLU  20           2HG      GLU  20  -2.549  -3.434 -10.908
  139    HG3  GLU  20           1HG      GLU  20  -1.132  -3.191 -11.928
  140    H    THR  21           H        THR  21  -2.210   0.304  -7.844
  141    HA   THR  21           HA       THR  21   0.400   0.490  -6.519
  142    HB   THR  21           HB       THR  21  -1.111   2.947  -7.425
  143    HG1  THR  21           1HG      THR  21   0.095   3.003  -9.188
  144   HG21  THR  21          3HG2      THR  21   1.708   2.607  -6.427
  145   HG22  THR  21          1HG2      THR  21   0.372   3.346  -5.545
  146   HG23  THR  21          2HG2      THR  21   0.991   4.109  -7.009
  147    H    TYR  22           H        TYR  22   0.332   1.363  -4.388
  148    HA   TYR  22           HA       TYR  22  -2.379   1.544  -3.235
  149    HB2  TYR  22           2HB      TYR  22   0.071   0.390  -1.882
  150    HB3  TYR  22           1HB      TYR  22  -1.552   0.476  -1.207
  151    HD1  TYR  22           1HD      TYR  22   0.533  -1.138  -3.791
  152    HD2  TYR  22           2HD      TYR  22  -3.204  -1.158  -1.756
  153    HE1  TYR  22           1HE      TYR  22   0.025  -3.340  -4.755
  154    HE2  TYR  22           2HE      TYR  22  -3.719  -3.362  -2.714
  155    HH   TYR  22           HH       TYR  22  -1.959  -5.402  -3.690
  156    H    PHE  23           H        PHE  23  -2.796   3.215  -1.855
  157    HA   PHE  23           HA       PHE  23  -0.551   4.988  -1.146
  158    HB2  PHE  23           2HB      PHE  23  -3.279   5.958  -2.022
  159    HB3  PHE  23           1HB      PHE  23  -1.863   6.942  -1.676
  160    HD1  PHE  23           1HD      PHE  23  -3.120   4.314  -3.987
  161    HD2  PHE  23           2HD      PHE  23  -0.407   7.539  -3.387
  162    HE1  PHE  23           1HE      PHE  23  -2.481   4.214  -6.359
  163    HE2  PHE  23           2HE      PHE  23   0.236   7.443  -5.759
  164    HZ   PHE  23           HZ       PHE  23  -0.801   5.779  -7.250
  165    H    TYR  24           H        TYR  24  -0.925   6.376   0.709
  166    HA   TYR  24           HA       TYR  24  -3.163   5.622   2.436
  167    HB2  TYR  24           2HB      TYR  24  -1.080   4.212   2.939
  168    HB3  TYR  24           1HB      TYR  24  -0.366   5.699   3.556
  169    HD1  TYR  24           2HD      TYR  24  -2.941   3.136   4.114
  170    HD2  TYR  24           1HD      TYR  24  -1.143   6.688   5.627
  171    HE1  TYR  24           2HE      TYR  24  -4.035   2.763   6.281
  172    HE2  TYR  24           1HE      TYR  24  -2.233   6.320   7.798
  173    HH   TYR  24           HH       TYR  24  -4.722   4.623   8.345
  174    HA   PRO  25           HA       PRO  25  -3.376  10.018   3.024
  175    HB2  PRO  25           2HB      PRO  25  -4.582   9.316   5.642
  176    HB3  PRO  25           1HB      PRO  25  -5.224  10.316   4.336
  177    HG2  PRO  25           2HG      PRO  25  -6.181   7.867   4.781
  178    HG3  PRO  25           1HG      PRO  25  -5.987   8.491   3.133
  179    HD2  PRO  25           2HD      PRO  25  -4.282   6.548   4.638
  180    HD3  PRO  25           1HD      PRO  25  -4.751   6.550   2.925
  181    H    CYS  26           H        CYS  26  -1.833  11.354   3.684
  182    HA   CYS  26           HA       CYS  26  -0.211  10.623   6.019
  183    HB2  CYS  26           2HB      CYS  26   0.716  11.177   3.605
  184    HB3  CYS  26           1HB      CYS  26   0.551  12.840   4.164
  185    HA   PRO  27           HA       PRO  27  -2.087  13.951   8.285
  186    HB2  PRO  27           2HB      PRO  27  -0.327  14.124  10.329
  187    HB3  PRO  27           1HB      PRO  27  -1.473  12.788  10.171
  188    HG2  PRO  27           2HG      PRO  27   1.431  12.889   9.455
  189    HG3  PRO  27           1HG      PRO  27   0.521  11.597  10.257
  190    HD2  PRO  27           2HD      PRO  27   1.168  11.550   7.614
  191    HD3  PRO  27           1HD      PRO  27  -0.280  10.762   8.274
  192    H    CYS  28           H        CYS  28  -1.079  15.093   6.157
  193    HA   CYS  28           HA       CYS  28   0.115  17.518   7.153
  194    HB2  CYS  28           2HB      CYS  28   2.036  17.528   5.645
  195    HB3  CYS  28           1HB      CYS  28   2.116  16.144   6.727
  196    H    GLY  29           H        GLY  29  -0.740  15.671   4.221
  197    HA2  GLY  29           2HA      GLY  29  -2.749  17.343   3.331
  198    HA3  GLY  29           1HA      GLY  29  -1.268  17.974   2.629
  199    H    ASP  30           H        ASP  30   0.154  15.811   1.930
  200    HA   ASP  30           HA       ASP  30  -1.428  14.698  -0.242
  201    HB2  ASP  30           2HB      ASP  30   1.413  15.200   0.291
  202    HB3  ASP  30           1HB      ASP  30   1.117  13.666  -0.517
  203    H    ASN  31           H        ASN  31  -0.568  12.283  -0.814
  204    HA   ASN  31           HA       ASN  31  -0.839  10.673   1.643
  205    HB2  ASN  31           2HB      ASN  31  -2.175  10.118  -1.017
  206    HB3  ASN  31           1HB      ASN  31  -2.251   9.083   0.404
  207   HD21  ASN  31          1HD2      ASN  31  -4.350   9.168   0.921
  208   HD22  ASN  31          2HD2      ASN  31  -5.225  10.616   1.271
  209    H    PHE  32           H        PHE  32   0.330   8.791   1.769
  210    HA   PHE  32           HA       PHE  32   2.742   8.571   0.358
  211    HB2  PHE  32           2HB      PHE  32   1.223   6.520   1.978
  212    HB3  PHE  32           1HB      PHE  32   2.849   6.261   1.363
  213    HD1  PHE  32           1HD      PHE  32   4.687   7.808   2.140
  214    HD2  PHE  32           2HD      PHE  32   0.858   7.655   3.991
  215    HE1  PHE  32           1HE      PHE  32   5.623   8.860   4.153
  216    HE2  PHE  32           2HE      PHE  32   1.788   8.708   6.009
  217    HZ   PHE  32           HZ       PHE  32   4.174   9.310   6.094
  218    H    SER  33           H        SER  33   3.447   6.577  -0.880
  219    HA   SER  33           HA       SER  33   1.374   5.289  -2.455
  220    HB2  SER  33           2HB      SER  33   2.425   5.955  -4.617
  221    HB3  SER  33           1HB      SER  33   1.715   7.312  -3.746
  222    HG   SER  33           HG       SER  33   4.348   6.795  -4.368
  223    H    ILE  34           H        ILE  34   1.947   3.313  -3.214
  224    HA   ILE  34           HA       ILE  34   4.728   2.510  -3.377
  225    HB   ILE  34           HB       ILE  34   4.231   2.104  -1.008
  226   HG12  ILE  34          2HG1      ILE  34   4.240  -0.677  -1.974
  227   HG13  ILE  34          1HG1      ILE  34   5.411   0.367  -2.772
  228   HG21  ILE  34          1HG2      ILE  34   2.285  -0.043  -1.664
  229   HG22  ILE  34          2HG2      ILE  34   1.717   1.625  -1.658
  230   HG23  ILE  34          3HG2      ILE  34   2.444   0.937  -0.207
  231   HD11  ILE  34          3HD1      ILE  34   5.664  -0.916  -0.308
  232   HD12  ILE  34          1HD1      ILE  34   5.485   0.799   0.059
  233   HD13  ILE  34          2HD1      ILE  34   6.762   0.259  -1.030
  234    H    THR  35           H        THR  35   4.957   1.262  -5.130
  235    HA   THR  35           HA       THR  35   2.686   0.358  -6.606
  236    HB   THR  35           HB       THR  35   4.306  -0.560  -8.191
  237    HG1  THR  35           1HG      THR  35   6.364   0.256  -6.434
  238   HG21  THR  35          3HG2      THR  35   5.717   1.924  -7.496
  239   HG22  THR  35          1HG2      THR  35   3.977   2.065  -7.746
  240   HG23  THR  35          2HG2      THR  35   5.001   1.403  -9.022
  241    H    LYS  36           H        LYS  36   2.067  -1.761  -7.127
  242    HA   LYS  36           HA       LYS  36   2.043  -3.593  -5.001
  243    HB2  LYS  36           2HB      LYS  36   0.409  -3.405  -6.962
  244    HB3  LYS  36           1HB      LYS  36   1.579  -4.336  -7.887
  245    HG2  LYS  36           2HG      LYS  36   0.695  -5.420  -5.267
  246    HG3  LYS  36           1HG      LYS  36  -0.432  -5.484  -6.625
  247    HD2  LYS  36           2HD      LYS  36   2.398  -6.524  -6.738
  248    HD3  LYS  36           1HD      LYS  36   1.000  -7.525  -6.342
  249    HE2  LYS  36           2HE      LYS  36   0.772  -5.916  -8.803
  250    HE3  LYS  36           1HE      LYS  36   1.975  -7.204  -8.840
  251    HZ1  LYS  36           3HZ      LYS  36  -0.908  -7.520  -8.200
  252    HZ2  LYS  36           1HZ      LYS  36   0.237  -8.766  -8.161
  253    HZ3  LYS  36           2HZ      LYS  36  -0.141  -8.008  -9.626
  254    H    GLU  37           H        GLU  37   4.060  -3.405  -7.900
  255    HA   GLU  37           HA       GLU  37   5.336  -5.894  -7.669
  256    HB2  GLU  37           2HB      GLU  37   5.384  -4.115  -9.584
  257    HB3  GLU  37           1HB      GLU  37   6.782  -3.491  -8.721
  258    HG2  GLU  37           2HG      GLU  37   7.900  -5.633  -8.923
  259    HG3  GLU  37           1HG      GLU  37   6.486  -6.313  -9.729
  260    H    ASP  38           H        ASP  38   6.066  -2.756  -6.207
  261    HA   ASP  38           HA       ASP  38   8.601  -3.295  -5.179
  262    HB2  ASP  38           2HB      ASP  38   6.399  -1.424  -4.491
  263    HB3  ASP  38           1HB      ASP  38   7.592  -1.716  -3.232
  264    H    LEU  39           H        LEU  39   5.399  -3.940  -3.806
  265    HA   LEU  39           HA       LEU  39   6.252  -4.956  -1.329
  266    HB2  LEU  39           2HB      LEU  39   3.791  -5.815  -2.843
  267    HB3  LEU  39           1HB      LEU  39   4.046  -5.884  -1.111
  268    HG   LEU  39           HG       LEU  39   3.891  -3.315  -2.689
  269   HD11  LEU  39          1HD1      LEU  39   1.780  -4.589  -2.760
  270   HD12  LEU  39          2HD1      LEU  39   1.642  -3.081  -1.858
  271   HD13  LEU  39          3HD1      LEU  39   1.763  -4.616  -0.997
  272   HD21  LEU  39          3HD2      LEU  39   3.453  -3.574   0.253
  273   HD22  LEU  39          1HD2      LEU  39   4.000  -2.186  -0.687
  274   HD23  LEU  39          2HD2      LEU  39   5.099  -3.529  -0.377
  275    H    GLU  40           H        GLU  40   5.674  -6.557  -4.449
  276    HA   GLU  40           HA       GLU  40   6.109  -9.199  -3.506
  277    HB2  GLU  40           2HB      GLU  40   6.130  -7.942  -6.235
  278    HB3  GLU  40           1HB      GLU  40   6.592  -9.624  -6.013
  279    HG2  GLU  40           2HG      GLU  40   4.371  -9.970  -4.885
  280    HG3  GLU  40           1HG      GLU  40   3.934  -8.352  -5.430
  281    H    ASN  41           H        ASN  41   8.278  -6.655  -4.527
  282    HA   ASN  41           HA       ASN  41  10.542  -8.444  -4.795
  283    HB2  ASN  41           2HB      ASN  41  10.045  -5.545  -5.246
  284    HB3  ASN  41           1HB      ASN  41  11.696  -6.031  -4.875
  285   HD21  ASN  41          1HD2      ASN  41  12.752  -7.502  -6.277
  286   HD22  ASN  41          2HD2      ASN  41  12.250  -7.668  -7.921
  287    H    GLY  42           H        GLY  42   9.372  -6.024  -2.475
  288    HA2  GLY  42           2HA      GLY  42  10.059  -6.910  -0.121
  289    HA3  GLY  42           1HA      GLY  42  11.671  -6.571  -0.734
  290    H    GLU  43           H        GLU  43  10.153  -4.242  -2.253
  291    HA   GLU  43           HA       GLU  43  10.896  -2.209  -0.410
  292    HB2  GLU  43           2HB      GLU  43   9.531  -2.200  -3.091
  293    HB3  GLU  43           1HB      GLU  43   9.689  -0.723  -2.154
  294    HG2  GLU  43           2HG      GLU  43  11.941  -2.461  -3.135
  295    HG3  GLU  43           1HG      GLU  43  11.457  -0.897  -3.791
  296    H    ASP  44           H        ASP  44   9.594  -2.785   1.416
  297    HA   ASP  44           HA       ASP  44   6.717  -2.301   1.181
  298    HB2  ASP  44           2HB      ASP  44   6.696  -3.092   3.597
  299    HB3  ASP  44           1HB      ASP  44   7.170  -4.286   2.394
  300    H    VAL  45           H        VAL  45   8.354  -0.061   0.824
  301    HA   VAL  45           HA       VAL  45   7.622   1.521   3.189
  302    HB   VAL  45           HB       VAL  45  10.037   1.211   3.244
  303   HG11  VAL  45          1HG1      VAL  45  10.516   2.785   0.788
  304   HG12  VAL  45          2HG1      VAL  45  10.008   1.111   0.568
  305   HG13  VAL  45          3HG1      VAL  45  11.457   1.477   1.502
  306   HG21  VAL  45          3HG2      VAL  45   9.433   4.025   2.357
  307   HG22  VAL  45          1HG2      VAL  45  10.679   3.492   3.485
  308   HG23  VAL  45          2HG2      VAL  45   8.978   3.376   3.931
  309    H    ALA  46           H        ALA  46   6.418   3.261   2.770
  310    HA   ALA  46           HA       ALA  46   6.209   4.149  -0.032
  311    HB1  ALA  46           1HB      ALA  46   3.961   4.402   0.182
  312    HB2  ALA  46           2HB      ALA  46   4.057   4.816   1.894
  313    HB3  ALA  46           3HB      ALA  46   4.197   3.133   1.384
  314    H    THR  47           H        THR  47   6.357   6.304  -0.524
  315    HA   THR  47           HA       THR  47   7.034   8.113   1.702
  316    HB   THR  47           HB       THR  47   8.074   8.580  -1.070
  317    HG1  THR  47           1HG      THR  47   9.728   7.203  -0.778
  318   HG21  THR  47          3HG2      THR  47   9.759   8.964   1.310
  319   HG22  THR  47          1HG2      THR  47   8.368  10.035   1.163
  320   HG23  THR  47          2HG2      THR  47   9.567   9.967  -0.128
  321    H    CYS  48           H        CYS  48   5.960   9.990   1.861
  322    HA   CYS  48           HA       CYS  48   3.674  10.444   0.201
  323    HB2  CYS  48           2HB      CYS  48   3.673  10.965   2.616
  324    HB3  CYS  48           1HB      CYS  48   4.885  12.211   2.342
  325    HA   PRO  49           HA       PRO  49   5.754  13.051  -2.756
  326    HB2  PRO  49           2HB      PRO  49   3.624  13.756  -4.230
  327    HB3  PRO  49           1HB      PRO  49   4.260  12.106  -4.243
  328    HG2  PRO  49           2HG      PRO  49   1.895  13.216  -2.789
  329    HG3  PRO  49           1HG      PRO  49   2.063  11.668  -3.637
  330    HD2  PRO  49           2HD      PRO  49   2.273  11.982  -0.909
  331    HD3  PRO  49           1HD      PRO  49   3.007  10.650  -1.823
  332    H    SER  50           H        SER  50   5.599  14.342  -0.375
  333    HA   SER  50           HA       SER  50   5.286  17.065  -1.163
  334    HB2  SER  50           2HB      SER  50   2.940  16.616  -0.647
  335    HB3  SER  50           1HB      SER  50   3.385  15.977   0.934
  336    HG   SER  50           HG       SER  50   2.771  18.425   0.411
  337    H    CYS  51           H        CYS  51   5.288  15.045   1.781
  338    HA   CYS  51           HA       CYS  51   7.336  16.787   2.937
  339    HB2  CYS  51           2HB      CYS  51   6.835  15.660   5.055
  340    HB3  CYS  51           1HB      CYS  51   5.372  16.309   4.321
  341    H    SER  52           H        SER  52   6.946  13.633   1.552
  342    HA   SER  52           HA       SER  52   8.460  12.034   0.994
  343    HB2  SER  52           2HB      SER  52   9.999  14.149   0.798
  344    HB3  SER  52           1HB      SER  52  10.707  13.542   2.295
  345    HG   SER  52           HG       SER  52  11.839  12.339   0.991
  346    H    LEU  53           H        LEU  53   6.964  11.819   3.306
  347    HA   LEU  53           HA       LEU  53   8.596  11.019   5.531
  348    HB2  LEU  53           2HB      LEU  53   5.800  11.459   4.987
  349    HB3  LEU  53           1HB      LEU  53   6.013   9.917   5.790
  350    HG   LEU  53           HG       LEU  53   7.156  11.014   7.650
  351   HD11  LEU  53          1HD1      LEU  53   7.891  13.130   7.643
  352   HD12  LEU  53          2HD1      LEU  53   6.430  13.738   6.866
  353   HD13  LEU  53          3HD1      LEU  53   7.717  13.027   5.892
  354   HD21  LEU  53          3HD2      LEU  53   4.539  12.342   6.959
  355   HD22  LEU  53          1HD2      LEU  53   5.236  12.179   8.571
  356   HD23  LEU  53          2HD2      LEU  53   4.718  10.745   7.685
  357    H    ILE  54           H        ILE  54   7.702   8.683   6.473
  358    HA   ILE  54           HA       ILE  54   7.926   6.714   4.311
  359    HB   ILE  54           HB       ILE  54   9.512   5.382   5.784
  360   HG12  ILE  54          2HG1      ILE  54   9.806   8.091   7.107
  361   HG13  ILE  54          1HG1      ILE  54   9.219   6.616   7.866
  362   HG21  ILE  54          1HG2      ILE  54  10.935   7.853   4.968
  363   HG22  ILE  54          2HG2      ILE  54  10.004   7.006   3.733
  364   HG23  ILE  54          3HG2      ILE  54  11.288   6.164   4.602
  365   HD11  ILE  54          3HD1      ILE  54  11.966   6.771   6.688
  366   HD12  ILE  54          1HD1      ILE  54  11.337   5.651   7.895
  367   HD13  ILE  54          2HD1      ILE  54  11.623   7.338   8.323
  368    H    ILE  55           H        ILE  55   6.919   4.763   4.680
  369    HA   ILE  55           HA       ILE  55   5.776   4.196   7.300
  370    HB   ILE  55           HB       ILE  55   3.525   3.744   6.351
  371   HG12  ILE  55          2HG1      ILE  55   4.255   5.465   4.000
  372   HG13  ILE  55          1HG1      ILE  55   4.508   3.724   3.934
  373   HG21  ILE  55          1HG2      ILE  55   2.785   6.072   6.300
  374   HG22  ILE  55          2HG2      ILE  55   4.458   6.600   6.117
  375   HG23  ILE  55          3HG2      ILE  55   3.946   5.786   7.596
  376   HD11  ILE  55          3HD1      ILE  55   2.005   3.657   4.716
  377   HD12  ILE  55          1HD1      ILE  55   2.429   3.882   3.019
  378   HD13  ILE  55          2HD1      ILE  55   1.978   5.271   4.006
  379    H    LYS  56           H        LYS  56   5.243   2.010   7.620
  380    HA   LYS  56           HA       LYS  56   6.500   0.203   5.700
  381    HB2  LYS  56           2HB      LYS  56   6.601   0.300   8.438
  382    HB3  LYS  56           1HB      LYS  56   5.401  -0.957   8.167
  383    HG2  LYS  56           2HG      LYS  56   8.166  -0.930   6.971
  384    HG3  LYS  56           1HG      LYS  56   7.690  -1.826   8.415
  385    HD2  LYS  56           2HD      LYS  56   5.853  -2.820   6.842
  386    HD3  LYS  56           1HD      LYS  56   6.940  -2.291   5.558
  387    HE2  LYS  56           2HE      LYS  56   7.367  -4.613   6.150
  388    HE3  LYS  56           1HE      LYS  56   8.753  -3.599   6.546
  389    HZ1  LYS  56           3HZ      LYS  56   7.762  -5.354   8.235
  390    HZ2  LYS  56           1HZ      LYS  56   6.781  -4.040   8.654
  391    HZ3  LYS  56           2HZ      LYS  56   8.464  -3.908   8.758
  392    H    VAL  57           H        VAL  57   5.502  -1.233   4.512
  393    HA   VAL  57           HA       VAL  57   2.575  -1.351   4.703
  394    HB   VAL  57           HB       VAL  57   3.893  -2.409   2.270
  395   HG11  VAL  57          1HG1      VAL  57   1.543  -0.609   2.812
  396   HG12  VAL  57          2HG1      VAL  57   1.487  -2.339   2.473
  397   HG13  VAL  57          3HG1      VAL  57   2.008  -1.211   1.221
  398   HG21  VAL  57          3HG2      VAL  57   3.788   0.564   2.798
  399   HG22  VAL  57          1HG2      VAL  57   4.252  -0.216   1.287
  400   HG23  VAL  57          2HG2      VAL  57   5.257  -0.406   2.721
  401    H    ILE  58           H        ILE  58   1.824  -3.114   5.669
  402    HA   ILE  58           HA       ILE  58   3.400  -5.581   5.625
  403    HB   ILE  58           HB       ILE  58   0.858  -5.062   7.167
  404   HG12  ILE  58          2HG1      ILE  58   2.595  -3.429   7.802
  405   HG13  ILE  58          1HG1      ILE  58   2.268  -4.570   9.102
  406   HG21  ILE  58          1HG2      ILE  58   3.020  -7.148   7.441
  407   HG22  ILE  58          2HG2      ILE  58   1.357  -7.404   6.913
  408   HG23  ILE  58          3HG2      ILE  58   1.688  -6.920   8.576
  409   HD11  ILE  58          3HD1      ILE  58   4.734  -3.880   8.204
  410   HD12  ILE  58          1HD1      ILE  58   4.439  -5.382   7.325
  411   HD13  ILE  58          2HD1      ILE  58   4.354  -5.358   9.086
  412    H    TYR  59           H        TYR  59   2.785  -7.398   4.582
  413    HA   TYR  59           HA       TYR  59   0.084  -7.756   3.606
  414    HB2  TYR  59           2HB      TYR  59   0.986  -8.088   1.216
  415    HB3  TYR  59           1HB      TYR  59   0.804  -6.430   1.785
  416    HD1  TYR  59           1HD      TYR  59   3.207  -9.071   0.932
  417    HD2  TYR  59           2HD      TYR  59   2.731  -5.040   2.211
  418    HE1  TYR  59           1HE      TYR  59   5.577  -8.648   0.454
  419    HE2  TYR  59           2HE      TYR  59   5.101  -4.604   1.733
  420    HH   TYR  59           HH       TYR  59   7.330  -7.133   0.985
  421    H    ASP  60           H        ASP  60   0.135  -9.828   2.060
  422    HA   ASP  60           HA       ASP  60   1.318 -11.923   3.645
  423    HB2  ASP  60           2HB      ASP  60  -1.005 -11.930   2.480
  424    HB3  ASP  60           1HB      ASP  60  -0.106 -12.351   1.026
  425    H    LYS  61           H        LYS  61   3.513 -11.971   3.378
  426    HA   LYS  61           HA       LYS  61   4.875 -11.557   0.954
  427    HB2  LYS  61           2HB      LYS  61   5.618 -12.821   3.565
  428    HB3  LYS  61           1HB      LYS  61   6.703 -12.974   2.190
  429    HG2  LYS  61           2HG      LYS  61   5.718 -10.257   2.814
  430    HG3  LYS  61           1HG      LYS  61   6.861 -10.982   3.946
  431    HD2  LYS  61           2HD      LYS  61   8.038 -11.565   1.568
  432    HD3  LYS  61           1HD      LYS  61   7.271 -10.019   1.195
  433    HE2  LYS  61           2HE      LYS  61   9.212  -9.210   2.038
  434    HE3  LYS  61           1HE      LYS  61   8.342  -9.395   3.560
  435    HZ1  LYS  61           3HZ      LYS  61   9.605 -11.157   4.177
  436    HZ2  LYS  61           1HZ      LYS  61  10.746 -10.382   3.198
  437    HZ3  LYS  61           2HZ      LYS  61   9.868 -11.696   2.596
  438    H    ASP  62           H        ASP  62   3.360 -14.404   2.327
  439    HA   ASP  62           HA       ASP  62   4.622 -16.316   0.643
  440    HB2  ASP  62           2HB      ASP  62   3.124 -16.574   2.847
  441    HB3  ASP  62           1HB      ASP  62   1.868 -16.836   1.642
  442    H    GLN  63           H        GLN  63   1.797 -14.248   0.299
  443    HA   GLN  63           HA       GLN  63   0.907 -15.585  -2.109
  444    HB2  GLN  63           2HB      GLN  63   0.005 -13.053  -0.734
  445    HB3  GLN  63           1HB      GLN  63  -0.716 -13.660  -2.217
  446    HG2  GLN  63           2HG      GLN  63  -0.549 -15.442   0.167
  447    HG3  GLN  63           1HG      GLN  63  -1.788 -14.189   0.095
  448   HE21  GLN  63          1HE2      GLN  63  -3.567 -15.425  -0.170
  449   HE22  GLN  63          2HE2      GLN  63  -3.838 -16.468  -1.519
  450    H    PHE  64           H        PHE  64   2.442 -12.491  -1.273
  451    HA   PHE  64           HA       PHE  64   2.634 -11.596  -3.975
  452    HB2  PHE  64           2HB      PHE  64   3.675 -10.655  -1.341
  453    HB3  PHE  64           1HB      PHE  64   4.445 -10.046  -2.801
  454    HD1  PHE  64           2HD      PHE  64   0.944 -10.662  -1.632
  455    HD2  PHE  64           1HD      PHE  64   3.695  -8.002  -3.496
  456    HE1  PHE  64           2HE      PHE  64  -0.846  -8.994  -1.887
  457    HE2  PHE  64           1HE      PHE  64   1.910  -6.329  -3.754
  458    HZ   PHE  64           HZ       PHE  64  -0.364  -6.825  -2.951
  459    H    VAL  65           H        VAL  65   4.913 -13.153  -1.734
  460    HA   VAL  65           HA       VAL  65   6.853 -13.377  -3.935
  461    HB   VAL  65           HB       VAL  65   7.372 -13.897  -1.004
  462   HG11  VAL  65          1HG1      VAL  65   9.451 -13.161  -3.018
  463   HG12  VAL  65          2HG1      VAL  65   8.864 -14.823  -2.943
  464   HG13  VAL  65          3HG1      VAL  65   9.607 -14.084  -1.525
  465   HG21  VAL  65          3HG2      VAL  65   8.648 -11.609  -1.371
  466   HG22  VAL  65          1HG2      VAL  65   6.952 -11.658  -0.887
  467   HG23  VAL  65          2HG2      VAL  65   7.379 -11.373  -2.574
  468    H    SER  66           H        SER  66   5.768 -15.123  -4.955
  469    HA   SER  66           HA       SER  66   6.688 -17.678  -4.130
  470    HB2  SER  66           2HB      SER  66   4.649 -17.303  -2.636
  471    HB3  SER  66           1HB      SER  66   3.680 -17.426  -4.105
  472    HG   SER  66           HG       SER  66   5.059 -19.385  -2.710
  473    H    GLY  67           H        GLY  67   7.048 -16.211  -6.423
  474    HA2  GLY  67           2HA      GLY  67   5.765 -17.959  -8.407
  475    HA3  GLY  67           1HA      GLY  67   5.685 -16.219  -8.637
  476    H    GLU  68           H        GLU  68   8.130 -15.334  -7.990
  477    HA   GLU  68           HA       GLU  68   9.827 -16.609 -10.018
  478    HB2  GLU  68           2HB      GLU  68   9.064 -14.071  -9.974
  479    HB3  GLU  68           1HB      GLU  68  10.436 -13.914  -8.888
  480    HG2  GLU  68           2HG      GLU  68  11.755 -15.130 -10.733
  481    HG3  GLU  68           1HG      GLU  68  10.397 -14.701 -11.772
  482    H    THR  69           H        THR  69   9.634 -17.663  -7.315
  483    HA   THR  69           HA       THR  69  12.339 -17.075  -6.310
  484    HB   THR  69           HB       THR  69   9.998 -18.264  -4.800
  485    HG1  THR  69           1HG      THR  69  11.093 -15.646  -4.745
  486   HG21  THR  69          3HG2      THR  69  12.291 -18.863  -3.964
  487   HG22  THR  69          1HG2      THR  69  11.248 -18.019  -2.818
  488   HG23  THR  69          2HG2      THR  69  12.533 -17.145  -3.650
  489    H    VAL  70           H        VAL  70  13.206 -18.540  -7.912
  490    HA   VAL  70           HA       VAL  70  13.582 -21.170  -6.898
  491    HB   VAL  70           HB       VAL  70  11.381 -21.538  -7.907
  492   HG11  VAL  70          1HG1      VAL  70  10.873 -21.163 -10.163
  493   HG12  VAL  70          2HG1      VAL  70  12.567 -20.942 -10.598
  494   HG13  VAL  70          3HG1      VAL  70  11.733 -19.711  -9.652
  495   HG21  VAL  70          3HG2      VAL  70  12.021 -23.389  -9.480
  496   HG22  VAL  70          1HG2      VAL  70  12.824 -23.432  -7.911
  497   HG23  VAL  70          2HG2      VAL  70  13.692 -22.847  -9.329
  498    HA   PRO  71           HA       PRO  71  17.230 -20.378  -9.321
  499    HB2  PRO  71           2HB      PRO  71  18.536 -22.695  -8.870
  500    HB3  PRO  71           1HB      PRO  71  18.340 -21.466  -7.614
  501    HG2  PRO  71           2HG      PRO  71  16.801 -23.996  -8.047
  502    HG3  PRO  71           1HG      PRO  71  17.399 -23.294  -6.532
  503    HD2  PRO  71           2HD      PRO  71  14.815 -23.065  -7.394
  504    HD3  PRO  71           1HD      PRO  71  15.607 -21.875  -6.343
  505    H    ALA  72           H        ALA  72  18.149 -20.918 -11.313
  506    HA   ALA  72           HA       ALA  72  16.450 -22.323 -13.135
  507    HB1  ALA  72           1HB      ALA  72  19.241 -21.525 -13.840
  508    HB2  ALA  72           2HB      ALA  72  18.019 -20.285 -13.556
  509    HB3  ALA  72           3HB      ALA  72  17.777 -21.487 -14.824
  510    HA   PRO  73           HA       PRO  73  17.952 -26.450 -12.986
  511    HB2  PRO  73           2HB      PRO  73  18.059 -26.366 -15.958
  512    HB3  PRO  73           1HB      PRO  73  17.202 -27.480 -14.889
  513    HG2  PRO  73           2HG      PRO  73  15.885 -25.588 -16.222
  514    HG3  PRO  73           1HG      PRO  73  15.434 -26.019 -14.562
  515    HD2  PRO  73           2HD      PRO  73  16.961 -23.649 -15.557
  516    HD3  PRO  73           1HD      PRO  73  15.755 -23.752 -14.257
  517    H    SER  74           H        SER  74  20.006 -25.890 -12.109
  518    HA   SER  74           HA       SER  74  22.261 -25.989 -11.990
  519    HB2  SER  74           2HB      SER  74  21.931 -27.298 -14.695
  520    HB3  SER  74           1HB      SER  74  23.471 -27.188 -13.842
  521    HG   SER  74           HG       SER  74  21.411 -28.898 -13.450
  522    H    ALA  75           H        ALA  75  22.921 -23.912 -11.892
  523    HA   ALA  75           HA       ALA  75  23.522 -22.550 -14.441
  524    HB1  ALA  75           1HB      ALA  75  21.752 -21.637 -12.665
  525    HB2  ALA  75           2HB      ALA  75  22.763 -20.565 -13.635
  526    HB3  ALA  75           3HB      ALA  75  23.217 -20.938 -11.973
  527    H    ASN  76           H        ASN  76  25.405 -21.204 -14.505
  528    HA   ASN  76           HA       ASN  76  27.594 -20.701 -14.190
  529    HB2  ASN  76           2HB      ASN  76  26.684 -21.180 -11.386
  530    HB3  ASN  76           1HB      ASN  76  28.410 -21.029 -11.694
  531   HD21  ASN  76          1HD2      ASN  76  29.081 -19.061 -11.236
  532   HD22  ASN  76          2HD2      ASN  76  28.237 -17.593 -11.577
  533    H    LYS  77           H        LYS  77  29.737 -21.717 -13.087
  534    HA   LYS  77           HA       LYS  77  29.629 -24.634 -13.428
  535    HB2  LYS  77           2HB      LYS  77  31.790 -24.524 -14.668
  536    HB3  LYS  77           1HB      LYS  77  30.433 -23.817 -15.533
  537    HG2  LYS  77           2HG      LYS  77  31.219 -21.570 -14.733
  538    HG3  LYS  77           1HG      LYS  77  32.668 -22.374 -14.125
  539    HD2  LYS  77           2HD      LYS  77  31.956 -22.984 -16.919
  540    HD3  LYS  77           1HD      LYS  77  32.439 -21.314 -16.609
  541    HE2  LYS  77           2HE      LYS  77  34.111 -23.471 -15.436
  542    HE3  LYS  77           1HE      LYS  77  34.193 -23.238 -17.183
  543    HZ1  LYS  77           3HZ      LYS  77  35.864 -21.946 -15.936
  544    HZ2  LYS  77           1HZ      LYS  77  34.619 -21.080 -15.185
  545    HZ3  LYS  77           2HZ      LYS  77  34.839 -20.967 -16.859
  546    H    GLU  78           H        GLU  78  30.434 -25.645 -11.735
  547    HA   GLU  78           HA       GLU  78  32.715 -24.487 -10.296
  548    HB2  GLU  78           2HB      GLU  78  30.251 -24.222  -9.256
  549    HB3  GLU  78           1HB      GLU  78  30.635 -25.828  -8.652
  550    HG2  GLU  78           2HG      GLU  78  32.307 -25.075  -7.292
  551    HG3  GLU  78           1HG      GLU  78  32.640 -23.664  -8.295
  552    H    LEU  79           H        LEU  79  34.108 -26.026 -11.145
  553    HA   LEU  79           HA       LEU  79  33.860 -28.682  -9.973
  554    HB2  LEU  79           2HB      LEU  79  34.435 -29.775 -12.131
  555    HB3  LEU  79           1HB      LEU  79  32.842 -29.048 -12.104
  556    HG   LEU  79           HG       LEU  79  35.047 -27.393 -13.204
  557   HD11  LEU  79          1HD1      LEU  79  34.392 -28.624 -15.458
  558   HD12  LEU  79          2HD1      LEU  79  34.173 -29.983 -14.356
  559   HD13  LEU  79          3HD1      LEU  79  35.732 -29.167 -14.449
  560   HD21  LEU  79          3HD2      LEU  79  32.428 -26.983 -12.990
  561   HD22  LEU  79          1HD2      LEU  79  32.435 -27.822 -14.541
  562   HD23  LEU  79          2HD2      LEU  79  33.375 -26.345 -14.334
  563    H    VAL  80           H        VAL  80  35.557 -27.407  -8.741
  564    HA   VAL  80           HA       VAL  80  38.182 -27.712 -10.055
  565    HB   VAL  80           HB       VAL  80  37.568 -25.817  -7.783
  566   HG11  VAL  80          1HG1      VAL  80  39.967 -26.777  -8.511
  567   HG12  VAL  80          2HG1      VAL  80  39.727 -25.153  -7.867
  568   HG13  VAL  80          3HG1      VAL  80  39.852 -25.401  -9.608
  569   HG21  VAL  80          3HG2      VAL  80  37.740 -24.033  -9.537
  570   HG22  VAL  80          1HG2      VAL  80  36.294 -25.036  -9.642
  571   HG23  VAL  80          2HG2      VAL  80  37.638 -25.305 -10.752
  572    H    LYS  81           H        LYS  81  38.393 -29.882  -9.363
  573    HA   LYS  81           HA       LYS  81  38.343 -30.465  -6.515
  574    HB2  LYS  81           2HB      LYS  81  37.672 -31.980  -8.630
  575    HB3  LYS  81           1HB      LYS  81  39.351 -32.471  -8.465
  576    HG2  LYS  81           2HG      LYS  81  38.564 -32.703  -5.909
  577    HG3  LYS  81           1HG      LYS  81  37.031 -33.016  -6.727
  578    HD2  LYS  81           2HD      LYS  81  39.630 -34.443  -7.307
  579    HD3  LYS  81           1HD      LYS  81  38.332 -35.075  -6.293
  580    HE2  LYS  81           2HE      LYS  81  37.640 -36.045  -8.203
  581    HE3  LYS  81           1HE      LYS  81  36.951 -34.458  -8.535
  582    HZ1  LYS  81           3HZ      LYS  81  38.303 -35.452 -10.371
  583    HZ2  LYS  81           1HZ      LYS  81  39.676 -35.248  -9.403
  584    HZ3  LYS  81           2HZ      LYS  81  38.782 -33.900  -9.900
  585    H    LEU  82           H        LEU  82  40.056 -29.410  -5.576
  586    HA   LEU  82           HA       LEU  82  42.681 -29.345  -6.670
  587    HB2  LEU  82           2HB      LEU  82  41.411 -27.926  -4.757
  588    HB3  LEU  82           1HB      LEU  82  42.340 -29.014  -3.746
  589    HG   LEU  82           HG       LEU  82  43.557 -26.955  -4.026
  590   HD11  LEU  82          1HD1      LEU  82  44.656 -29.355  -4.286
  591   HD12  LEU  82          2HD1      LEU  82  45.599 -27.870  -4.403
  592   HD13  LEU  82          3HD1      LEU  82  45.082 -28.705  -5.868
  593   HD21  LEU  82          3HD2      LEU  82  43.918 -25.855  -5.985
  594   HD22  LEU  82          1HD2      LEU  82  42.387 -26.634  -6.380
  595   HD23  LEU  82          2HD2      LEU  82  43.904 -27.331  -6.950
  596    H    GLU  83           H        GLU  83  44.356 -30.710  -6.453
  597    HA   GLU  83           HA       GLU  83  43.979 -33.347  -5.551
  598    HB2  GLU  83           2HB      GLU  83  45.775 -32.189  -7.167
  599    HB3  GLU  83           1HB      GLU  83  46.747 -32.268  -5.704
  600    HG2  GLU  83           2HG      GLU  83  45.313 -34.716  -6.598
  601    HG3  GLU  83           1HG      GLU  83  46.758 -34.209  -7.470
  602    H    HIS  84           H        HIS  84  44.948 -34.479  -3.799
  603    HA   HIS  84           HA       HIS  84  45.337 -32.803  -1.419
  604    HB2  HIS  84           2HB      HIS  84  43.565 -34.744  -1.645
  605    HB3  HIS  84           1HB      HIS  84  44.947 -35.771  -1.276
  606    HD1  HIS  84           1HD      HIS  84  44.150 -32.406   0.292
  607    HD2  HIS  84           2HD      HIS  84  44.393 -36.428   1.314
  608    HE1  HIS  84           1HE      HIS  84  43.862 -32.484   2.789
  609    HE2  HIS  84           2HE      HIS  84  44.079 -34.921   3.392
  Start of MODEL   12
    1    H1   MET   1           1HT      MET   1  15.945  11.141   6.062
    2    H2   MET   1           2HT      MET   1  16.312  11.074   7.737
    3    H3   MET   1           3HT      MET   1  15.189  12.229   7.147
    4    HA   MET   1           HA       MET   1  13.922  10.588   8.116
    5    HB2  MET   1           2HB      MET   1  14.129  10.382   5.117
    6    HB3  MET   1           1HB      MET   1  12.917   9.473   6.010
    7    HG2  MET   1           2HG      MET   1  13.211  12.458   6.200
    8    HG3  MET   1           1HG      MET   1  12.150  11.653   5.044
    9    HE1  MET   1           2HE      MET   1  10.414  13.255   5.988
   10    HE2  MET   1           3HE      MET   1  11.091  13.825   7.515
   11    HE3  MET   1           1HE      MET   1   9.527  13.008   7.494
   12    H    ALA   2           H        ALA   2  14.352   8.841   9.313
   13    HA   ALA   2           HA       ALA   2  15.516   6.490   7.986
   14    HB1  ALA   2           1HB      ALA   2  16.708   6.079  10.245
   15    HB2  ALA   2           2HB      ALA   2  16.476   7.809  10.497
   16    HB3  ALA   2           3HB      ALA   2  17.401   7.237   9.109
   17    H    VAL   3           H        VAL   3  14.323   7.357  11.250
   18    HA   VAL   3           HA       VAL   3  13.137   4.844  11.722
   19    HB   VAL   3           HB       VAL   3  11.919   5.959  13.584
   20   HG11  VAL   3          1HG1      VAL   3  14.660   7.022  13.861
   21   HG12  VAL   3          2HG1      VAL   3  14.522   5.313  13.448
   22   HG13  VAL   3          3HG1      VAL   3  13.749   5.933  14.906
   23   HG21  VAL   3          3HG2      VAL   3  12.821   8.373  12.140
   24   HG22  VAL   3          1HG2      VAL   3  12.945   8.425  13.898
   25   HG23  VAL   3          2HG2      VAL   3  11.388   8.109  13.132
   26    H    PHE   4           H        PHE   4  11.345   3.975  10.940
   27    HA   PHE   4           HA       PHE   4   9.630   5.351   9.153
   28    HB2  PHE   4           2HB      PHE   4   9.709   2.630  10.362
   29    HB3  PHE   4           1HB      PHE   4   8.184   3.169   9.670
   30    HD1  PHE   4           1HD      PHE   4  11.765   3.493   8.656
   31    HD2  PHE   4           2HD      PHE   4   7.832   2.259   7.599
   32    HE1  PHE   4           1HE      PHE   4  12.570   2.860   6.421
   33    HE2  PHE   4           2HE      PHE   4   8.631   1.622   5.361
   34    HZ   PHE   4           HZ       PHE   4  11.004   1.923   4.771
   35    H    HIS   5           H        HIS   5   7.484   6.008   9.372
   36    HA   HIS   5           HA       HIS   5   6.780   7.134  11.864
   37    HB2  HIS   5           2HB      HIS   5   6.067   7.923   9.548
   38    HB3  HIS   5           1HB      HIS   5   4.864   6.638   9.586
   39    HD1  HIS   5           1HD      HIS   5   5.873   9.592  11.778
   40    HD2  HIS   5           2HD      HIS   5   2.501   7.465  10.606
   41    HE1  HIS   5           1HE      HIS   5   3.929  10.771  12.851
   42    HE2  HIS   5           2HE      HIS   5   1.915   9.392  12.230
   43    H    ASP   6           H        ASP   6   5.107   4.558  10.028
   44    HA   ASP   6           HA       ASP   6   4.784   2.900  12.324
   45    HB2  ASP   6           2HB      ASP   6   2.624   4.799  11.628
   46    HB3  ASP   6           1HB      ASP   6   2.106   3.137  11.882
   47    H    GLU   7           H        GLU   7   3.681   0.892  11.826
   48    HA   GLU   7           HA       GLU   7   3.796   0.287   8.957
   49    HB2  GLU   7           2HB      GLU   7   3.583  -1.706  11.216
   50    HB3  GLU   7           1HB      GLU   7   4.030  -2.022   9.548
   51    HG2  GLU   7           2HG      GLU   7   6.170  -1.655   9.974
   52    HG3  GLU   7           1HG      GLU   7   5.821  -0.101  10.731
   53    H    VAL   8           H        VAL   8   2.047  -0.387   7.812
   54    HA   VAL   8           HA       VAL   8  -0.445  -0.949   9.270
   55    HB   VAL   8           HB       VAL   8  -0.364   0.844   6.840
   56   HG11  VAL   8          1HG1      VAL   8  -2.609   0.529   8.808
   57   HG12  VAL   8          2HG1      VAL   8  -2.437  -0.538   7.414
   58   HG13  VAL   8          3HG1      VAL   8  -2.655   1.195   7.176
   59   HG21  VAL   8          3HG2      VAL   8   0.738   1.931   8.762
   60   HG22  VAL   8          1HG2      VAL   8  -0.715   1.663   9.724
   61   HG23  VAL   8          2HG2      VAL   8  -0.772   2.723   8.315
   62    H    GLU   9           H        GLU   9  -1.779  -2.453   8.338
   63    HA   GLU   9           HA       GLU   9  -0.646  -4.269   6.486
   64    HB2  GLU   9           2HB      GLU   9  -3.414  -3.989   7.642
   65    HB3  GLU   9           1HB      GLU   9  -3.017  -5.242   6.475
   66    HG2  GLU   9           2HG      GLU   9  -1.313  -6.118   7.984
   67    HG3  GLU   9           1HG      GLU   9  -1.697  -4.857   9.153
   68    H    ILE  10           H        ILE  10  -0.989  -4.609   4.336
   69    HA   ILE  10           HA       ILE  10  -1.584  -2.469   2.666
   70    HB   ILE  10           HB       ILE  10  -0.284  -4.456   1.981
   71   HG12  ILE  10          2HG1      ILE  10  -1.866  -4.730  -0.254
   72   HG13  ILE  10          1HG1      ILE  10  -2.404  -3.187   0.400
   73   HG21  ILE  10          1HG2      ILE  10  -1.641  -6.211   2.941
   74   HG22  ILE  10          2HG2      ILE  10  -1.454  -6.473   1.207
   75   HG23  ILE  10          3HG2      ILE  10  -2.966  -5.824   1.842
   76   HD11  ILE  10          3HD1      ILE  10  -0.262  -3.565  -1.244
   77   HD12  ILE  10          1HD1      ILE  10   0.493  -3.469   0.345
   78   HD13  ILE  10          2HD1      ILE  10  -0.535  -2.154  -0.223
   79    H    GLU  11           H        GLU  11  -3.726  -4.833   4.100
   80    HA   GLU  11           HA       GLU  11  -5.943  -4.599   2.423
   81    HB2  GLU  11           2HB      GLU  11  -5.565  -5.312   5.301
   82    HB3  GLU  11           1HB      GLU  11  -7.197  -5.021   4.719
   83    HG2  GLU  11           2HG      GLU  11  -6.756  -7.363   4.614
   84    HG3  GLU  11           1HG      GLU  11  -6.829  -6.734   2.969
   85    H    ASP  12           H        ASP  12  -4.735  -2.449   4.930
   86    HA   ASP  12           HA       ASP  12  -7.103  -0.827   5.034
   87    HB2  ASP  12           2HB      ASP  12  -4.292  -0.307   6.030
   88    HB3  ASP  12           1HB      ASP  12  -5.664   0.755   6.327
   89    H    PHE  13           H        PHE  13  -4.164  -0.849   3.146
   90    HA   PHE  13           HA       PHE  13  -4.220   1.804   2.188
   91    HB2  PHE  13           2HB      PHE  13  -2.990  -0.754   1.233
   92    HB3  PHE  13           1HB      PHE  13  -2.995   0.642   0.167
   93    HD1  PHE  13           2HD      PHE  13  -2.283   0.045   3.801
   94    HD2  PHE  13           1HD      PHE  13  -1.025   1.763   0.113
   95    HE1  PHE  13           2HE      PHE  13  -0.249   0.900   4.892
   96    HE2  PHE  13           1HE      PHE  13   1.009   2.615   1.198
   97    HZ   PHE  13           HZ       PHE  13   1.399   2.184   3.590
   98    H    GLN  14           H        GLN  14  -4.445   2.182  -0.306
   99    HA   GLN  14           HA       GLN  14  -7.058   1.090  -1.138
  100    HB2  GLN  14           2HB      GLN  14  -6.653   3.656  -0.602
  101    HB3  GLN  14           1HB      GLN  14  -6.023   3.665  -2.243
  102    HG2  GLN  14           2HG      GLN  14  -8.053   3.525  -3.156
  103    HG3  GLN  14           1HG      GLN  14  -8.596   2.315  -1.996
  104   HE21  GLN  14          1HE2      GLN  14 -10.213   4.385  -2.923
  105   HE22  GLN  14          2HE2      GLN  14 -10.570   5.443  -1.605
  106    H    TYR  15           H        TYR  15  -6.819  -0.382  -2.701
  107    HA   TYR  15           HA       TYR  15  -4.530  -0.610  -4.347
  108    HB2  TYR  15           2HB      TYR  15  -5.998  -2.524  -3.843
  109    HB3  TYR  15           1HB      TYR  15  -7.292  -1.776  -4.770
  110    HD1  TYR  15           1HD      TYR  15  -3.749  -2.901  -5.176
  111    HD2  TYR  15           2HD      TYR  15  -7.562  -2.390  -6.992
  112    HE1  TYR  15           1HE      TYR  15  -2.924  -4.016  -7.207
  113    HE2  TYR  15           2HE      TYR  15  -6.747  -3.504  -9.028
  114    HH   TYR  15           HH       TYR  15  -3.955  -3.802  -9.977
  115    H    ASP  16           H        ASP  16  -3.974   0.449  -6.125
  116    HA   ASP  16           HA       ASP  16  -6.009   2.082  -7.480
  117    HB2  ASP  16           2HB      ASP  16  -3.838   3.069  -6.399
  118    HB3  ASP  16           1HB      ASP  16  -3.056   2.460  -7.856
  119    H    GLU  17           H        GLU  17  -6.806   0.461  -8.846
  120    HA   GLU  17           HA       GLU  17  -5.330  -1.299 -10.408
  121    HB2  GLU  17           2HB      GLU  17  -7.363  -1.208 -11.968
  122    HB3  GLU  17           1HB      GLU  17  -7.634  -1.714 -10.308
  123    HG2  GLU  17           2HG      GLU  17  -8.719   0.253  -9.748
  124    HG3  GLU  17           1HG      GLU  17  -8.019   1.143 -11.099
  125    H    ASP  18           H        ASP  18  -5.938   2.100 -10.861
  126    HA   ASP  18           HA       ASP  18  -5.578   2.535 -13.524
  127    HB2  ASP  18           2HB      ASP  18  -5.693   4.143 -11.357
  128    HB3  ASP  18           1HB      ASP  18  -3.991   4.322 -11.772
  129    H    SER  19           H        SER  19  -2.990   1.965 -11.144
  130    HA   SER  19           HA       SER  19  -1.246   1.092 -13.314
  131    HB2  SER  19           2HB      SER  19   0.603   2.515 -12.654
  132    HB3  SER  19           1HB      SER  19  -0.801   3.520 -13.004
  133    HG   SER  19           HG       SER  19  -0.703   4.231 -11.038
  134    H    GLU  20           H        GLU  20  -2.631  -0.140 -10.946
  135    HA   GLU  20           HA       GLU  20  -2.244  -1.610  -9.256
  136    HB2  GLU  20           2HB      GLU  20  -0.980  -2.533 -11.419
  137    HB3  GLU  20           1HB      GLU  20   0.419  -2.339 -10.369
  138    HG2  GLU  20           2HG      GLU  20  -0.218  -4.006  -8.973
  139    HG3  GLU  20           1HG      GLU  20  -1.937  -3.710  -9.219
  140    H    THR  21           H        THR  21  -1.882   0.553  -8.060
  141    HA   THR  21           HA       THR  21   0.597   0.270  -6.516
  142    HB   THR  21           HB       THR  21  -0.494   2.942  -7.416
  143    HG1  THR  21           1HG      THR  21   0.824   2.873  -9.066
  144   HG21  THR  21          3HG2      THR  21   1.452   3.934  -6.572
  145   HG22  THR  21          1HG2      THR  21   2.236   2.374  -6.314
  146   HG23  THR  21          2HG2      THR  21   0.879   2.859  -5.297
  147    H    TYR  22           H        TYR  22   0.447   1.074  -4.332
  148    HA   TYR  22           HA       TYR  22  -2.336   1.365  -3.392
  149    HB2  TYR  22           2HB      TYR  22   0.039   0.244  -1.884
  150    HB3  TYR  22           1HB      TYR  22  -1.597   0.405  -1.253
  151    HD1  TYR  22           1HD      TYR  22   0.329  -1.219  -3.990
  152    HD2  TYR  22           2HD      TYR  22  -3.108  -1.357  -1.489
  153    HE1  TYR  22           1HE      TYR  22  -0.215  -3.447  -4.872
  154    HE2  TYR  22           2HE      TYR  22  -3.661  -3.588  -2.358
  155    HH   TYR  22           HH       TYR  22  -2.182  -5.553  -3.461
  156    H    PHE  23           H        PHE  23  -2.867   3.038  -2.053
  157    HA   PHE  23           HA       PHE  23  -0.702   4.923  -1.376
  158    HB2  PHE  23           2HB      PHE  23  -3.490   5.502  -2.382
  159    HB3  PHE  23           1HB      PHE  23  -2.488   6.724  -1.607
  160    HD1  PHE  23           1HD      PHE  23  -2.096   4.148  -4.288
  161    HD2  PHE  23           2HD      PHE  23  -1.405   8.159  -3.032
  162    HE1  PHE  23           1HE      PHE  23  -1.033   4.638  -6.449
  163    HE2  PHE  23           2HE      PHE  23  -0.341   8.651  -5.198
  164    HZ   PHE  23           HZ       PHE  23  -0.154   6.890  -6.907
  165    H    TYR  24           H        TYR  24  -0.886   6.094   0.572
  166    HA   TYR  24           HA       TYR  24  -2.939   5.111   2.444
  167    HB2  TYR  24           2HB      TYR  24  -0.646   4.091   2.816
  168    HB3  TYR  24           1HB      TYR  24  -0.085   5.706   3.234
  169    HD1  TYR  24           1HD      TYR  24  -2.681   3.198   4.168
  170    HD2  TYR  24           2HD      TYR  24  -0.219   6.424   5.444
  171    HE1  TYR  24           1HE      TYR  24  -3.439   2.853   6.482
  172    HE2  TYR  24           2HE      TYR  24  -0.967   6.088   7.762
  173    HH   TYR  24           HH       TYR  24  -2.683   3.326   8.762
  174    HA   PRO  25           HA       PRO  25  -3.888   9.431   2.929
  175    HB2  PRO  25           2HB      PRO  25  -4.860   8.584   5.603
  176    HB3  PRO  25           1HB      PRO  25  -5.713   9.437   4.313
  177    HG2  PRO  25           2HG      PRO  25  -6.223   6.871   4.823
  178    HG3  PRO  25           1HG      PRO  25  -6.193   7.485   3.159
  179    HD2  PRO  25           2HD      PRO  25  -4.127   5.902   4.636
  180    HD3  PRO  25           1HD      PRO  25  -4.650   5.774   2.943
  181    H    CYS  26           H        CYS  26  -2.467  10.959   3.447
  182    HA   CYS  26           HA       CYS  26  -0.790  10.597   5.837
  183    HB2  CYS  26           2HB      CYS  26   0.055  11.006   3.293
  184    HB3  CYS  26           1HB      CYS  26  -0.050  12.672   3.858
  185    HA   PRO  27           HA       PRO  27  -2.736  13.951   7.964
  186    HB2  PRO  27           2HB      PRO  27   0.012  14.795   8.717
  187    HB3  PRO  27           1HB      PRO  27  -1.376  14.424   9.746
  188    HG2  PRO  27           2HG      PRO  27   0.658  12.715   9.535
  189    HG3  PRO  27           1HG      PRO  27  -1.015  12.135   9.633
  190    HD2  PRO  27           2HD      PRO  27   0.784  12.351   7.253
  191    HD3  PRO  27           1HD      PRO  27  -0.391  11.087   7.668
  192    H    CYS  28           H        CYS  28  -0.005  14.607   5.827
  193    HA   CYS  28           HA       CYS  28  -0.393  17.437   5.752
  194    HB2  CYS  28           2HB      CYS  28   1.158  17.383   3.827
  195    HB3  CYS  28           1HB      CYS  28   1.784  16.504   5.217
  196    H    GLY  29           H        GLY  29  -1.470  14.731   3.736
  197    HA2  GLY  29           2HA      GLY  29  -3.687  14.923   2.731
  198    HA3  GLY  29           1HA      GLY  29  -3.317  16.605   2.394
  199    H    ASP  30           H        ASP  30  -0.803  14.283   1.843
  200    HA   ASP  30           HA       ASP  30  -1.166  14.646  -1.049
  201    HB2  ASP  30           2HB      ASP  30   1.209  14.433   0.703
  202    HB3  ASP  30           1HB      ASP  30   1.328  13.605  -0.847
  203    H    ASN  31           H        ASN  31  -0.827  12.210   1.454
  204    HA   ASN  31           HA       ASN  31  -1.386  10.011   1.497
  205    HB2  ASN  31           2HB      ASN  31  -2.167  10.186  -1.416
  206    HB3  ASN  31           1HB      ASN  31  -2.697   9.006  -0.221
  207   HD21  ASN  31          1HD2      ASN  31  -3.485  11.812  -1.813
  208   HD22  ASN  31          2HD2      ASN  31  -4.764  12.356  -0.786
  209    H    PHE  32           H        PHE  32   0.097   8.499   1.630
  210    HA   PHE  32           HA       PHE  32   2.512   8.518   0.176
  211    HB2  PHE  32           2HB      PHE  32   1.211   6.394   1.884
  212    HB3  PHE  32           1HB      PHE  32   2.813   6.214   1.187
  213    HD1  PHE  32           1HD      PHE  32   4.518   8.089   1.747
  214    HD2  PHE  32           2HD      PHE  32   0.969   7.335   3.968
  215    HE1  PHE  32           1HE      PHE  32   5.499   9.226   3.693
  216    HE2  PHE  32           2HE      PHE  32   1.942   8.471   5.919
  217    HZ   PHE  32           HZ       PHE  32   4.211   9.418   5.783
  218    H    SER  33           H        SER  33   3.359   6.630  -1.100
  219    HA   SER  33           HA       SER  33   1.322   5.221  -2.661
  220    HB2  SER  33           2HB      SER  33   3.560   6.552  -4.151
  221    HB3  SER  33           1HB      SER  33   1.993   6.007  -4.748
  222    HG   SER  33           HG       SER  33   2.572   8.288  -3.176
  223    H    ILE  34           H        ILE  34   1.929   3.228  -3.372
  224    HA   ILE  34           HA       ILE  34   4.719   2.445  -3.416
  225    HB   ILE  34           HB       ILE  34   4.156   2.038  -1.066
  226   HG12  ILE  34          2HG1      ILE  34   4.226  -0.704  -2.255
  227   HG13  ILE  34          1HG1      ILE  34   5.534   0.410  -2.643
  228   HG21  ILE  34          1HG2      ILE  34   1.718   1.706  -1.414
  229   HG22  ILE  34          2HG2      ILE  34   2.463   0.490  -0.375
  230   HG23  ILE  34          3HG2      ILE  34   2.070   0.099  -2.049
  231   HD11  ILE  34          3HD1      ILE  34   5.404  -1.243  -0.461
  232   HD12  ILE  34          1HD1      ILE  34   4.943   0.329   0.197
  233   HD13  ILE  34          2HD1      ILE  34   6.478   0.142  -0.654
  234    H    THR  35           H        THR  35   5.020   1.236  -5.166
  235    HA   THR  35           HA       THR  35   2.833   0.292  -6.731
  236    HB   THR  35           HB       THR  35   4.751  -0.778  -8.084
  237    HG1  THR  35           1HG      THR  35   6.787  -0.208  -7.516
  238   HG21  THR  35          3HG2      THR  35   3.724   1.438  -8.608
  239   HG22  THR  35          1HG2      THR  35   5.414   1.269  -9.087
  240   HG23  THR  35          2HG2      THR  35   4.995   2.184  -7.639
  241    H    LYS  36           H        LYS  36   2.253  -1.836  -7.267
  242    HA   LYS  36           HA       LYS  36   2.186  -3.685  -5.167
  243    HB2  LYS  36           2HB      LYS  36   0.549  -3.657  -6.999
  244    HB3  LYS  36           1HB      LYS  36   1.792  -4.182  -8.124
  245    HG2  LYS  36           2HG      LYS  36   0.755  -6.166  -7.693
  246    HG3  LYS  36           1HG      LYS  36   2.015  -6.196  -6.459
  247    HD2  LYS  36           2HD      LYS  36   0.409  -5.328  -4.816
  248    HD3  LYS  36           1HD      LYS  36  -0.849  -5.325  -6.054
  249    HE2  LYS  36           2HE      LYS  36   0.667  -7.798  -5.245
  250    HE3  LYS  36           1HE      LYS  36  -0.844  -7.305  -4.484
  251    HZ1  LYS  36           3HZ      LYS  36  -1.897  -7.396  -6.689
  252    HZ2  LYS  36           1HZ      LYS  36  -1.284  -8.898  -6.206
  253    HZ3  LYS  36           2HZ      LYS  36  -0.452  -7.974  -7.352
  254    H    GLU  37           H        GLU  37   4.340  -3.445  -7.958
  255    HA   GLU  37           HA       GLU  37   5.662  -5.900  -7.667
  256    HB2  GLU  37           2HB      GLU  37   5.761  -4.129  -9.575
  257    HB3  GLU  37           1HB      GLU  37   7.073  -3.432  -8.634
  258    HG2  GLU  37           2HG      GLU  37   8.121  -5.752  -8.681
  259    HG3  GLU  37           1HG      GLU  37   6.943  -6.129  -9.937
  260    H    ASP  38           H        ASP  38   6.230  -2.749  -6.155
  261    HA   ASP  38           HA       ASP  38   8.713  -3.257  -4.980
  262    HB2  ASP  38           2HB      ASP  38   6.467  -1.387  -4.440
  263    HB3  ASP  38           1HB      ASP  38   7.617  -1.637  -3.131
  264    H    LEU  39           H        LEU  39   5.440  -3.809  -3.718
  265    HA   LEU  39           HA       LEU  39   6.264  -4.881  -1.240
  266    HB2  LEU  39           2HB      LEU  39   3.700  -5.521  -2.693
  267    HB3  LEU  39           1HB      LEU  39   3.997  -5.625  -0.969
  268    HG   LEU  39           HG       LEU  39   4.300  -2.960  -2.269
  269   HD11  LEU  39          1HD1      LEU  39   1.736  -2.787  -1.614
  270   HD12  LEU  39          2HD1      LEU  39   1.773  -4.489  -2.070
  271   HD13  LEU  39          3HD1      LEU  39   2.266  -3.256  -3.228
  272   HD21  LEU  39          3HD2      LEU  39   3.491  -2.178  -0.135
  273   HD22  LEU  39          1HD2      LEU  39   4.799  -3.332   0.122
  274   HD23  LEU  39          2HD2      LEU  39   3.125  -3.827   0.368
  275    H    GLU  40           H        GLU  40   5.686  -6.337  -4.397
  276    HA   GLU  40           HA       GLU  40   5.800  -9.039  -3.543
  277    HB2  GLU  40           2HB      GLU  40   6.148  -7.700  -6.218
  278    HB3  GLU  40           1HB      GLU  40   6.378  -9.433  -6.027
  279    HG2  GLU  40           2HG      GLU  40   4.078  -9.587  -5.118
  280    HG3  GLU  40           1HG      GLU  40   3.863  -7.875  -5.480
  281    H    ASN  41           H        ASN  41   8.265  -6.666  -4.188
  282    HA   ASN  41           HA       ASN  41  10.362  -8.698  -4.324
  283    HB2  ASN  41           2HB      ASN  41  10.195  -5.793  -4.952
  284    HB3  ASN  41           1HB      ASN  41  11.757  -6.425  -4.441
  285   HD21  ASN  41          1HD2      ASN  41  10.384  -5.501  -7.066
  286   HD22  ASN  41          2HD2      ASN  41  10.897  -6.700  -8.199
  287    H    GLY  42           H        GLY  42   9.190  -6.133  -2.201
  288    HA2  GLY  42           2HA      GLY  42   9.691  -6.971   0.216
  289    HA3  GLY  42           1HA      GLY  42  11.350  -6.697  -0.299
  290    H    GLU  43           H        GLU  43  10.103  -4.372  -1.985
  291    HA   GLU  43           HA       GLU  43  10.743  -2.308  -0.153
  292    HB2  GLU  43           2HB      GLU  43   9.508  -2.329  -2.898
  293    HB3  GLU  43           1HB      GLU  43   9.709  -0.836  -1.994
  294    HG2  GLU  43           2HG      GLU  43  11.894  -2.716  -2.850
  295    HG3  GLU  43           1HG      GLU  43  11.526  -1.139  -3.545
  296    H    ASP  44           H        ASP  44   9.348  -2.791   1.599
  297    HA   ASP  44           HA       ASP  44   6.491  -2.269   1.218
  298    HB2  ASP  44           2HB      ASP  44   6.412  -2.927   3.701
  299    HB3  ASP  44           1HB      ASP  44   6.790  -4.192   2.539
  300    H    VAL  45           H        VAL  45   8.242  -0.073   0.882
  301    HA   VAL  45           HA       VAL  45   7.487   1.574   3.203
  302    HB   VAL  45           HB       VAL  45   9.895   1.267   3.236
  303   HG11  VAL  45          1HG1      VAL  45  10.005   2.547   0.511
  304   HG12  VAL  45          2HG1      VAL  45  10.103   0.806   0.781
  305   HG13  VAL  45          3HG1      VAL  45  11.340   1.872   1.445
  306   HG21  VAL  45          3HG2      VAL  45   8.911   3.452   3.885
  307   HG22  VAL  45          1HG2      VAL  45   9.239   4.044   2.255
  308   HG23  VAL  45          2HG2      VAL  45  10.573   3.574   3.309
  309    H    ALA  46           H        ALA  46   6.386   3.384   2.794
  310    HA   ALA  46           HA       ALA  46   6.030   4.168  -0.027
  311    HB1  ALA  46           1HB      ALA  46   3.819   4.523   0.324
  312    HB2  ALA  46           2HB      ALA  46   4.053   5.023   2.000
  313    HB3  ALA  46           3HB      ALA  46   4.081   3.311   1.577
  314    H    THR  47           H        THR  47   6.595   6.167  -0.630
  315    HA   THR  47           HA       THR  47   7.289   8.099   1.486
  316    HB   THR  47           HB       THR  47   8.453   8.324  -1.256
  317    HG1  THR  47           1HG      THR  47   9.306   6.460   0.704
  318   HG21  THR  47          3HG2      THR  47  10.318   9.269  -0.190
  319   HG22  THR  47          1HG2      THR  47   9.816   8.676   1.393
  320   HG23  THR  47          2HG2      THR  47   8.908   9.968   0.607
  321    H    CYS  48           H        CYS  48   6.363  10.070   1.458
  322    HA   CYS  48           HA       CYS  48   4.247  10.566  -0.439
  323    HB2  CYS  48           2HB      CYS  48   4.658  11.227   2.208
  324    HB3  CYS  48           1HB      CYS  48   4.941  12.754   1.383
  325    HA   PRO  49           HA       PRO  49   6.672  13.132  -3.117
  326    HB2  PRO  49           2HB      PRO  49   4.713  14.295  -4.536
  327    HB3  PRO  49           1HB      PRO  49   5.077  12.572  -4.684
  328    HG2  PRO  49           2HG      PRO  49   2.883  13.924  -3.174
  329    HG3  PRO  49           1HG      PRO  49   2.833  12.432  -4.128
  330    HD2  PRO  49           2HD      PRO  49   3.033  12.529  -1.376
  331    HD3  PRO  49           1HD      PRO  49   3.548  11.156  -2.375
  332    H    SER  50           H        SER  50   4.962  14.355  -0.529
  333    HA   SER  50           HA       SER  50   5.761  17.110  -1.188
  334    HB2  SER  50           2HB      SER  50   3.372  17.082  -1.094
  335    HB3  SER  50           1HB      SER  50   3.377  16.150   0.402
  336    HG   SER  50           HG       SER  50   3.062  18.209   1.042
  337    H    CYS  51           H        CYS  51   4.841  15.326   1.778
  338    HA   CYS  51           HA       CYS  51   6.783  16.742   3.338
  339    HB2  CYS  51           2HB      CYS  51   6.029  15.348   5.192
  340    HB3  CYS  51           1HB      CYS  51   4.644  15.970   4.297
  341    H    SER  52           H        SER  52   6.764  13.756   1.559
  342    HA   SER  52           HA       SER  52   8.370  12.217   1.122
  343    HB2  SER  52           2HB      SER  52  10.316  14.088   2.487
  344    HB3  SER  52           1HB      SER  52  10.689  12.829   1.311
  345    HG   SER  52           HG       SER  52   9.342  15.282   0.894
  346    H    LEU  53           H        LEU  53   6.807  11.872   3.395
  347    HA   LEU  53           HA       LEU  53   8.479  11.079   5.613
  348    HB2  LEU  53           2HB      LEU  53   5.596  11.276   5.044
  349    HB3  LEU  53           1HB      LEU  53   6.041   9.957   6.108
  350    HG   LEU  53           HG       LEU  53   6.966  12.763   6.653
  351   HD11  LEU  53          1HD1      LEU  53   4.265  11.600   6.975
  352   HD12  LEU  53          2HD1      LEU  53   4.761  13.276   6.743
  353   HD13  LEU  53          3HD1      LEU  53   4.903  12.528   8.334
  354   HD21  LEU  53          3HD2      LEU  53   6.610  11.623   9.038
  355   HD22  LEU  53          1HD2      LEU  53   8.105  11.445   8.118
  356   HD23  LEU  53          2HD2      LEU  53   6.892  10.165   8.084
  357    H    ILE  54           H        ILE  54   7.725   8.747   6.538
  358    HA   ILE  54           HA       ILE  54   7.879   6.788   4.353
  359    HB   ILE  54           HB       ILE  54   9.497   5.459   5.783
  360   HG12  ILE  54          2HG1      ILE  54   9.872   8.154   7.118
  361   HG13  ILE  54          1HG1      ILE  54   9.173   6.728   7.876
  362   HG21  ILE  54          1HG2      ILE  54  11.241   6.266   4.581
  363   HG22  ILE  54          2HG2      ILE  54  10.899   7.944   4.997
  364   HG23  ILE  54          3HG2      ILE  54   9.944   7.131   3.757
  365   HD11  ILE  54          3HD1      ILE  54  11.961   6.771   6.770
  366   HD12  ILE  54          1HD1      ILE  54  11.236   5.593   7.862
  367   HD13  ILE  54          2HD1      ILE  54  11.575   7.228   8.428
  368    H    ILE  55           H        ILE  55   6.870   4.844   4.727
  369    HA   ILE  55           HA       ILE  55   5.776   4.257   7.364
  370    HB   ILE  55           HB       ILE  55   3.504   3.805   6.393
  371   HG12  ILE  55          2HG1      ILE  55   4.060   5.756   4.213
  372   HG13  ILE  55          1HG1      ILE  55   4.602   4.098   3.969
  373   HG21  ILE  55          1HG2      ILE  55   2.735   6.078   6.608
  374   HG22  ILE  55          2HG2      ILE  55   4.362   6.691   6.314
  375   HG23  ILE  55          3HG2      ILE  55   4.016   5.776   7.781
  376   HD11  ILE  55          3HD1      ILE  55   1.891   5.221   3.995
  377   HD12  ILE  55          1HD1      ILE  55   2.078   3.664   4.802
  378   HD13  ILE  55          2HD1      ILE  55   2.548   3.844   3.111
  379    H    LYS  56           H        LYS  56   5.332   2.079   7.699
  380    HA   LYS  56           HA       LYS  56   6.473   0.296   5.688
  381    HB2  LYS  56           2HB      LYS  56   6.757   0.366   8.407
  382    HB3  LYS  56           1HB      LYS  56   5.540  -0.886   8.213
  383    HG2  LYS  56           2HG      LYS  56   8.160  -0.880   6.739
  384    HG3  LYS  56           1HG      LYS  56   7.906  -1.690   8.286
  385    HD2  LYS  56           2HD      LYS  56   5.863  -2.759   7.007
  386    HD3  LYS  56           1HD      LYS  56   6.832  -2.357   5.587
  387    HE2  LYS  56           2HE      LYS  56   8.679  -3.649   6.413
  388    HE3  LYS  56           1HE      LYS  56   7.850  -3.936   7.942
  389    HZ1  LYS  56           3HZ      LYS  56   7.530  -5.260   5.389
  390    HZ2  LYS  56           1HZ      LYS  56   6.073  -4.895   6.174
  391    HZ3  LYS  56           2HZ      LYS  56   7.241  -5.839   6.952
  392    H    VAL  57           H        VAL  57   5.423  -1.159   4.563
  393    HA   VAL  57           HA       VAL  57   2.513  -1.316   4.935
  394    HB   VAL  57           HB       VAL  57   3.684  -2.305   2.400
  395   HG11  VAL  57          1HG1      VAL  57   1.710  -1.049   1.524
  396   HG12  VAL  57          2HG1      VAL  57   1.331  -0.605   3.188
  397   HG13  VAL  57          3HG1      VAL  57   1.314  -2.300   2.702
  398   HG21  VAL  57          3HG2      VAL  57   3.487   0.268   1.685
  399   HG22  VAL  57          1HG2      VAL  57   5.007  -0.468   2.193
  400   HG23  VAL  57          2HG2      VAL  57   4.062   0.483   3.337
  401    H    ILE  58           H        ILE  58   1.856  -3.102   5.908
  402    HA   ILE  58           HA       ILE  58   3.461  -5.536   5.760
  403    HB   ILE  58           HB       ILE  58   0.936  -5.103   7.362
  404   HG12  ILE  58          2HG1      ILE  58   2.647  -3.432   7.988
  405   HG13  ILE  58          1HG1      ILE  58   2.361  -4.591   9.280
  406   HG21  ILE  58          1HG2      ILE  58   1.720  -7.447   6.918
  407   HG22  ILE  58          2HG2      ILE  58   1.600  -7.008   8.622
  408   HG23  ILE  58          3HG2      ILE  58   3.176  -7.060   7.833
  409   HD11  ILE  58          3HD1      ILE  58   4.805  -3.841   8.251
  410   HD12  ILE  58          1HD1      ILE  58   4.514  -5.426   7.535
  411   HD13  ILE  58          2HD1      ILE  58   4.485  -5.232   9.287
  412    H    TYR  59           H        TYR  59   2.871  -7.340   4.695
  413    HA   TYR  59           HA       TYR  59   0.158  -7.718   3.734
  414    HB2  TYR  59           2HB      TYR  59   1.059  -8.079   1.362
  415    HB3  TYR  59           1HB      TYR  59   0.911  -6.411   1.908
  416    HD1  TYR  59           2HD      TYR  59   3.285  -9.139   1.207
  417    HD2  TYR  59           1HD      TYR  59   2.848  -5.030   2.210
  418    HE1  TYR  59           2HE      TYR  59   5.671  -8.780   0.732
  419    HE2  TYR  59           1HE      TYR  59   5.229  -4.652   1.744
  420    HH   TYR  59           HH       TYR  59   7.450  -7.202   1.325
  421    H    ASP  60           H        ASP  60   0.235  -9.832   2.216
  422    HA   ASP  60           HA       ASP  60   1.534 -11.846   3.859
  423    HB2  ASP  60           2HB      ASP  60  -0.903 -11.859   2.733
  424    HB3  ASP  60           1HB      ASP  60  -0.004 -12.643   1.436
  425    H    LYS  61           H        LYS  61   3.620 -12.169   3.447
  426    HA   LYS  61           HA       LYS  61   4.923 -11.707   1.010
  427    HB2  LYS  61           2HB      LYS  61   5.629 -13.196   3.508
  428    HB3  LYS  61           1HB      LYS  61   6.655 -13.377   2.092
  429    HG2  LYS  61           2HG      LYS  61   5.942 -10.622   2.928
  430    HG3  LYS  61           1HG      LYS  61   7.090 -11.517   3.925
  431    HD2  LYS  61           2HD      LYS  61   8.252 -12.032   1.652
  432    HD3  LYS  61           1HD      LYS  61   7.334 -10.641   1.074
  433    HE2  LYS  61           2HE      LYS  61   8.341  -9.223   2.751
  434    HE3  LYS  61           1HE      LYS  61   9.166 -10.605   3.471
  435    HZ1  LYS  61           3HZ      LYS  61  10.362  -9.004   1.778
  436    HZ2  LYS  61           1HZ      LYS  61   9.671 -10.050   0.641
  437    HZ3  LYS  61           2HZ      LYS  61  10.714 -10.656   1.826
  438    H    ASP  62           H        ASP  62   3.205 -14.516   2.204
  439    HA   ASP  62           HA       ASP  62   4.263 -16.403   0.367
  440    HB2  ASP  62           2HB      ASP  62   2.812 -16.712   2.563
  441    HB3  ASP  62           1HB      ASP  62   1.478 -16.683   1.415
  442    H    GLN  63           H        GLN  63   1.426 -14.276   0.303
  443    HA   GLN  63           HA       GLN  63   0.499 -15.261  -2.225
  444    HB2  GLN  63           2HB      GLN  63  -0.245 -12.810  -0.624
  445    HB3  GLN  63           1HB      GLN  63  -1.030 -13.272  -2.127
  446    HG2  GLN  63           2HG      GLN  63  -1.756 -15.368  -1.113
  447    HG3  GLN  63           1HG      GLN  63  -0.957 -14.916   0.393
  448   HE21  GLN  63          1HE2      GLN  63  -3.158 -13.351  -1.927
  449   HE22  GLN  63          2HE2      GLN  63  -4.270 -12.777  -0.738
  450    H    PHE  64           H        PHE  64   2.143 -12.287  -1.150
  451    HA   PHE  64           HA       PHE  64   2.342 -11.172  -3.761
  452    HB2  PHE  64           2HB      PHE  64   3.589 -10.553  -1.105
  453    HB3  PHE  64           1HB      PHE  64   4.214  -9.784  -2.558
  454    HD1  PHE  64           2HD      PHE  64   1.058 -10.327  -0.662
  455    HD2  PHE  64           1HD      PHE  64   3.225  -7.851  -3.364
  456    HE1  PHE  64           2HE      PHE  64  -0.706  -8.618  -0.507
  457    HE2  PHE  64           1HE      PHE  64   1.466  -6.139  -3.210
  458    HZ   PHE  64           HZ       PHE  64  -0.503  -6.520  -1.782
  459    H    VAL  65           H        VAL  65   4.451 -13.229  -1.824
  460    HA   VAL  65           HA       VAL  65   6.258 -13.457  -4.145
  461    HB   VAL  65           HB       VAL  65   7.129 -13.740  -1.265
  462   HG11  VAL  65          1HG1      VAL  65   8.751 -14.840  -2.417
  463   HG12  VAL  65          2HG1      VAL  65   9.372 -13.198  -2.580
  464   HG13  VAL  65          3HG1      VAL  65   8.471 -13.935  -3.903
  465   HG21  VAL  65          3HG2      VAL  65   6.820 -11.505  -1.197
  466   HG22  VAL  65          1HG2      VAL  65   6.839 -11.338  -2.952
  467   HG23  VAL  65          2HG2      VAL  65   8.357 -11.485  -2.065
  468    H    SER  66           H        SER  66   5.318 -15.329  -4.954
  469    HA   SER  66           HA       SER  66   5.099 -17.639  -3.170
  470    HB2  SER  66           2HB      SER  66   3.237 -17.006  -4.778
  471    HB3  SER  66           1HB      SER  66   4.301 -17.532  -6.081
  472    HG   SER  66           HG       SER  66   4.285 -19.598  -5.235
  473    H    GLY  67           H        GLY  67   7.705 -16.829  -3.616
  474    HA2  GLY  67           2HA      GLY  67   8.734 -19.122  -5.153
  475    HA3  GLY  67           1HA      GLY  67   9.414 -17.520  -5.412
  476    H    GLU  68           H        GLU  68   9.876 -16.429  -3.102
  477    HA   GLU  68           HA       GLU  68  11.397 -18.408  -1.538
  478    HB2  GLU  68           2HB      GLU  68  12.179 -15.660  -2.475
  479    HB3  GLU  68           1HB      GLU  68  12.932 -16.373  -1.055
  480    HG2  GLU  68           2HG      GLU  68  13.626 -18.300  -2.432
  481    HG3  GLU  68           1HG      GLU  68  12.947 -17.497  -3.847
  482    H    THR  69           H        THR  69   8.765 -17.780  -0.879
  483    HA   THR  69           HA       THR  69   8.501 -15.670   0.980
  484    HB   THR  69           HB       THR  69   6.492 -16.588   0.108
  485    HG1  THR  69           1HG      THR  69   5.395 -16.760   1.940
  486   HG21  THR  69          3HG2      THR  69   7.677 -19.197   0.784
  487   HG22  THR  69          1HG2      THR  69   6.617 -18.733  -0.546
  488   HG23  THR  69          2HG2      THR  69   5.942 -19.033   1.055
  489    H    VAL  70           H        VAL  70   8.388 -15.722   3.274
  490    HA   VAL  70           HA       VAL  70   9.298 -18.022   4.738
  491    HB   VAL  70           HB       VAL  70  11.444 -17.204   3.890
  492   HG11  VAL  70          1HG1      VAL  70  12.189 -15.063   4.000
  493   HG12  VAL  70          2HG1      VAL  70  11.327 -14.719   5.500
  494   HG13  VAL  70          3HG1      VAL  70  10.457 -14.729   3.965
  495   HG21  VAL  70          3HG2      VAL  70  10.998 -16.787   6.840
  496   HG22  VAL  70          1HG2      VAL  70  12.588 -16.890   6.084
  497   HG23  VAL  70          2HG2      VAL  70  11.493 -18.273   6.028
  498    HA   PRO  71           HA       PRO  71   6.896 -15.780   7.754
  499    HB2  PRO  71           2HB      PRO  71   7.213 -17.444   9.844
  500    HB3  PRO  71           1HB      PRO  71   6.234 -17.886   8.441
  501    HG2  PRO  71           2HG      PRO  71   9.044 -18.672   9.113
  502    HG3  PRO  71           1HG      PRO  71   7.724 -19.673   8.482
  503    HD2  PRO  71           2HD      PRO  71   9.712 -18.639   6.920
  504    HD3  PRO  71           1HD      PRO  71   8.080 -18.991   6.317
  505    H    ALA  72           H        ALA  72   7.256 -15.328  10.299
  506    HA   ALA  72           HA       ALA  72  10.006 -14.753  10.985
  507    HB1  ALA  72           1HB      ALA  72   8.989 -12.866   9.456
  508    HB2  ALA  72           2HB      ALA  72  10.010 -12.468  10.840
  509    HB3  ALA  72           3HB      ALA  72   8.254 -12.347  10.973
  510    HA   PRO  73           HA       PRO  73   8.355 -15.238  15.065
  511    HB2  PRO  73           2HB      PRO  73  10.229 -13.944  16.530
  512    HB3  PRO  73           1HB      PRO  73  10.538 -15.501  15.752
  513    HG2  PRO  73           2HG      PRO  73  11.272 -12.746  14.832
  514    HG3  PRO  73           1HG      PRO  73  12.256 -14.222  14.835
  515    HD2  PRO  73           2HD      PRO  73  11.014 -13.305  12.610
  516    HD3  PRO  73           1HD      PRO  73  11.267 -15.034  12.916
  517    H    SER  74           H        SER  74   8.013 -13.831  17.149
  518    HA   SER  74           HA       SER  74   7.418 -11.046  16.604
  519    HB2  SER  74           2HB      SER  74   5.323 -13.150  16.805
  520    HB3  SER  74           1HB      SER  74   5.008 -11.624  17.629
  521    HG   SER  74           HG       SER  74   5.354 -10.562  15.641
  522    H    ALA  75           H        ALA  75   7.856  -9.872  18.355
  523    HA   ALA  75           HA       ALA  75   8.465 -11.186  20.851
  524    HB1  ALA  75           1HB      ALA  75   8.854  -8.669  21.511
  525    HB2  ALA  75           2HB      ALA  75   8.809  -8.433  19.764
  526    HB3  ALA  75           3HB      ALA  75   9.997  -9.524  20.475
  527    H    ASN  76           H        ASN  76   6.332  -8.434  20.005
  528    HA   ASN  76           HA       ASN  76   4.175  -9.472  21.578
  529    HB2  ASN  76           2HB      ASN  76   4.078  -7.573  23.188
  530    HB3  ASN  76           1HB      ASN  76   5.480  -8.609  23.425
  531   HD21  ASN  76          1HD2      ASN  76   5.015  -5.814  24.191
  532   HD22  ASN  76          2HD2      ASN  76   6.307  -4.914  23.482
  533    H    LYS  77           H        LYS  77   2.232  -8.217  21.387
  534    HA   LYS  77           HA       LYS  77   2.335  -6.059  19.391
  535    HB2  LYS  77           2HB      LYS  77   0.567  -8.502  19.335
  536    HB3  LYS  77           1HB      LYS  77   0.203  -7.048  18.418
  537    HG2  LYS  77           2HG      LYS  77   2.842  -8.429  18.124
  538    HG3  LYS  77           1HG      LYS  77   1.417  -8.985  17.246
  539    HD2  LYS  77           2HD      LYS  77   2.156  -6.092  17.152
  540    HD3  LYS  77           1HD      LYS  77   3.059  -7.245  16.169
  541    HE2  LYS  77           2HE      LYS  77   0.596  -8.031  15.535
  542    HE3  LYS  77           1HE      LYS  77   0.233  -6.357  15.952
  543    HZ1  LYS  77           3HZ      LYS  77   0.711  -6.226  13.718
  544    HZ2  LYS  77           1HZ      LYS  77   1.928  -7.400  13.781
  545    HZ3  LYS  77           2HZ      LYS  77   2.215  -5.849  14.394
  546    H    GLU  78           H        GLU  78   1.455  -4.299  20.250
  547    HA   GLU  78           HA       GLU  78  -1.069  -4.496  21.693
  548    HB2  GLU  78           2HB      GLU  78   1.127  -4.477  23.223
  549    HB3  GLU  78           1HB      GLU  78   0.974  -2.745  22.964
  550    HG2  GLU  78           2HG      GLU  78  -1.477  -4.178  23.769
  551    HG3  GLU  78           1HG      GLU  78  -0.202  -4.046  24.979
  552    H    LEU  79           H        LEU  79  -2.250  -3.284  20.326
  553    HA   LEU  79           HA       LEU  79  -2.003  -0.489  20.282
  554    HB2  LEU  79           2HB      LEU  79  -1.325  -0.021  18.042
  555    HB3  LEU  79           1HB      LEU  79  -0.093  -1.029  18.773
  556    HG   LEU  79           HG       LEU  79  -2.224  -2.036  16.881
  557   HD11  LEU  79          1HD1      LEU  79  -0.053  -2.329  15.443
  558   HD12  LEU  79          2HD1      LEU  79   0.533  -0.997  16.440
  559   HD13  LEU  79          3HD1      LEU  79  -0.922  -0.794  15.464
  560   HD21  LEU  79          3HD2      LEU  79   0.128  -3.326  18.235
  561   HD22  LEU  79          1HD2      LEU  79  -0.572  -3.980  16.753
  562   HD23  LEU  79          2HD2      LEU  79  -1.556  -3.850  18.210
  563    H    VAL  80           H        VAL  80  -3.957   0.335  19.877
  564    HA   VAL  80           HA       VAL  80  -5.920  -1.384  18.505
  565    HB   VAL  80           HB       VAL  80  -6.437  -1.004  20.881
  566   HG11  VAL  80          1HG1      VAL  80  -5.467   1.510  20.535
  567   HG12  VAL  80          2HG1      VAL  80  -6.454   0.993  21.901
  568   HG13  VAL  80          3HG1      VAL  80  -7.206   1.805  20.530
  569   HG21  VAL  80          3HG2      VAL  80  -8.158  -0.965  18.818
  570   HG22  VAL  80          1HG2      VAL  80  -8.544   0.587  19.561
  571   HG23  VAL  80          2HG2      VAL  80  -8.662  -0.897  20.507
  572    H    LYS  81           H        LYS  81  -7.095  -0.586  16.830
  573    HA   LYS  81           HA       LYS  81  -6.176   1.847  15.597
  574    HB2  LYS  81           2HB      LYS  81  -8.184  -0.258  14.826
  575    HB3  LYS  81           1HB      LYS  81  -8.020   1.226  13.900
  576    HG2  LYS  81           2HG      LYS  81  -5.537  -0.284  14.447
  577    HG3  LYS  81           1HG      LYS  81  -6.686  -1.007  13.319
  578    HD2  LYS  81           2HD      LYS  81  -6.157   1.859  12.901
  579    HD3  LYS  81           1HD      LYS  81  -4.777   0.795  12.626
  580    HE2  LYS  81           2HE      LYS  81  -5.831   0.938  10.540
  581    HE3  LYS  81           1HE      LYS  81  -6.364  -0.608  11.198
  582    HZ1  LYS  81           3HZ      LYS  81  -8.202   0.606  10.222
  583    HZ2  LYS  81           1HZ      LYS  81  -7.920   1.925  11.244
  584    HZ3  LYS  81           2HZ      LYS  81  -8.434   0.448  11.891
  585    H    LEU  82           H        LEU  82  -6.900   3.784  16.166
  586    HA   LEU  82           HA       LEU  82  -9.359   4.127  17.610
  587    HB2  LEU  82           2HB      LEU  82  -7.051   5.480  17.643
  588    HB3  LEU  82           1HB      LEU  82  -7.921   6.473  16.489
  589    HG   LEU  82           HG       LEU  82  -9.793   6.404  18.369
  590   HD11  LEU  82          1HD1      LEU  82  -7.979   4.915  19.663
  591   HD12  LEU  82          2HD1      LEU  82  -9.142   5.955  20.484
  592   HD13  LEU  82          3HD1      LEU  82  -7.492   6.517  20.214
  593   HD21  LEU  82          3HD2      LEU  82  -7.358   8.165  18.608
  594   HD22  LEU  82          1HD2      LEU  82  -8.995   8.532  19.152
  595   HD23  LEU  82          2HD2      LEU  82  -8.649   8.396  17.429
  596    H    GLU  83           H        GLU  83 -11.296   4.319  16.738
  597    HA   GLU  83           HA       GLU  83 -11.612   5.743  14.195
  598    HB2  GLU  83           2HB      GLU  83 -12.412   2.928  14.797
  599    HB3  GLU  83           1HB      GLU  83 -13.456   3.890  13.760
  600    HG2  GLU  83           2HG      GLU  83 -12.039   3.798  12.030
  601    HG3  GLU  83           1HG      GLU  83 -10.616   3.995  13.050
  602    H    HIS  84           H        HIS  84 -12.123   6.604  16.899
  603    HA   HIS  84           HA       HIS  84 -15.056   6.612  17.065
  604    HB2  HIS  84           2HB      HIS  84 -13.401   6.142  19.062
  605    HB3  HIS  84           1HB      HIS  84 -13.302   7.899  19.124
  606    HD1  HIS  84           1HD      HIS  84 -15.434   9.181  19.870
  607    HD2  HIS  84           2HD      HIS  84 -15.814   5.043  19.936
  608    HE1  HIS  84           1HE      HIS  84 -17.526   8.718  21.187
  609    HE2  HIS  84           2HE      HIS  84 -17.696   6.206  21.276
  Start of MODEL   13
    1    H1   MET   1           1HT      MET   1  18.572  10.121  11.380
    2    H2   MET   1           2HT      MET   1  17.893   8.775  12.200
    3    H3   MET   1           3HT      MET   1  18.747   9.974  13.079
    4    HA   MET   1           HA       MET   1  16.577  10.453  13.500
    5    HB2  MET   1           2HB      MET   1  17.726  12.095  11.258
    6    HB3  MET   1           1HB      MET   1  16.167  12.507  11.961
    7    HG2  MET   1           2HG      MET   1  17.166  12.803  14.128
    8    HG3  MET   1           1HG      MET   1  18.726  12.247  13.525
    9    HE1  MET   1           2HE      MET   1  17.800  16.415  14.113
   10    HE2  MET   1           3HE      MET   1  18.003  14.986  15.127
   11    HE3  MET   1           1HE      MET   1  16.497  15.233  14.240
   12    H    ALA   2           H        ALA   2  16.994   9.591  10.090
   13    HA   ALA   2           HA       ALA   2  14.228   9.703   9.419
   14    HB1  ALA   2           1HB      ALA   2  16.306   8.064   7.988
   15    HB2  ALA   2           2HB      ALA   2  16.189   9.815   7.814
   16    HB3  ALA   2           3HB      ALA   2  14.838   8.787   7.331
   17    H    VAL   3           H        VAL   3  13.020   8.523  10.865
   18    HA   VAL   3           HA       VAL   3  13.439   5.605  10.823
   19    HB   VAL   3           HB       VAL   3  12.288   5.548  13.050
   20   HG11  VAL   3          1HG1      VAL   3  14.326   6.648  14.268
   21   HG12  VAL   3          2HG1      VAL   3  14.959   6.812  12.631
   22   HG13  VAL   3          3HG1      VAL   3  14.553   5.217  13.265
   23   HG21  VAL   3          3HG2      VAL   3  12.704   8.534  12.930
   24   HG22  VAL   3          1HG2      VAL   3  12.240   7.632  14.373
   25   HG23  VAL   3          2HG2      VAL   3  11.159   7.686  12.982
   26    H    PHE   4           H        PHE   4  11.601   4.286  10.694
   27    HA   PHE   4           HA       PHE   4   9.506   5.226   9.077
   28    HB2  PHE   4           2HB      PHE   4  10.080   2.704  10.554
   29    HB3  PHE   4           1HB      PHE   4   8.425   2.969  10.023
   30    HD1  PHE   4           2HD      PHE   4  11.898   3.205   8.651
   31    HD2  PHE   4           1HD      PHE   4   7.831   2.146   7.975
   32    HE1  PHE   4           2HE      PHE   4  12.488   2.379   6.409
   33    HE2  PHE   4           1HE      PHE   4   8.416   1.317   5.735
   34    HZ   PHE   4           HZ       PHE   4  10.746   1.432   4.949
   35    H    HIS   5           H        HIS   5   7.695   6.284   9.538
   36    HA   HIS   5           HA       HIS   5   7.082   7.245  12.094
   37    HB2  HIS   5           2HB      HIS   5   6.348   8.184   9.833
   38    HB3  HIS   5           1HB      HIS   5   5.062   6.982   9.863
   39    HD1  HIS   5           1HD      HIS   5   6.310   9.307  12.609
   40    HD2  HIS   5           2HD      HIS   5   2.839   8.375  10.523
   41    HE1  HIS   5           1HE      HIS   5   4.501  10.702  13.657
   42    HE2  HIS   5           2HE      HIS   5   2.391  10.038  12.451
   43    H    ASP   6           H        ASP   6   5.111   4.941  10.196
   44    HA   ASP   6           HA       ASP   6   4.718   3.264  12.508
   45    HB2  ASP   6           2HB      ASP   6   2.618   5.156  11.567
   46    HB3  ASP   6           1HB      ASP   6   2.096   3.534  12.011
   47    H    GLU   7           H        GLU   7   3.431   1.330  11.996
   48    HA   GLU   7           HA       GLU   7   3.811   0.566   9.188
   49    HB2  GLU   7           2HB      GLU   7   3.206  -1.252  11.523
   50    HB3  GLU   7           1HB      GLU   7   3.785  -1.717   9.930
   51    HG2  GLU   7           2HG      GLU   7   5.933  -0.872  10.343
   52    HG3  GLU   7           1HG      GLU   7   5.394   0.042  11.749
   53    H    VAL   8           H        VAL   8   2.146  -0.014   7.896
   54    HA   VAL   8           HA       VAL   8  -0.531  -0.220   9.105
   55    HB   VAL   8           HB       VAL   8   0.023   1.196   6.496
   56   HG11  VAL   8          1HG1      VAL   8  -2.236   1.738   6.432
   57   HG12  VAL   8          2HG1      VAL   8  -2.470   1.396   8.145
   58   HG13  VAL   8          3HG1      VAL   8  -2.243   0.071   7.004
   59   HG21  VAL   8          3HG2      VAL   8  -0.826   3.180   8.049
   60   HG22  VAL   8          1HG2      VAL   8   0.882   2.771   7.895
   61   HG23  VAL   8          2HG2      VAL   8  -0.039   2.200   9.285
   62    H    GLU   9           H        GLU   9  -1.888  -1.717   8.234
   63    HA   GLU   9           HA       GLU   9  -0.715  -3.811   6.680
   64    HB2  GLU   9           2HB      GLU   9  -3.490  -3.343   7.764
   65    HB3  GLU   9           1HB      GLU   9  -3.105  -4.731   6.757
   66    HG2  GLU   9           2HG      GLU   9  -1.542  -5.553   8.372
   67    HG3  GLU   9           1HG      GLU   9  -1.690  -4.084   9.333
   68    H    ILE  10           H        ILE  10  -1.048  -4.374   4.587
   69    HA   ILE  10           HA       ILE  10  -1.595  -2.413   2.683
   70    HB   ILE  10           HB       ILE  10  -0.278  -4.456   2.233
   71   HG12  ILE  10          2HG1      ILE  10  -1.287  -4.912  -0.052
   72   HG13  ILE  10          1HG1      ILE  10  -2.612  -3.852   0.415
   73   HG21  ILE  10          1HG2      ILE  10  -2.969  -5.809   2.275
   74   HG22  ILE  10          2HG2      ILE  10  -1.589  -6.133   3.323
   75   HG23  ILE  10          3HG2      ILE  10  -1.506  -6.530   1.607
   76   HD11  ILE  10          3HD1      ILE  10  -1.407  -2.006   0.076
   77   HD12  ILE  10          1HD1      ILE  10  -0.359  -3.063  -0.868
   78   HD13  ILE  10          2HD1      ILE  10   0.043  -2.695   0.808
   79    H    GLU  11           H        GLU  11  -3.768  -4.626   4.313
   80    HA   GLU  11           HA       GLU  11  -5.942  -4.542   2.538
   81    HB2  GLU  11           2HB      GLU  11  -7.336  -5.029   4.588
   82    HB3  GLU  11           1HB      GLU  11  -6.018  -6.151   4.287
   83    HG2  GLU  11           2HG      GLU  11  -4.977  -5.633   6.200
   84    HG3  GLU  11           1HG      GLU  11  -5.306  -3.911   6.030
   85    H    ASP  12           H        ASP  12  -4.839  -2.269   4.977
   86    HA   ASP  12           HA       ASP  12  -7.191  -0.632   4.917
   87    HB2  ASP  12           2HB      ASP  12  -5.230  -0.844   6.715
   88    HB3  ASP  12           1HB      ASP  12  -4.567   0.496   5.782
   89    H    PHE  13           H        PHE  13  -4.189  -0.777   3.132
   90    HA   PHE  13           HA       PHE  13  -4.170   1.800   2.008
   91    HB2  PHE  13           2HB      PHE  13  -2.910  -0.816   1.380
   92    HB3  PHE  13           1HB      PHE  13  -2.973   0.356   0.075
   93    HD1  PHE  13           2HD      PHE  13  -2.017   0.153   3.683
   94    HD2  PHE  13           1HD      PHE  13  -1.235   1.822  -0.153
   95    HE1  PHE  13           2HE      PHE  13  -0.007   1.259   4.575
   96    HE2  PHE  13           1HE      PHE  13   0.774   2.926   0.730
   97    HZ   PHE  13           HZ       PHE  13   1.392   2.647   3.097
   98    H    GLN  14           H        GLN  14  -4.362   2.091  -0.480
   99    HA   GLN  14           HA       GLN  14  -6.940   0.946  -1.341
  100    HB2  GLN  14           2HB      GLN  14  -6.505   3.554  -0.867
  101    HB3  GLN  14           1HB      GLN  14  -5.974   3.486  -2.541
  102    HG2  GLN  14           2HG      GLN  14  -8.279   2.205  -2.825
  103    HG3  GLN  14           1HG      GLN  14  -8.682   3.148  -1.391
  104   HE21  GLN  14          1HE2      GLN  14  -9.275   5.212  -1.648
  105   HE22  GLN  14          2HE2      GLN  14  -9.167   6.101  -3.124
  106    H    TYR  15           H        TYR  15  -6.553  -0.609  -2.805
  107    HA   TYR  15           HA       TYR  15  -4.236  -0.724  -4.428
  108    HB2  TYR  15           2HB      TYR  15  -5.483  -2.749  -3.842
  109    HB3  TYR  15           1HB      TYR  15  -6.879  -2.170  -4.746
  110    HD1  TYR  15           2HD      TYR  15  -3.224  -2.742  -5.341
  111    HD2  TYR  15           1HD      TYR  15  -7.190  -3.096  -6.836
  112    HE1  TYR  15           2HE      TYR  15  -2.355  -3.837  -7.361
  113    HE2  TYR  15           1HE      TYR  15  -6.334  -4.191  -8.864
  114    HH   TYR  15           HH       TYR  15  -3.403  -5.532  -9.135
  115    H    ASP  16           H        ASP  16  -3.833  -0.037  -6.451
  116    HA   ASP  16           HA       ASP  16  -5.944   1.522  -7.789
  117    HB2  ASP  16           2HB      ASP  16  -3.814   2.693  -6.918
  118    HB3  ASP  16           1HB      ASP  16  -2.989   1.897  -8.253
  119    H    GLU  17           H        GLU  17  -6.815   0.016  -9.139
  120    HA   GLU  17           HA       GLU  17  -5.463  -1.989 -10.537
  121    HB2  GLU  17           2HB      GLU  17  -7.465  -1.840 -12.138
  122    HB3  GLU  17           1HB      GLU  17  -7.790  -2.236 -10.458
  123    HG2  GLU  17           2HG      GLU  17  -8.821  -0.238 -10.042
  124    HG3  GLU  17           1HG      GLU  17  -7.912   0.616 -11.286
  125    H    ASP  18           H        ASP  18  -5.754   1.406 -11.217
  126    HA   ASP  18           HA       ASP  18  -5.392   1.612 -13.921
  127    HB2  ASP  18           2HB      ASP  18  -5.432   3.406 -11.916
  128    HB3  ASP  18           1HB      ASP  18  -3.708   3.414 -12.259
  129    H    SER  19           H        SER  19  -2.763   1.346 -11.506
  130    HA   SER  19           HA       SER  19  -1.131  -0.022 -13.499
  131    HB2  SER  19           2HB      SER  19   0.084   2.298 -12.006
  132    HB3  SER  19           1HB      SER  19   0.711   1.450 -13.417
  133    HG   SER  19           HG       SER  19  -0.926   3.590 -13.305
  134    H    GLU  20           H        GLU  20  -2.436  -0.817 -10.993
  135    HA   GLU  20           HA       GLU  20  -2.041  -1.977  -9.077
  136    HB2  GLU  20           2HB      GLU  20   0.636  -2.598 -10.321
  137    HB3  GLU  20           1HB      GLU  20  -0.243  -3.565  -9.148
  138    HG2  GLU  20           2HG      GLU  20  -1.765  -4.322 -10.717
  139    HG3  GLU  20           1HG      GLU  20  -1.456  -2.979 -11.815
  140    H    THR  21           H        THR  21  -1.920   0.204  -8.032
  141    HA   THR  21           HA       THR  21   0.622   0.435  -6.586
  142    HB   THR  21           HB       THR  21  -0.869   2.903  -7.475
  143    HG1  THR  21           1HG      THR  21   1.142   1.474  -8.858
  144   HG21  THR  21          3HG2      THR  21   0.854   4.115  -6.694
  145   HG22  THR  21          1HG2      THR  21   2.052   2.892  -7.115
  146   HG23  THR  21          2HG2      THR  21   1.083   2.710  -5.653
  147    H    TYR  22           H        TYR  22   0.427   1.051  -4.430
  148    HA   TYR  22           HA       TYR  22  -2.343   1.239  -3.436
  149    HB2  TYR  22           2HB      TYR  22   0.055   0.218  -1.905
  150    HB3  TYR  22           1HB      TYR  22  -1.628   0.166  -1.395
  151    HD1  TYR  22           2HD      TYR  22   0.677  -1.107  -4.031
  152    HD2  TYR  22           1HD      TYR  22  -2.931  -1.721  -1.860
  153    HE1  TYR  22           2HE      TYR  22   0.447  -3.326  -5.053
  154    HE2  TYR  22           1HE      TYR  22  -3.170  -3.945  -2.877
  155    HH   TYR  22           HH       TYR  22  -1.513  -5.686  -3.911
  156    H    PHE  23           H        PHE  23  -2.904   2.860  -2.040
  157    HA   PHE  23           HA       PHE  23  -0.780   4.750  -1.261
  158    HB2  PHE  23           2HB      PHE  23  -3.542   5.548  -2.193
  159    HB3  PHE  23           1HB      PHE  23  -2.221   6.628  -1.768
  160    HD1  PHE  23           2HD      PHE  23  -3.110   3.915  -4.163
  161    HD2  PHE  23           1HD      PHE  23  -0.820   7.428  -3.428
  162    HE1  PHE  23           2HE      PHE  23  -2.368   3.918  -6.506
  163    HE2  PHE  23           1HE      PHE  23  -0.077   7.438  -5.772
  164    HZ   PHE  23           HZ       PHE  23  -0.849   5.680  -7.315
  165    H    TYR  24           H        TYR  24  -1.259   6.096   0.593
  166    HA   TYR  24           HA       TYR  24  -3.428   5.140   2.320
  167    HB2  TYR  24           2HB      TYR  24  -1.214   3.982   2.848
  168    HB3  TYR  24           1HB      TYR  24  -0.641   5.554   3.393
  169    HD1  TYR  24           1HD      TYR  24  -3.632   3.356   3.890
  170    HD2  TYR  24           2HD      TYR  24  -0.765   5.954   5.663
  171    HE1  TYR  24           1HE      TYR  24  -4.633   2.947   6.096
  172    HE2  TYR  24           2HE      TYR  24  -1.759   5.550   7.875
  173    HH   TYR  24           HH       TYR  24  -4.643   4.474   8.430
  174    HA   PRO  25           HA       PRO  25  -4.137   9.489   2.888
  175    HB2  PRO  25           2HB      PRO  25  -5.209   8.678   5.534
  176    HB3  PRO  25           1HB      PRO  25  -5.986   9.587   4.234
  177    HG2  PRO  25           2HG      PRO  25  -6.650   7.050   4.714
  178    HG3  PRO  25           1HG      PRO  25  -6.554   7.674   3.057
  179    HD2  PRO  25           2HD      PRO  25  -4.611   5.961   4.554
  180    HD3  PRO  25           1HD      PRO  25  -5.109   5.880   2.851
  181    H    CYS  26           H        CYS  26  -2.652  10.937   3.462
  182    HA   CYS  26           HA       CYS  26  -0.925  10.387   5.761
  183    HB2  CYS  26           2HB      CYS  26  -0.384  11.331   3.198
  184    HB3  CYS  26           1HB      CYS  26  -0.251  12.761   4.220
  185    HA   PRO  27           HA       PRO  27  -2.922  13.448   8.257
  186    HB2  PRO  27           2HB      PRO  27  -0.865  14.112   9.908
  187    HB3  PRO  27           1HB      PRO  27  -1.770  12.600  10.049
  188    HG2  PRO  27           2HG      PRO  27   0.886  13.106   8.765
  189    HG3  PRO  27           1HG      PRO  27   0.379  11.756   9.795
  190    HD2  PRO  27           2HD      PRO  27   0.526  11.553   7.103
  191    HD3  PRO  27           1HD      PRO  27  -0.675  10.662   8.063
  192    H    CYS  28           H        CYS  28  -0.119  14.175   6.345
  193    HA   CYS  28           HA       CYS  28  -0.055  16.981   6.969
  194    HB2  CYS  28           2HB      CYS  28   1.597  17.138   5.169
  195    HB3  CYS  28           1HB      CYS  28   1.977  15.801   6.247
  196    H    GLY  29           H        GLY  29  -1.560  14.961   4.512
  197    HA2  GLY  29           2HA      GLY  29  -3.711  16.331   3.829
  198    HA3  GLY  29           1HA      GLY  29  -2.488  17.300   3.020
  199    H    ASP  30           H        ASP  30  -0.770  15.405   2.049
  200    HA   ASP  30           HA       ASP  30  -2.260  14.376  -0.185
  201    HB2  ASP  30           2HB      ASP  30   0.267  15.299   0.077
  202    HB3  ASP  30           1HB      ASP  30   0.573  13.569   0.180
  203    H    ASN  31           H        ASN  31  -0.844  11.991  -0.761
  204    HA   ASN  31           HA       ASN  31  -1.452  10.205   1.477
  205    HB2  ASN  31           2HB      ASN  31  -2.484   9.691  -1.322
  206    HB3  ASN  31           1HB      ASN  31  -2.774   8.713   0.112
  207   HD21  ASN  31          1HD2      ASN  31  -3.403  11.859  -1.359
  208   HD22  ASN  31          2HD2      ASN  31  -4.871  12.162  -0.500
  209    H    PHE  32           H        PHE  32  -0.164   8.432   1.610
  210    HA   PHE  32           HA       PHE  32   2.318   8.424   0.277
  211    HB2  PHE  32           2HB      PHE  32   0.892   6.523   2.097
  212    HB3  PHE  32           1HB      PHE  32   2.340   5.973   1.261
  213    HD1  PHE  32           2HD      PHE  32   4.435   7.486   1.489
  214    HD2  PHE  32           1HD      PHE  32   1.088   7.637   4.114
  215    HE1  PHE  32           2HE      PHE  32   5.840   8.533   3.215
  216    HE2  PHE  32           1HE      PHE  32   2.489   8.687   5.843
  217    HZ   PHE  32           HZ       PHE  32   4.868   9.134   5.395
  218    H    SER  33           H        SER  33   3.211   6.592  -1.016
  219    HA   SER  33           HA       SER  33   1.237   5.159  -2.627
  220    HB2  SER  33           2HB      SER  33   3.450   6.667  -4.012
  221    HB3  SER  33           1HB      SER  33   1.998   5.958  -4.715
  222    HG   SER  33           HG       SER  33   2.374   8.420  -3.595
  223    H    ILE  34           H        ILE  34   1.907   3.199  -3.361
  224    HA   ILE  34           HA       ILE  34   4.717   2.489  -3.398
  225    HB   ILE  34           HB       ILE  34   4.153   2.033  -1.064
  226   HG12  ILE  34          2HG1      ILE  34   4.255  -0.691  -2.284
  227   HG13  ILE  34          1HG1      ILE  34   5.553   0.438  -2.659
  228   HG21  ILE  34          1HG2      ILE  34   2.309  -0.178  -1.702
  229   HG22  ILE  34          2HG2      ILE  34   1.663   1.452  -1.889
  230   HG23  ILE  34          3HG2      ILE  34   2.319   0.938  -0.336
  231   HD11  ILE  34          3HD1      ILE  34   4.940   0.299   0.181
  232   HD12  ILE  34          1HD1      ILE  34   6.487   0.186  -0.658
  233   HD13  ILE  34          2HD1      ILE  34   5.459  -1.238  -0.506
  234    H    THR  35           H        THR  35   5.070   1.279  -5.139
  235    HA   THR  35           HA       THR  35   2.920   0.315  -6.746
  236    HB   THR  35           HB       THR  35   4.930  -0.764  -8.024
  237    HG1  THR  35           1HG      THR  35   6.756  -0.544  -7.034
  238   HG21  THR  35          3HG2      THR  35   5.105   2.211  -7.807
  239   HG22  THR  35          1HG2      THR  35   3.712   1.428  -8.553
  240   HG23  THR  35          2HG2      THR  35   5.325   1.180  -9.220
  241    H    LYS  36           H        LYS  36   2.388  -1.815  -7.304
  242    HA   LYS  36           HA       LYS  36   2.344  -3.684  -5.210
  243    HB2  LYS  36           2HB      LYS  36   0.735  -3.581  -7.138
  244    HB3  LYS  36           1HB      LYS  36   1.986  -4.287  -8.153
  245    HG2  LYS  36           2HG      LYS  36   1.244  -5.708  -5.650
  246    HG3  LYS  36           1HG      LYS  36   0.121  -5.760  -7.011
  247    HD2  LYS  36           2HD      LYS  36   2.484  -6.290  -8.251
  248    HD3  LYS  36           1HD      LYS  36   2.750  -7.033  -6.673
  249    HE2  LYS  36           2HE      LYS  36   1.771  -8.785  -7.760
  250    HE3  LYS  36           1HE      LYS  36   0.334  -8.000  -7.107
  251    HZ1  LYS  36           3HZ      LYS  36  -0.239  -7.151  -9.166
  252    HZ2  LYS  36           1HZ      LYS  36   0.373  -8.674  -9.574
  253    HZ3  LYS  36           2HZ      LYS  36   1.324  -7.294  -9.797
  254    H    GLU  37           H        GLU  37   4.481  -3.366  -8.009
  255    HA   GLU  37           HA       GLU  37   5.837  -5.810  -7.762
  256    HB2  GLU  37           2HB      GLU  37   5.912  -4.015  -9.651
  257    HB3  GLU  37           1HB      GLU  37   7.221  -3.319  -8.704
  258    HG2  GLU  37           2HG      GLU  37   8.538  -4.668  -9.888
  259    HG3  GLU  37           1HG      GLU  37   7.959  -5.936  -8.810
  260    H    ASP  38           H        ASP  38   6.349  -2.687  -6.184
  261    HA   ASP  38           HA       ASP  38   8.858  -3.177  -5.042
  262    HB2  ASP  38           2HB      ASP  38   6.583  -1.347  -4.447
  263    HB3  ASP  38           1HB      ASP  38   7.772  -1.584  -3.172
  264    H    LEU  39           H        LEU  39   5.596  -3.766  -3.750
  265    HA   LEU  39           HA       LEU  39   6.420  -4.868  -1.287
  266    HB2  LEU  39           2HB      LEU  39   3.893  -5.498  -2.812
  267    HB3  LEU  39           1HB      LEU  39   4.160  -5.709  -1.093
  268    HG   LEU  39           HG       LEU  39   4.412  -2.968  -2.258
  269   HD11  LEU  39          1HD1      LEU  39   2.331  -3.832  -3.192
  270   HD12  LEU  39          2HD1      LEU  39   2.021  -2.597  -1.972
  271   HD13  LEU  39          3HD1      LEU  39   1.796  -4.302  -1.579
  272   HD21  LEU  39          3HD2      LEU  39   3.744  -2.268  -0.085
  273   HD22  LEU  39          1HD2      LEU  39   4.968  -3.520   0.126
  274   HD23  LEU  39          2HD2      LEU  39   3.264  -3.904   0.364
  275    H    GLU  40           H        GLU  40   5.885  -6.285  -4.477
  276    HA   GLU  40           HA       GLU  40   6.012  -8.999  -3.727
  277    HB2  GLU  40           2HB      GLU  40   6.476  -7.507  -6.280
  278    HB3  GLU  40           1HB      GLU  40   6.896  -9.210  -6.184
  279    HG2  GLU  40           2HG      GLU  40   4.262  -8.745  -5.127
  280    HG3  GLU  40           1HG      GLU  40   4.410  -8.122  -6.768
  281    H    ASN  41           H        ASN  41   8.521  -6.613  -4.354
  282    HA   ASN  41           HA       ASN  41  10.632  -8.615  -4.295
  283    HB2  ASN  41           2HB      ASN  41  10.460  -5.725  -4.964
  284    HB3  ASN  41           1HB      ASN  41  12.000  -6.306  -4.337
  285   HD21  ASN  41          1HD2      ASN  41  10.758  -5.489  -7.078
  286   HD22  ASN  41          2HD2      ASN  41  11.381  -6.699  -8.142
  287    H    GLY  42           H        GLY  42   9.323  -6.101  -2.199
  288    HA2  GLY  42           2HA      GLY  42   9.730  -6.907   0.234
  289    HA3  GLY  42           1HA      GLY  42  11.411  -6.650  -0.208
  290    H    GLU  43           H        GLU  43  10.133  -4.326  -1.955
  291    HA   GLU  43           HA       GLU  43  10.799  -2.235  -0.164
  292    HB2  GLU  43           2HB      GLU  43   9.591  -2.336  -2.914
  293    HB3  GLU  43           1HB      GLU  43   9.677  -0.814  -2.040
  294    HG2  GLU  43           2HG      GLU  43  12.001  -2.576  -2.780
  295    HG3  GLU  43           1HG      GLU  43  11.547  -1.057  -3.554
  296    H    ASP  44           H        ASP  44   9.395  -2.775   1.602
  297    HA   ASP  44           HA       ASP  44   6.551  -2.209   1.250
  298    HB2  ASP  44           2HB      ASP  44   6.435  -2.919   3.689
  299    HB3  ASP  44           1HB      ASP  44   6.910  -4.162   2.544
  300    H    VAL  45           H        VAL  45   8.285  -0.036   0.877
  301    HA   VAL  45           HA       VAL  45   7.617   1.620   3.214
  302    HB   VAL  45           HB       VAL  45  10.042   1.295   3.102
  303   HG11  VAL  45          1HG1      VAL  45  11.382   1.852   1.275
  304   HG12  VAL  45          2HG1      VAL  45  10.101   2.785   0.501
  305   HG13  VAL  45          3HG1      VAL  45  10.005   1.026   0.547
  306   HG21  VAL  45          3HG2      VAL  45   9.008   3.450   3.866
  307   HG22  VAL  45          1HG2      VAL  45   9.367   4.108   2.269
  308   HG23  VAL  45          2HG2      VAL  45  10.680   3.576   3.320
  309    H    ALA  46           H        ALA  46   6.528   3.453   2.842
  310    HA   ALA  46           HA       ALA  46   6.052   4.192   0.033
  311    HB1  ALA  46           1HB      ALA  46   3.861   4.498   0.452
  312    HB2  ALA  46           2HB      ALA  46   4.150   5.169   2.057
  313    HB3  ALA  46           3HB      ALA  46   4.167   3.422   1.815
  314    H    THR  47           H        THR  47   6.403   6.257  -0.606
  315    HA   THR  47           HA       THR  47   7.359   8.136   1.453
  316    HB   THR  47           HB       THR  47   8.261   8.471  -1.366
  317    HG1  THR  47           1HG      THR  47   9.276   6.457   0.357
  318   HG21  THR  47          3HG2      THR  47   9.133  10.070   0.111
  319   HG22  THR  47          1HG2      THR  47  10.438   8.917  -0.168
  320   HG23  THR  47          2HG2      THR  47   9.512   8.854   1.332
  321    H    CYS  48           H        CYS  48   6.392  10.058   1.592
  322    HA   CYS  48           HA       CYS  48   4.237  10.664  -0.280
  323    HB2  CYS  48           2HB      CYS  48   3.908  10.727   2.232
  324    HB3  CYS  48           1HB      CYS  48   4.940  12.154   2.254
  325    HA   PRO  49           HA       PRO  49   6.787  13.695  -2.315
  326    HB2  PRO  49           2HB      PRO  49   4.890  14.835  -3.860
  327    HB3  PRO  49           1HB      PRO  49   5.528  13.217  -4.182
  328    HG2  PRO  49           2HG      PRO  49   2.975  14.017  -2.844
  329    HG3  PRO  49           1HG      PRO  49   3.266  12.721  -4.017
  330    HD2  PRO  49           2HD      PRO  49   3.061  12.309  -1.324
  331    HD3  PRO  49           1HD      PRO  49   4.005  11.266  -2.407
  332    H    SER  50           H        SER  50   4.399  14.406  -0.015
  333    HA   SER  50           HA       SER  50   4.798  17.300  -0.267
  334    HB2  SER  50           2HB      SER  50   2.487  15.897   0.158
  335    HB3  SER  50           1HB      SER  50   2.931  16.351   1.802
  336    HG   SER  50           HG       SER  50   2.966  18.504   1.163
  337    H    CYS  51           H        CYS  51   4.447  15.008   2.466
  338    HA   CYS  51           HA       CYS  51   6.093  16.687   4.136
  339    HB2  CYS  51           2HB      CYS  51   5.661  15.059   5.891
  340    HB3  CYS  51           1HB      CYS  51   4.162  15.477   5.068
  341    H    SER  52           H        SER  52   6.573  13.852   2.170
  342    HA   SER  52           HA       SER  52   8.439  12.696   1.583
  343    HB2  SER  52           2HB      SER  52  10.107  14.675   3.134
  344    HB3  SER  52           1HB      SER  52  10.565  13.739   1.713
  345    HG   SER  52           HG       SER  52   9.060  15.001   0.513
  346    H    LEU  53           H        LEU  53   7.017  11.815   3.774
  347    HA   LEU  53           HA       LEU  53   9.027  11.011   5.752
  348    HB2  LEU  53           2HB      LEU  53   6.046  11.175   5.746
  349    HB3  LEU  53           1HB      LEU  53   6.815  10.013   6.810
  350    HG   LEU  53           HG       LEU  53   7.687  12.878   6.868
  351   HD11  LEU  53          1HD1      LEU  53   5.100  11.775   7.790
  352   HD12  LEU  53          2HD1      LEU  53   5.520  13.404   7.259
  353   HD13  LEU  53          3HD1      LEU  53   5.947  12.869   8.884
  354   HD21  LEU  53          3HD2      LEU  53   8.741  10.810   8.106
  355   HD22  LEU  53          1HD2      LEU  53   7.411  11.084   9.231
  356   HD23  LEU  53          2HD2      LEU  53   8.579  12.367   8.916
  357    H    ILE  54           H        ILE  54   8.384   8.665   6.658
  358    HA   ILE  54           HA       ILE  54   8.090   6.857   4.348
  359    HB   ILE  54           HB       ILE  54   9.732   5.328   5.554
  360   HG12  ILE  54          2HG1      ILE  54  10.555   7.916   6.890
  361   HG13  ILE  54          1HG1      ILE  54   9.687   6.618   7.703
  362   HG21  ILE  54          1HG2      ILE  54  11.729   6.673   4.687
  363   HG22  ILE  54          2HG2      ILE  54  10.539   7.886   4.212
  364   HG23  ILE  54          3HG2      ILE  54  10.456   6.258   3.539
  365   HD11  ILE  54          3HD1      ILE  54  12.455   6.495   6.536
  366   HD12  ILE  54          1HD1      ILE  54  11.586   5.111   7.195
  367   HD13  ILE  54          2HD1      ILE  54  12.010   6.465   8.242
  368    H    ILE  55           H        ILE  55   6.996   4.952   4.697
  369    HA   ILE  55           HA       ILE  55   6.061   4.334   7.401
  370    HB   ILE  55           HB       ILE  55   3.745   3.957   6.579
  371   HG12  ILE  55          2HG1      ILE  55   4.312   5.727   4.234
  372   HG13  ILE  55          1HG1      ILE  55   4.645   4.005   4.096
  373   HG21  ILE  55          1HG2      ILE  55   3.094   6.341   6.550
  374   HG22  ILE  55          2HG2      ILE  55   4.795   6.774   6.389
  375   HG23  ILE  55          3HG2      ILE  55   4.230   5.945   7.838
  376   HD11  ILE  55          3HD1      ILE  55   2.309   3.531   4.701
  377   HD12  ILE  55          1HD1      ILE  55   2.455   4.496   3.232
  378   HD13  ILE  55          2HD1      ILE  55   1.996   5.265   4.751
  379    H    LYS  56           H        LYS  56   5.486   2.162   7.730
  380    HA   LYS  56           HA       LYS  56   6.585   0.342   5.729
  381    HB2  LYS  56           2HB      LYS  56   7.356   0.149   8.070
  382    HB3  LYS  56           1HB      LYS  56   5.710  -0.207   8.572
  383    HG2  LYS  56           2HG      LYS  56   6.778  -2.284   8.470
  384    HG3  LYS  56           1HG      LYS  56   5.821  -2.196   6.990
  385    HD2  LYS  56           2HD      LYS  56   7.889  -3.006   6.271
  386    HD3  LYS  56           1HD      LYS  56   7.962  -1.282   5.900
  387    HE2  LYS  56           2HE      LYS  56   9.979  -1.497   6.921
  388    HE3  LYS  56           1HE      LYS  56   8.991  -1.197   8.350
  389    HZ1  LYS  56           3HZ      LYS  56   9.982  -3.808   7.354
  390    HZ2  LYS  56           1HZ      LYS  56   8.801  -3.672   8.558
  391    HZ3  LYS  56           2HZ      LYS  56  10.352  -3.052   8.820
  392    H    VAL  57           H        VAL  57   5.500  -1.091   4.611
  393    HA   VAL  57           HA       VAL  57   2.585  -1.149   4.961
  394    HB   VAL  57           HB       VAL  57   3.755  -2.190   2.441
  395   HG11  VAL  57          1HG1      VAL  57   1.373  -2.131   2.756
  396   HG12  VAL  57          2HG1      VAL  57   1.812  -0.943   1.529
  397   HG13  VAL  57          3HG1      VAL  57   1.434  -0.419   3.170
  398   HG21  VAL  57          3HG2      VAL  57   3.598   0.395   1.725
  399   HG22  VAL  57          1HG2      VAL  57   5.103  -0.380   2.209
  400   HG23  VAL  57          2HG2      VAL  57   4.197   0.587   3.371
  401    H    ILE  58           H        ILE  58   1.888  -2.910   5.973
  402    HA   ILE  58           HA       ILE  58   3.429  -5.387   5.829
  403    HB   ILE  58           HB       ILE  58   0.962  -4.858   7.487
  404   HG12  ILE  58          2HG1      ILE  58   2.744  -3.240   8.042
  405   HG13  ILE  58          1HG1      ILE  58   2.466  -4.379   9.355
  406   HG21  ILE  58          1HG2      ILE  58   3.062  -7.008   7.486
  407   HG22  ILE  58          2HG2      ILE  58   1.313  -7.176   7.334
  408   HG23  ILE  58          3HG2      ILE  58   2.023  -6.707   8.879
  409   HD11  ILE  58          3HD1      ILE  58   4.436  -5.659   8.620
  410   HD12  ILE  58          1HD1      ILE  58   4.825  -3.998   9.073
  411   HD13  ILE  58          2HD1      ILE  58   4.728  -4.448   7.370
  412    H    TYR  59           H        TYR  59   2.780  -7.186   4.792
  413    HA   TYR  59           HA       TYR  59   0.037  -7.546   3.938
  414    HB2  TYR  59           2HB      TYR  59   0.783  -7.863   1.516
  415    HB3  TYR  59           1HB      TYR  59   0.723  -6.201   2.097
  416    HD1  TYR  59           1HD      TYR  59   2.843  -5.044   2.719
  417    HD2  TYR  59           2HD      TYR  59   2.832  -8.825   0.766
  418    HE1  TYR  59           1HE      TYR  59   5.198  -4.726   2.106
  419    HE2  TYR  59           2HE      TYR  59   5.190  -8.514   0.143
  420    HH   TYR  59           HH       TYR  59   7.217  -6.715   1.485
  421    H    ASP  60           H        ASP  60   0.029  -9.622   2.387
  422    HA   ASP  60           HA       ASP  60   1.464 -11.665   3.892
  423    HB2  ASP  60           2HB      ASP  60  -1.066 -11.721   3.319
  424    HB3  ASP  60           1HB      ASP  60  -0.537 -12.227   1.716
  425    H    LYS  61           H        LYS  61   3.542 -11.607   3.106
  426    HA   LYS  61           HA       LYS  61   4.313 -11.377   0.433
  427    HB2  LYS  61           2HB      LYS  61   5.616 -12.438   2.895
  428    HB3  LYS  61           1HB      LYS  61   6.366 -12.789   1.343
  429    HG2  LYS  61           2HG      LYS  61   5.990 -10.167   1.036
  430    HG3  LYS  61           1HG      LYS  61   6.113 -10.228   2.796
  431    HD2  LYS  61           2HD      LYS  61   8.301 -10.866   2.756
  432    HD3  LYS  61           1HD      LYS  61   8.132 -11.742   1.233
  433    HE2  LYS  61           2HE      LYS  61   7.879  -8.768   1.250
  434    HE3  LYS  61           1HE      LYS  61   9.481  -9.496   1.343
  435    HZ1  LYS  61           3HZ      LYS  61   8.863 -10.777  -0.697
  436    HZ2  LYS  61           1HZ      LYS  61   9.011  -9.107  -0.928
  437    HZ3  LYS  61           2HZ      LYS  61   7.479  -9.815  -0.823
  438    H    ASP  62           H        ASP  62   3.218 -14.174   2.245
  439    HA   ASP  62           HA       ASP  62   4.111 -16.170   0.457
  440    HB2  ASP  62           2HB      ASP  62   2.098 -16.029   2.653
  441    HB3  ASP  62           1HB      ASP  62   1.986 -17.380   1.528
  442    H    GLN  63           H        GLN  63   1.233 -14.137   0.535
  443    HA   GLN  63           HA       GLN  63   0.002 -15.556  -1.673
  444    HB2  GLN  63           2HB      GLN  63  -0.767 -13.324   0.133
  445    HB3  GLN  63           1HB      GLN  63  -1.516 -13.359  -1.460
  446    HG2  GLN  63           2HG      GLN  63  -1.850 -15.927  -0.711
  447    HG3  GLN  63           1HG      GLN  63  -1.902 -15.127   0.857
  448   HE21  GLN  63          1HE2      GLN  63  -3.288 -13.010   0.736
  449   HE22  GLN  63          2HE2      GLN  63  -4.840 -13.214   0.005
  450    H    PHE  64           H        PHE  64   1.786 -12.566  -1.130
  451    HA   PHE  64           HA       PHE  64   1.360 -11.358  -3.630
  452    HB2  PHE  64           2HB      PHE  64   3.372 -11.063  -1.455
  453    HB3  PHE  64           1HB      PHE  64   3.774 -10.381  -3.028
  454    HD1  PHE  64           1HD      PHE  64   0.746 -10.527  -0.840
  455    HD2  PHE  64           2HD      PHE  64   3.347  -8.144  -3.221
  456    HE1  PHE  64           1HE      PHE  64  -0.609  -8.541  -0.326
  457    HE2  PHE  64           2HE      PHE  64   1.996  -6.152  -2.710
  458    HZ   PHE  64           HZ       PHE  64   0.016  -6.348  -1.260
  459    H    VAL  65           H        VAL  65   4.284 -13.136  -2.551
  460    HA   VAL  65           HA       VAL  65   4.797 -13.775  -5.380
  461    HB   VAL  65           HB       VAL  65   6.549 -12.386  -4.400
  462   HG11  VAL  65          1HG1      VAL  65   6.152 -13.807  -2.083
  463   HG12  VAL  65          2HG1      VAL  65   7.476 -12.685  -2.394
  464   HG13  VAL  65          3HG1      VAL  65   7.704 -14.412  -2.659
  465   HG21  VAL  65          3HG2      VAL  65   7.712 -13.503  -5.948
  466   HG22  VAL  65          1HG2      VAL  65   6.997 -15.051  -5.497
  467   HG23  VAL  65          2HG2      VAL  65   8.381 -14.425  -4.602
  468    H    SER  66           H        SER  66   3.707 -15.665  -5.574
  469    HA   SER  66           HA       SER  66   4.841 -17.953  -4.136
  470    HB2  SER  66           2HB      SER  66   2.438 -16.968  -3.372
  471    HB3  SER  66           1HB      SER  66   1.926 -18.085  -4.635
  472    HG   SER  66           HG       SER  66   2.994 -19.746  -3.537
  473    H    GLY  67           H        GLY  67   5.259 -16.941  -6.840
  474    HA2  GLY  67           2HA      GLY  67   3.787 -18.763  -8.564
  475    HA3  GLY  67           1HA      GLY  67   4.963 -17.563  -9.078
  476    H    GLU  68           H        GLU  68   7.145 -18.093  -9.140
  477    HA   GLU  68           HA       GLU  68   7.692 -20.978  -8.992
  478    HB2  GLU  68           2HB      GLU  68   8.673 -18.778 -10.738
  479    HB3  GLU  68           1HB      GLU  68   9.797 -20.075 -10.361
  480    HG2  GLU  68           2HG      GLU  68   8.872 -20.883 -12.272
  481    HG3  GLU  68           1HG      GLU  68   7.791 -21.601 -11.079
  482    H    THR  69           H        THR  69   7.988 -20.795  -6.673
  483    HA   THR  69           HA       THR  69  10.415 -19.391  -5.838
  484    HB   THR  69           HB       THR  69   8.538 -18.949  -4.421
  485    HG1  THR  69           1HG      THR  69  10.494 -19.287  -3.311
  486   HG21  THR  69          3HG2      THR  69   6.892 -20.435  -4.323
  487   HG22  THR  69          1HG2      THR  69   7.850 -21.234  -3.077
  488   HG23  THR  69          2HG2      THR  69   7.951 -21.776  -4.752
  489    H    VAL  70           H        VAL  70  12.106 -20.626  -6.490
  490    HA   VAL  70           HA       VAL  70  12.392 -23.237  -5.195
  491    HB   VAL  70           HB       VAL  70  11.633 -23.681  -7.489
  492   HG11  VAL  70          1HG1      VAL  70  12.618 -22.878  -9.397
  493   HG12  VAL  70          2HG1      VAL  70  14.177 -22.615  -8.615
  494   HG13  VAL  70          3HG1      VAL  70  12.842 -21.504  -8.313
  495   HG21  VAL  70          3HG2      VAL  70  13.038 -25.340  -6.515
  496   HG22  VAL  70          1HG2      VAL  70  14.492 -24.414  -6.890
  497   HG23  VAL  70          2HG2      VAL  70  13.545 -25.134  -8.191
  498    HA   PRO  71           HA       PRO  71  16.340 -21.653  -3.932
  499    HB2  PRO  71           2HB      PRO  71  17.233 -24.475  -4.266
  500    HB3  PRO  71           1HB      PRO  71  17.373 -23.409  -2.864
  501    HG2  PRO  71           2HG      PRO  71  15.572 -25.369  -2.904
  502    HG3  PRO  71           1HG      PRO  71  15.189 -23.793  -2.189
  503    HD2  PRO  71           2HD      PRO  71  14.352 -24.935  -4.818
  504    HD3  PRO  71           1HD      PRO  71  13.444 -23.907  -3.690
  505    H    ALA  72           H        ALA  72  18.132 -20.890  -4.923
  506    HA   ALA  72           HA       ALA  72  19.760 -20.516  -6.466
  507    HB1  ALA  72           1HB      ALA  72  20.778 -22.276  -7.471
  508    HB2  ALA  72           2HB      ALA  72  19.260 -22.979  -8.027
  509    HB3  ALA  72           3HB      ALA  72  19.765 -23.190  -6.351
  510    HA   PRO  73           HA       PRO  73  17.639 -18.730  -9.899
  511    HB2  PRO  73           2HB      PRO  73  19.572 -18.509 -11.781
  512    HB3  PRO  73           1HB      PRO  73  19.545 -17.512 -10.321
  513    HG2  PRO  73           2HG      PRO  73  21.136 -19.983 -10.900
  514    HG3  PRO  73           1HG      PRO  73  21.656 -18.475 -10.124
  515    HD2  PRO  73           2HD      PRO  73  21.029 -20.710  -8.720
  516    HD3  PRO  73           1HD      PRO  73  20.767 -19.073  -8.084
  517    H    SER  74           H        SER  74  16.731 -19.108 -11.960
  518    HA   SER  74           HA       SER  74  16.925 -21.907 -12.844
  519    HB2  SER  74           2HB      SER  74  14.687 -19.926 -12.775
  520    HB3  SER  74           1HB      SER  74  14.676 -21.166 -14.030
  521    HG   SER  74           HG       SER  74  14.867 -21.638 -11.234
  522    H    ALA  75           H        ALA  75  16.667 -18.573 -14.080
  523    HA   ALA  75           HA       ALA  75  17.440 -19.497 -16.745
  524    HB1  ALA  75           1HB      ALA  75  16.480 -17.620 -17.597
  525    HB2  ALA  75           2HB      ALA  75  16.944 -16.620 -16.221
  526    HB3  ALA  75           3HB      ALA  75  15.570 -17.718 -16.090
  527    H    ASN  76           H        ASN  76  19.340 -18.991 -17.726
  528    HA   ASN  76           HA       ASN  76  21.389 -17.738 -16.036
  529    HB2  ASN  76           2HB      ASN  76  21.478 -19.798 -18.203
  530    HB3  ASN  76           1HB      ASN  76  22.900 -18.796 -17.925
  531   HD21  ASN  76          1HD2      ASN  76  20.581 -20.882 -16.244
  532   HD22  ASN  76          2HD2      ASN  76  21.708 -21.487 -15.083
  533    H    LYS  77           H        LYS  77  19.862 -17.554 -19.204
  534    HA   LYS  77           HA       LYS  77  20.661 -14.810 -19.491
  535    HB2  LYS  77           2HB      LYS  77  22.495 -16.570 -20.448
  536    HB3  LYS  77           1HB      LYS  77  21.479 -16.367 -21.869
  537    HG2  LYS  77           2HG      LYS  77  21.812 -13.952 -21.771
  538    HG3  LYS  77           1HG      LYS  77  22.817 -14.146 -20.335
  539    HD2  LYS  77           2HD      LYS  77  24.454 -14.074 -21.918
  540    HD3  LYS  77           1HD      LYS  77  24.126 -15.807 -21.934
  541    HE2  LYS  77           2HE      LYS  77  22.734 -15.590 -23.872
  542    HE3  LYS  77           1HE      LYS  77  22.813 -13.830 -23.790
  543    HZ1  LYS  77           3HZ      LYS  77  25.045 -13.837 -24.449
  544    HZ2  LYS  77           1HZ      LYS  77  24.302 -14.962 -25.469
  545    HZ3  LYS  77           2HZ      LYS  77  25.234 -15.493 -24.161
  546    H    GLU  78           H        GLU  78  18.791 -13.917 -20.083
  547    HA   GLU  78           HA       GLU  78  17.307 -15.109 -22.318
  548    HB2  GLU  78           2HB      GLU  78  16.284 -14.504 -19.577
  549    HB3  GLU  78           1HB      GLU  78  15.213 -14.242 -20.947
  550    HG2  GLU  78           2HG      GLU  78  16.057 -16.700 -21.547
  551    HG3  GLU  78           1HG      GLU  78  16.244 -16.758 -19.795
  552    H    LEU  79           H        LEU  79  17.687 -13.583 -23.827
  553    HA   LEU  79           HA       LEU  79  16.340 -11.110 -23.723
  554    HB2  LEU  79           2HB      LEU  79  18.270  -9.584 -23.806
  555    HB3  LEU  79           1HB      LEU  79  18.125 -10.396 -22.260
  556    HG   LEU  79           HG       LEU  79  20.001 -11.395 -24.391
  557   HD11  LEU  79          1HD1      LEU  79  20.957  -9.340 -24.164
  558   HD12  LEU  79          2HD1      LEU  79  21.701 -10.161 -22.793
  559   HD13  LEU  79          3HD1      LEU  79  20.319  -9.095 -22.538
  560   HD21  LEU  79          3HD2      LEU  79  19.523 -11.924 -21.503
  561   HD22  LEU  79          1HD2      LEU  79  21.169 -12.058 -22.124
  562   HD23  LEU  79          2HD2      LEU  79  19.882 -13.047 -22.814
  563    H    VAL  80           H        VAL  80  15.872 -10.543 -25.748
  564    HA   VAL  80           HA       VAL  80  16.877 -12.042 -27.944
  565    HB   VAL  80           HB       VAL  80  14.579 -11.165 -27.919
  566   HG11  VAL  80          1HG1      VAL  80  15.597  -8.842 -27.006
  567   HG12  VAL  80          2HG1      VAL  80  14.006  -8.991 -27.750
  568   HG13  VAL  80          3HG1      VAL  80  15.380  -8.442 -28.709
  569   HG21  VAL  80          3HG2      VAL  80  14.955  -9.868 -30.279
  570   HG22  VAL  80          1HG2      VAL  80  14.944 -11.621 -30.087
  571   HG23  VAL  80          2HG2      VAL  80  16.475 -10.748 -30.121
  572    H    LYS  81           H        LYS  81  18.745 -11.761 -28.943
  573    HA   LYS  81           HA       LYS  81  19.947  -9.071 -28.981
  574    HB2  LYS  81           2HB      LYS  81  21.236 -11.803 -29.006
  575    HB3  LYS  81           1HB      LYS  81  22.119 -10.312 -29.306
  576    HG2  LYS  81           2HG      LYS  81  21.861  -9.570 -27.115
  577    HG3  LYS  81           1HG      LYS  81  20.516 -10.668 -26.802
  578    HD2  LYS  81           2HD      LYS  81  22.152 -11.817 -25.717
  579    HD3  LYS  81           1HD      LYS  81  22.389 -12.483 -27.334
  580    HE2  LYS  81           2HE      LYS  81  23.952 -10.285 -27.479
  581    HE3  LYS  81           1HE      LYS  81  24.092 -10.658 -25.761
  582    HZ1  LYS  81           3HZ      LYS  81  25.731 -11.989 -26.508
  583    HZ2  LYS  81           1HZ      LYS  81  25.087 -12.122 -28.067
  584    HZ3  LYS  81           2HZ      LYS  81  24.466 -13.069 -26.811
  585    H    LEU  82           H        LEU  82  19.424  -8.173 -30.883
  586    HA   LEU  82           HA       LEU  82  19.207  -9.716 -33.311
  587    HB2  LEU  82           2HB      LEU  82  18.764  -6.868 -32.539
  588    HB3  LEU  82           1HB      LEU  82  19.033  -7.232 -34.232
  589    HG   LEU  82           HG       LEU  82  16.663  -7.124 -33.790
  590   HD11  LEU  82          1HD1      LEU  82  17.818  -9.007 -35.242
  591   HD12  LEU  82          2HD1      LEU  82  16.072  -8.964 -34.997
  592   HD13  LEU  82          3HD1      LEU  82  17.069 -10.056 -34.037
  593   HD21  LEU  82          3HD2      LEU  82  16.531  -7.584 -31.467
  594   HD22  LEU  82          1HD2      LEU  82  17.251  -9.181 -31.671
  595   HD23  LEU  82          2HD2      LEU  82  15.630  -8.859 -32.286
  596    H    GLU  83           H        GLU  83  20.552  -9.655 -35.097
  597    HA   GLU  83           HA       GLU  83  23.081  -8.181 -34.835
  598    HB2  GLU  83           2HB      GLU  83  22.751 -11.116 -35.450
  599    HB3  GLU  83           1HB      GLU  83  24.218 -10.228 -35.834
  600    HG2  GLU  83           2HG      GLU  83  24.690  -9.823 -33.563
  601    HG3  GLU  83           1HG      GLU  83  23.077 -10.320 -33.060
  602    H    HIS  84           H        HIS  84  23.320  -6.899 -36.534
  603    HA   HIS  84           HA       HIS  84  23.241  -6.036 -38.632
  604    HB2  HIS  84           2HB      HIS  84  24.356  -8.403 -38.991
  605    HB3  HIS  84           1HB      HIS  84  22.851  -8.748 -39.834
  606    HD1  HIS  84           1HD      HIS  84  22.406  -7.454 -42.046
  607    HD2  HIS  84           2HD      HIS  84  26.101  -6.669 -40.311
  608    HE1  HIS  84           1HE      HIS  84  23.745  -6.278 -43.820
  609    HE2  HIS  84           2HE      HIS  84  25.949  -5.744 -42.722
  Start of MODEL   14
    1    H1   MET   1           1HT      MET   1  14.277  11.063  12.011
    2    H2   MET   1           2HT      MET   1  13.480  11.649  13.413
    3    H3   MET   1           3HT      MET   1  12.614  10.723  12.254
    4    HA   MET   1           HA       MET   1  14.816   9.808  13.985
    5    HB2  MET   1           2HB      MET   1  11.842   9.653  14.043
    6    HB3  MET   1           1HB      MET   1  12.726   8.221  14.549
    7    HG2  MET   1           2HG      MET   1  13.588  10.798  15.711
    8    HG3  MET   1           1HG      MET   1  12.022  10.170  16.223
    9    HE1  MET   1           2HE      MET   1  15.836   9.984  16.610
   10    HE2  MET   1           3HE      MET   1  15.777   9.253  18.213
   11    HE3  MET   1           1HE      MET   1  14.851  10.716  17.876
   12    H    ALA   2           H        ALA   2  15.363   7.579  13.759
   13    HA   ALA   2           HA       ALA   2  14.935   6.581  11.032
   14    HB1  ALA   2           1HB      ALA   2  17.271   6.977  12.078
   15    HB2  ALA   2           2HB      ALA   2  16.984   5.500  11.158
   16    HB3  ALA   2           3HB      ALA   2  16.969   5.457  12.922
   17    H    VAL   3           H        VAL   3  12.892   6.279  13.069
   18    HA   VAL   3           HA       VAL   3  12.864   3.341  13.316
   19    HB   VAL   3           HB       VAL   3  11.269   3.697  15.242
   20   HG11  VAL   3          1HG1      VAL   3  13.812   4.973  16.062
   21   HG12  VAL   3          2HG1      VAL   3  13.922   3.408  15.258
   22   HG13  VAL   3          3HG1      VAL   3  12.970   3.575  16.733
   23   HG21  VAL   3          3HG2      VAL   3  10.859   5.750  16.163
   24   HG22  VAL   3          1HG2      VAL   3  11.018   6.212  14.469
   25   HG23  VAL   3          2HG2      VAL   3  12.371   6.442  15.576
   26    H    PHE   4           H        PHE   4  11.875   5.145  11.124
   27    HA   PHE   4           HA       PHE   4  10.112   5.311   9.709
   28    HB2  PHE   4           2HB      PHE   4   9.884   2.717  11.003
   29    HB3  PHE   4           1HB      PHE   4   8.325   3.330  10.478
   30    HD1  PHE   4           2HD      PHE   4  11.752   3.494   8.995
   31    HD2  PHE   4           1HD      PHE   4   7.697   2.285   8.545
   32    HE1  PHE   4           2HE      PHE   4  12.236   2.735   6.703
   33    HE2  PHE   4           1HE      PHE   4   8.175   1.522   6.256
   34    HZ   PHE   4           HZ       PHE   4  10.444   1.748   5.332
   35    H    HIS   5           H        HIS   5   7.531   5.327   9.721
   36    HA   HIS   5           HA       HIS   5   6.807   7.145  11.896
   37    HB2  HIS   5           2HB      HIS   5   6.502   7.879   9.528
   38    HB3  HIS   5           1HB      HIS   5   5.326   6.587   9.318
   39    HD1  HIS   5           1HD      HIS   5   5.775   9.932  10.910
   40    HD2  HIS   5           2HD      HIS   5   2.821   7.044  10.478
   41    HE1  HIS   5           1HE      HIS   5   3.645  11.034  11.659
   42    HE2  HIS   5           2HE      HIS   5   1.894   9.228  11.508
   43    H    ASP   6           H        ASP   6   5.153   4.601  10.011
   44    HA   ASP   6           HA       ASP   6   4.332   3.152  12.317
   45    HB2  ASP   6           2HB      ASP   6   2.510   5.215  11.224
   46    HB3  ASP   6           1HB      ASP   6   1.783   3.637  11.502
   47    H    GLU   7           H        GLU   7   3.484   1.142  11.792
   48    HA   GLU   7           HA       GLU   7   3.691   0.419   8.968
   49    HB2  GLU   7           2HB      GLU   7   3.249  -1.477  11.275
   50    HB3  GLU   7           1HB      GLU   7   3.876  -1.846   9.677
   51    HG2  GLU   7           2HG      GLU   7   5.886  -1.749  10.615
   52    HG3  GLU   7           1HG      GLU   7   5.674   0.001  10.606
   53    H    VAL   8           H        VAL   8   1.954   0.146   7.726
   54    HA   VAL   8           HA       VAL   8  -0.647  -0.340   9.031
   55    HB   VAL   8           HB       VAL   8  -0.229   1.215   6.474
   56   HG11  VAL   8          1HG1      VAL   8  -2.630   0.526   8.133
   57   HG12  VAL   8          2HG1      VAL   8  -2.378   0.308   6.401
   58   HG13  VAL   8          3HG1      VAL   8  -2.624   1.924   7.060
   59   HG21  VAL   8          3HG2      VAL   8   0.450   2.144   8.932
   60   HG22  VAL   8          1HG2      VAL   8  -1.245   2.622   8.848
   61   HG23  VAL   8          2HG2      VAL   8  -0.114   3.158   7.605
   62    H    GLU   9           H        GLU   9  -2.002  -1.837   8.138
   63    HA   GLU   9           HA       GLU   9  -0.842  -3.876   6.532
   64    HB2  GLU   9           2HB      GLU   9  -3.754  -3.474   7.247
   65    HB3  GLU   9           1HB      GLU   9  -3.028  -4.956   6.641
   66    HG2  GLU   9           2HG      GLU   9  -2.186  -5.524   8.647
   67    HG3  GLU   9           1HG      GLU   9  -1.812  -3.859   9.085
   68    H    ILE  10           H        ILE  10  -1.124  -4.399   4.420
   69    HA   ILE  10           HA       ILE  10  -1.573  -2.393   2.545
   70    HB   ILE  10           HB       ILE  10  -0.299  -4.480   2.129
   71   HG12  ILE  10          2HG1      ILE  10  -1.659  -4.865  -0.198
   72   HG13  ILE  10          1HG1      ILE  10  -2.290  -3.300   0.302
   73   HG21  ILE  10          1HG2      ILE  10  -3.041  -5.719   1.985
   74   HG22  ILE  10          2HG2      ILE  10  -1.727  -6.136   3.085
   75   HG23  ILE  10          3HG2      ILE  10  -1.577  -6.480   1.361
   76   HD11  ILE  10          3HD1      ILE  10  -0.347  -2.246  -0.086
   77   HD12  ILE  10          1HD1      ILE  10  -0.070  -3.620  -1.155
   78   HD13  ILE  10          2HD1      ILE  10   0.628  -3.608   0.464
   79    H    GLU  11           H        GLU  11  -3.849  -4.609   4.036
   80    HA   GLU  11           HA       GLU  11  -5.962  -4.419   2.205
   81    HB2  GLU  11           2HB      GLU  11  -5.786  -5.013   5.132
   82    HB3  GLU  11           1HB      GLU  11  -7.367  -4.761   4.404
   83    HG2  GLU  11           2HG      GLU  11  -6.464  -6.512   2.657
   84    HG3  GLU  11           1HG      GLU  11  -5.416  -6.964   4.000
   85    H    ASP  12           H        ASP  12  -4.900  -2.251   4.758
   86    HA   ASP  12           HA       ASP  12  -7.205  -0.564   4.712
   87    HB2  ASP  12           2HB      ASP  12  -5.243  -0.851   6.493
   88    HB3  ASP  12           1HB      ASP  12  -4.555   0.491   5.585
   89    H    PHE  13           H        PHE  13  -4.133  -0.630   3.012
   90    HA   PHE  13           HA       PHE  13  -4.110   1.952   1.942
   91    HB2  PHE  13           2HB      PHE  13  -2.859  -0.648   1.243
   92    HB3  PHE  13           1HB      PHE  13  -2.904   0.568  -0.025
   93    HD1  PHE  13           2HD      PHE  13  -2.025   0.298   3.599
   94    HD2  PHE  13           1HD      PHE  13  -1.118   1.978  -0.206
   95    HE1  PHE  13           2HE      PHE  13  -0.016   1.356   4.545
   96    HE2  PHE  13           1HE      PHE  13   0.891   3.034   0.732
   97    HZ   PHE  13           HZ       PHE  13   1.446   2.724   3.111
   98    H    GLN  14           H        GLN  14  -4.517   2.623  -0.281
   99    HA   GLN  14           HA       GLN  14  -7.041   1.517  -1.273
  100    HB2  GLN  14           2HB      GLN  14  -6.324   4.102  -0.842
  101    HB3  GLN  14           1HB      GLN  14  -5.904   3.939  -2.541
  102    HG2  GLN  14           2HG      GLN  14  -8.571   2.966  -1.691
  103    HG3  GLN  14           1HG      GLN  14  -8.306   4.706  -1.742
  104   HE21  GLN  14          1HE2      GLN  14  -8.975   5.572  -3.569
  105   HE22  GLN  14          2HE2      GLN  14  -8.891   4.846  -5.134
  106    H    TYR  15           H        TYR  15  -6.222  -0.333  -2.327
  107    HA   TYR  15           HA       TYR  15  -4.135  -0.152  -4.264
  108    HB2  TYR  15           2HB      TYR  15  -4.517  -2.272  -3.176
  109    HB3  TYR  15           1HB      TYR  15  -6.182  -2.316  -3.744
  110    HD1  TYR  15           1HD      TYR  15  -2.663  -2.307  -4.958
  111    HD2  TYR  15           2HD      TYR  15  -6.705  -3.348  -5.780
  112    HE1  TYR  15           1HE      TYR  15  -1.936  -3.501  -6.977
  113    HE2  TYR  15           2HE      TYR  15  -5.990  -4.548  -7.804
  114    HH   TYR  15           HH       TYR  15  -2.787  -5.362  -8.427
  115    H    ASP  16           H        ASP  16  -4.278  -0.338  -6.518
  116    HA   ASP  16           HA       ASP  16  -6.904   0.265  -7.690
  117    HB2  ASP  16           2HB      ASP  16  -5.160   2.235  -7.433
  118    HB3  ASP  16           1HB      ASP  16  -4.450   1.506  -8.870
  119    H    GLU  17           H        GLU  17  -7.393  -0.848  -9.509
  120    HA   GLU  17           HA       GLU  17  -5.562  -2.935 -10.336
  121    HB2  GLU  17           2HB      GLU  17  -7.475  -3.558 -11.897
  122    HB3  GLU  17           1HB      GLU  17  -7.796  -3.679 -10.173
  123    HG2  GLU  17           2HG      GLU  17  -9.391  -2.110 -10.234
  124    HG3  GLU  17           1HG      GLU  17  -8.489  -1.088 -11.351
  125    H    ASP  18           H        ASP  18  -6.785   0.107 -11.558
  126    HA   ASP  18           HA       ASP  18  -5.743  -0.254 -14.217
  127    HB2  ASP  18           2HB      ASP  18  -7.730   1.169 -13.721
  128    HB3  ASP  18           1HB      ASP  18  -6.677   2.285 -12.860
  129    H    SER  19           H        SER  19  -4.692   1.265 -11.225
  130    HA   SER  19           HA       SER  19  -2.289   2.326 -12.507
  131    HB2  SER  19           2HB      SER  19  -3.775   3.586 -10.770
  132    HB3  SER  19           1HB      SER  19  -2.905   2.615  -9.582
  133    HG   SER  19           HG       SER  19  -1.976   4.651 -11.252
  134    H    GLU  20           H        GLU  20  -3.286  -0.210 -10.302
  135    HA   GLU  20           HA       GLU  20  -2.181  -1.959  -9.361
  136    HB2  GLU  20           2HB      GLU  20   0.119  -1.371 -11.221
  137    HB3  GLU  20           1HB      GLU  20  -0.341  -2.917 -10.523
  138    HG2  GLU  20           2HG      GLU  20  -2.549  -2.527 -11.871
  139    HG3  GLU  20           1HG      GLU  20  -1.532  -1.439 -12.817
  140    H    THR  21           H        THR  21  -1.973   0.529  -8.099
  141    HA   THR  21           HA       THR  21   0.537   0.177  -6.640
  142    HB   THR  21           HB       THR  21  -0.447   2.871  -7.623
  143    HG1  THR  21           1HG      THR  21   0.729   2.497  -9.295
  144   HG21  THR  21          3HG2      THR  21   0.917   2.634  -5.390
  145   HG22  THR  21          1HG2      THR  21   1.269   3.911  -6.554
  146   HG23  THR  21          2HG2      THR  21   2.271   2.462  -6.507
  147    H    TYR  22           H        TYR  22   0.419   0.757  -4.453
  148    HA   TYR  22           HA       TYR  22  -2.310   1.119  -3.442
  149    HB2  TYR  22           2HB      TYR  22   0.201   0.290  -1.966
  150    HB3  TYR  22           1HB      TYR  22  -1.419   0.354  -1.284
  151    HD1  TYR  22           1HD      TYR  22   0.703  -1.388  -3.772
  152    HD2  TYR  22           2HD      TYR  22  -2.931  -1.448  -1.556
  153    HE1  TYR  22           1HE      TYR  22   0.328  -3.715  -4.462
  154    HE2  TYR  22           2HE      TYR  22  -3.313  -3.780  -2.240
  155    HH   TYR  22           HH       TYR  22  -2.339  -5.211  -4.522
  156    H    PHE  23           H        PHE  23  -2.902   2.806  -2.126
  157    HA   PHE  23           HA       PHE  23  -0.865   4.871  -1.602
  158    HB2  PHE  23           2HB      PHE  23  -3.716   5.389  -2.477
  159    HB3  PHE  23           1HB      PHE  23  -2.490   6.608  -2.141
  160    HD1  PHE  23           2HD      PHE  23  -3.545   3.972  -4.481
  161    HD2  PHE  23           1HD      PHE  23  -0.799   7.141  -3.740
  162    HE1  PHE  23           2HE      PHE  23  -2.828   3.893  -6.834
  163    HE2  PHE  23           1HE      PHE  23  -0.078   7.069  -6.090
  164    HZ   PHE  23           HZ       PHE  23  -1.090   5.445  -7.641
  165    H    TYR  24           H        TYR  24  -1.322   6.303   0.191
  166    HA   TYR  24           HA       TYR  24  -3.420   5.501   2.045
  167    HB2  TYR  24           2HB      TYR  24  -1.301   4.108   2.465
  168    HB3  TYR  24           1HB      TYR  24  -0.579   5.604   3.044
  169    HD1  TYR  24           1HD      TYR  24  -3.468   3.324   3.591
  170    HD2  TYR  24           2HD      TYR  24  -0.914   6.293   5.257
  171    HE1  TYR  24           1HE      TYR  24  -4.478   2.945   5.798
  172    HE2  TYR  24           2HE      TYR  24  -1.915   5.919   7.472
  173    HH   TYR  24           HH       TYR  24  -3.839   3.259   8.202
  174    HA   PRO  25           HA       PRO  25  -3.452   9.904   2.645
  175    HB2  PRO  25           2HB      PRO  25  -4.853   9.990   4.987
  176    HB3  PRO  25           1HB      PRO  25  -5.601   9.725   3.407
  177    HG2  PRO  25           2HG      PRO  25  -4.839   7.726   5.503
  178    HG3  PRO  25           1HG      PRO  25  -6.312   7.810   4.518
  179    HD2  PRO  25           2HD      PRO  25  -4.303   6.114   3.936
  180    HD3  PRO  25           1HD      PRO  25  -5.280   6.885   2.668
  181    H    CYS  26           H        CYS  26  -1.958  11.235   3.430
  182    HA   CYS  26           HA       CYS  26  -0.322  10.359   5.689
  183    HB2  CYS  26           2HB      CYS  26   0.463  11.319   3.307
  184    HB3  CYS  26           1HB      CYS  26   0.349  12.837   4.193
  185    HA   PRO  27           HA       PRO  27  -2.141  13.112   8.627
  186    HB2  PRO  27           2HB      PRO  27   0.642  13.664   9.515
  187    HB3  PRO  27           1HB      PRO  27  -0.743  13.082  10.446
  188    HG2  PRO  27           2HG      PRO  27   1.231  11.431   9.771
  189    HG3  PRO  27           1HG      PRO  27  -0.457  10.889   9.748
  190    HD2  PRO  27           2HD      PRO  27   1.321  11.654   7.468
  191    HD3  PRO  27           1HD      PRO  27   0.112  10.356   7.572
  192    H    CYS  28           H        CYS  28   0.523  14.202   6.604
  193    HA   CYS  28           HA       CYS  28   0.268  16.969   7.289
  194    HB2  CYS  28           2HB      CYS  28   1.821  17.370   5.449
  195    HB3  CYS  28           1HB      CYS  28   2.380  16.029   6.440
  196    H    GLY  29           H        GLY  29  -0.935  14.926   4.646
  197    HA2  GLY  29           2HA      GLY  29  -3.313  16.046   4.139
  198    HA3  GLY  29           1HA      GLY  29  -2.233  17.187   3.354
  199    H    ASP  30           H        ASP  30  -0.329  15.512   2.286
  200    HA   ASP  30           HA       ASP  30  -1.672  14.526  -0.030
  201    HB2  ASP  30           2HB      ASP  30   0.843  15.440   0.467
  202    HB3  ASP  30           1HB      ASP  30   1.136  13.705   0.422
  203    H    ASN  31           H        ASN  31  -0.702  12.217  -0.842
  204    HA   ASN  31           HA       ASN  31  -1.168  10.292   1.339
  205    HB2  ASN  31           2HB      ASN  31  -2.169   9.912  -1.488
  206    HB3  ASN  31           1HB      ASN  31  -2.516   8.909  -0.085
  207   HD21  ASN  31          1HD2      ASN  31  -4.128  10.623  -2.048
  208   HD22  ASN  31          2HD2      ASN  31  -5.192  11.512  -1.017
  209    H    PHE  32           H        PHE  32   0.122   8.523   1.394
  210    HA   PHE  32           HA       PHE  32   2.579   8.539  -0.013
  211    HB2  PHE  32           2HB      PHE  32   1.215   6.451   1.692
  212    HB3  PHE  32           1HB      PHE  32   2.795   6.188   0.969
  213    HD1  PHE  32           2HD      PHE  32   4.605   7.978   1.519
  214    HD2  PHE  32           1HD      PHE  32   1.058   7.380   3.793
  215    HE1  PHE  32           2HE      PHE  32   5.674   9.042   3.462
  216    HE2  PHE  32           1HE      PHE  32   2.122   8.440   5.740
  217    HZ   PHE  32           HZ       PHE  32   4.434   9.273   5.577
  218    H    SER  33           H        SER  33   3.367   6.522  -1.230
  219    HA   SER  33           HA       SER  33   1.329   5.138  -2.755
  220    HB2  SER  33           2HB      SER  33   2.459   5.818  -4.944
  221    HB3  SER  33           1HB      SER  33   1.463   7.044  -4.159
  222    HG   SER  33           HG       SER  33   4.163   7.018  -4.639
  223    H    ILE  34           H        ILE  34   1.982   3.189  -3.512
  224    HA   ILE  34           HA       ILE  34   4.798   2.520  -3.710
  225    HB   ILE  34           HB       ILE  34   4.390   2.052  -1.351
  226   HG12  ILE  34          2HG1      ILE  34   4.509  -0.511  -2.959
  227   HG13  ILE  34          1HG1      ILE  34   5.877   0.560  -2.667
  228   HG21  ILE  34          1HG2      ILE  34   2.589   0.995  -0.503
  229   HG22  ILE  34          2HG2      ILE  34   2.491  -0.145  -1.845
  230   HG23  ILE  34          3HG2      ILE  34   1.841   1.485  -2.023
  231   HD11  ILE  34          3HD1      ILE  34   6.064  -0.062  -0.472
  232   HD12  ILE  34          1HD1      ILE  34   5.515  -1.565  -1.212
  233   HD13  ILE  34          2HD1      ILE  34   4.370  -0.538  -0.348
  234    H    THR  35           H        THR  35   5.062   1.303  -5.470
  235    HA   THR  35           HA       THR  35   2.820   0.341  -6.945
  236    HB   THR  35           HB       THR  35   4.731  -0.742  -8.349
  237    HG1  THR  35           1HG      THR  35   6.747  -0.087  -7.886
  238   HG21  THR  35          3HG2      THR  35   5.448   2.002  -8.545
  239   HG22  THR  35          1HG2      THR  35   3.706   1.883  -8.279
  240   HG23  THR  35          2HG2      THR  35   4.453   1.033  -9.631
  241    H    LYS  36           H        LYS  36   2.266  -1.798  -7.482
  242    HA   LYS  36           HA       LYS  36   2.254  -3.647  -5.394
  243    HB2  LYS  36           2HB      LYS  36   0.615  -3.720  -7.191
  244    HB3  LYS  36           1HB      LYS  36   1.867  -4.103  -8.361
  245    HG2  LYS  36           2HG      LYS  36   0.758  -6.126  -7.917
  246    HG3  LYS  36           1HG      LYS  36   2.280  -6.218  -7.029
  247    HD2  LYS  36           2HD      LYS  36   1.135  -5.599  -4.971
  248    HD3  LYS  36           1HD      LYS  36  -0.386  -5.434  -5.850
  249    HE2  LYS  36           2HE      LYS  36   0.137  -7.914  -6.558
  250    HE3  LYS  36           1HE      LYS  36   1.120  -7.893  -5.095
  251    HZ1  LYS  36           3HZ      LYS  36  -0.895  -8.603  -4.300
  252    HZ2  LYS  36           1HZ      LYS  36  -1.796  -7.656  -5.377
  253    HZ3  LYS  36           2HZ      LYS  36  -1.040  -6.937  -4.045
  254    H    GLU  37           H        GLU  37   4.474  -3.279  -8.105
  255    HA   GLU  37           HA       GLU  37   5.882  -5.694  -7.853
  256    HB2  GLU  37           2HB      GLU  37   5.991  -3.928  -9.723
  257    HB3  GLU  37           1HB      GLU  37   7.161  -3.105  -8.701
  258    HG2  GLU  37           2HG      GLU  37   8.661  -4.329  -9.813
  259    HG3  GLU  37           1HG      GLU  37   8.170  -5.616  -8.715
  260    H    ASP  38           H        ASP  38   6.313  -2.565  -6.242
  261    HA   ASP  38           HA       ASP  38   8.773  -3.008  -5.008
  262    HB2  ASP  38           2HB      ASP  38   6.407  -1.292  -4.383
  263    HB3  ASP  38           1HB      ASP  38   7.633  -1.495  -3.136
  264    H    LEU  39           H        LEU  39   5.502  -3.738  -3.816
  265    HA   LEU  39           HA       LEU  39   6.283  -4.793  -1.334
  266    HB2  LEU  39           2HB      LEU  39   3.865  -5.508  -2.989
  267    HB3  LEU  39           1HB      LEU  39   4.067  -5.832  -1.277
  268    HG   LEU  39           HG       LEU  39   4.292  -3.006  -2.177
  269   HD11  LEU  39          1HD1      LEU  39   1.676  -4.476  -1.936
  270   HD12  LEU  39          2HD1      LEU  39   2.354  -3.782  -3.408
  271   HD13  LEU  39          3HD1      LEU  39   1.864  -2.729  -2.081
  272   HD21  LEU  39          3HD2      LEU  39   3.305  -2.568  -0.025
  273   HD22  LEU  39          1HD2      LEU  39   4.636  -3.707   0.175
  274   HD23  LEU  39          2HD2      LEU  39   2.971  -4.283   0.213
  275    H    GLU  40           H        GLU  40   5.795  -6.349  -4.487
  276    HA   GLU  40           HA       GLU  40   6.244  -8.997  -3.561
  277    HB2  GLU  40           2HB      GLU  40   6.284  -7.706  -6.274
  278    HB3  GLU  40           1HB      GLU  40   6.749  -9.388  -6.066
  279    HG2  GLU  40           2HG      GLU  40   4.520  -9.748  -4.954
  280    HG3  GLU  40           1HG      GLU  40   4.083  -8.130  -5.499
  281    H    ASN  41           H        ASN  41   8.378  -6.418  -4.602
  282    HA   ASN  41           HA       ASN  41  10.685  -8.138  -4.851
  283    HB2  ASN  41           2HB      ASN  41  10.139  -5.228  -5.185
  284    HB3  ASN  41           1HB      ASN  41  11.797  -5.715  -4.851
  285   HD21  ASN  41          1HD2      ASN  41   9.063  -6.457  -6.970
  286   HD22  ASN  41          2HD2      ASN  41  10.018  -6.815  -8.365
  287    H    GLY  42           H        GLY  42   9.434  -5.821  -2.471
  288    HA2  GLY  42           2HA      GLY  42  10.100  -6.767  -0.137
  289    HA3  GLY  42           1HA      GLY  42  11.715  -6.383  -0.712
  290    H    GLU  43           H        GLU  43  10.207  -4.028  -2.178
  291    HA   GLU  43           HA       GLU  43  10.893  -2.036  -0.279
  292    HB2  GLU  43           2HB      GLU  43   9.538  -1.997  -2.960
  293    HB3  GLU  43           1HB      GLU  43   9.627  -0.540  -1.984
  294    HG2  GLU  43           2HG      GLU  43  11.947  -2.152  -3.015
  295    HG3  GLU  43           1HG      GLU  43  11.406  -0.583  -3.606
  296    H    ASP  44           H        ASP  44   9.592  -2.717   1.524
  297    HA   ASP  44           HA       ASP  44   6.715  -2.259   1.308
  298    HB2  ASP  44           2HB      ASP  44   6.709  -3.109   3.706
  299    HB3  ASP  44           1HB      ASP  44   7.179  -4.265   2.468
  300    H    VAL  45           H        VAL  45   8.309   0.009   0.998
  301    HA   VAL  45           HA       VAL  45   7.565   1.532   3.400
  302    HB   VAL  45           HB       VAL  45   9.996   1.251   3.420
  303   HG11  VAL  45          1HG1      VAL  45  10.345   2.906   0.980
  304   HG12  VAL  45          2HG1      VAL  45   9.969   1.198   0.770
  305   HG13  VAL  45          3HG1      VAL  45  11.401   1.679   1.677
  306   HG21  VAL  45          3HG2      VAL  45  10.618   3.601   3.597
  307   HG22  VAL  45          1HG2      VAL  45   9.017   3.326   4.284
  308   HG23  VAL  45          2HG2      VAL  45   9.177   4.063   2.690
  309    H    ALA  46           H        ALA  46   6.573   3.463   3.058
  310    HA   ALA  46           HA       ALA  46   6.163   4.258   0.248
  311    HB1  ALA  46           1HB      ALA  46   4.235   5.301   2.184
  312    HB2  ALA  46           2HB      ALA  46   4.240   3.541   2.058
  313    HB3  ALA  46           3HB      ALA  46   3.973   4.527   0.621
  314    H    THR  47           H        THR  47   6.727   6.263  -0.368
  315    HA   THR  47           HA       THR  47   7.644   8.123   1.726
  316    HB   THR  47           HB       THR  47   8.565   8.118  -1.150
  317    HG1  THR  47           1HG      THR  47   9.632   6.731   1.077
  318   HG21  THR  47          3HG2      THR  47  10.467   8.959   0.854
  319   HG22  THR  47          1HG2      THR  47   9.008   9.949   0.876
  320   HG23  THR  47          2HG2      THR  47   9.934   9.774  -0.615
  321    H    CYS  48           H        CYS  48   6.781  10.109   1.839
  322    HA   CYS  48           HA       CYS  48   4.611  10.766   0.012
  323    HB2  CYS  48           2HB      CYS  48   4.373  10.974   2.510
  324    HB3  CYS  48           1HB      CYS  48   5.530  12.298   2.454
  325    HA   PRO  49           HA       PRO  49   7.218  13.573  -2.265
  326    HB2  PRO  49           2HB      PRO  49   5.338  14.708  -3.818
  327    HB3  PRO  49           1HB      PRO  49   5.864  13.036  -4.049
  328    HG2  PRO  49           2HG      PRO  49   3.416  14.082  -2.686
  329    HG3  PRO  49           1HG      PRO  49   3.583  12.695  -3.774
  330    HD2  PRO  49           2HD      PRO  49   3.465  12.491  -1.045
  331    HD3  PRO  49           1HD      PRO  49   4.270  11.304  -2.092
  332    H    SER  50           H        SER  50   5.087  14.502   0.150
  333    HA   SER  50           HA       SER  50   5.556  17.364  -0.314
  334    HB2  SER  50           2HB      SER  50   3.198  16.156   0.236
  335    HB3  SER  50           1HB      SER  50   3.736  16.538   1.872
  336    HG   SER  50           HG       SER  50   3.726  18.665   1.395
  337    H    CYS  51           H        CYS  51   5.251  15.229   2.550
  338    HA   CYS  51           HA       CYS  51   7.146  16.904   3.982
  339    HB2  CYS  51           2HB      CYS  51   6.597  15.510   5.927
  340    HB3  CYS  51           1HB      CYS  51   5.148  16.149   5.159
  341    H    SER  52           H        SER  52   7.154  13.886   2.280
  342    HA   SER  52           HA       SER  52   8.828  12.447   1.746
  343    HB2  SER  52           2HB      SER  52  10.169  14.655   1.685
  344    HB3  SER  52           1HB      SER  52  10.795  14.160   3.256
  345    HG   SER  52           HG       SER  52  11.104  12.895   0.753
  346    H    LEU  53           H        LEU  53   7.247  11.904   3.934
  347    HA   LEU  53           HA       LEU  53   8.967  11.003   6.099
  348    HB2  LEU  53           2HB      LEU  53   6.099  11.454   5.704
  349    HB3  LEU  53           1HB      LEU  53   6.454   9.990   6.599
  350    HG   LEU  53           HG       LEU  53   7.731  11.290   8.245
  351   HD11  LEU  53          1HD1      LEU  53   8.223  13.486   8.072
  352   HD12  LEU  53          2HD1      LEU  53   6.715  13.873   7.245
  353   HD13  LEU  53          3HD1      LEU  53   8.058  13.165   6.347
  354   HD21  LEU  53          3HD2      LEU  53   4.922  12.229   7.695
  355   HD22  LEU  53          1HD2      LEU  53   5.796  12.542   9.195
  356   HD23  LEU  53          2HD2      LEU  53   5.422  10.885   8.722
  357    H    ILE  54           H        ILE  54   8.184   8.678   6.950
  358    HA   ILE  54           HA       ILE  54   8.163   6.827   4.661
  359    HB   ILE  54           HB       ILE  54   9.722   5.345   5.980
  360   HG12  ILE  54          2HG1      ILE  54  10.144   7.898   7.558
  361   HG13  ILE  54          1HG1      ILE  54   9.454   6.401   8.175
  362   HG21  ILE  54          1HG2      ILE  54  11.565   6.206   4.931
  363   HG22  ILE  54          2HG2      ILE  54  11.182   7.868   5.379
  364   HG23  ILE  54          3HG2      ILE  54  10.288   7.077   4.082
  365   HD11  ILE  54          3HD1      ILE  54  11.687   5.333   7.529
  366   HD12  ILE  54          1HD1      ILE  54  11.648   6.391   8.940
  367   HD13  ILE  54          2HD1      ILE  54  12.286   6.988   7.407
  368    H    ILE  55           H        ILE  55   7.042   4.916   4.952
  369    HA   ILE  55           HA       ILE  55   5.922   4.322   7.583
  370    HB   ILE  55           HB       ILE  55   3.652   3.977   6.659
  371   HG12  ILE  55          2HG1      ILE  55   4.394   5.669   4.296
  372   HG13  ILE  55          1HG1      ILE  55   4.622   3.924   4.226
  373   HG21  ILE  55          1HG2      ILE  55   3.022   6.359   6.557
  374   HG22  ILE  55          2HG2      ILE  55   4.730   6.781   6.447
  375   HG23  ILE  55          3HG2      ILE  55   4.109   5.991   7.895
  376   HD11  ILE  55          3HD1      ILE  55   2.498   4.574   3.253
  377   HD12  ILE  55          1HD1      ILE  55   2.026   5.343   4.768
  378   HD13  ILE  55          2HD1      ILE  55   2.252   3.596   4.701
  379    H    LYS  56           H        LYS  56   5.353   2.157   7.887
  380    HA   LYS  56           HA       LYS  56   6.548   0.333   5.952
  381    HB2  LYS  56           2HB      LYS  56   6.715   0.372   8.643
  382    HB3  LYS  56           1HB      LYS  56   5.348  -0.715   8.452
  383    HG2  LYS  56           2HG      LYS  56   7.823  -1.198   6.866
  384    HG3  LYS  56           1HG      LYS  56   7.778  -1.643   8.573
  385    HD2  LYS  56           2HD      LYS  56   6.078  -3.203   8.247
  386    HD3  LYS  56           1HD      LYS  56   5.593  -2.499   6.705
  387    HE2  LYS  56           2HE      LYS  56   7.153  -3.639   5.543
  388    HE3  LYS  56           1HE      LYS  56   8.361  -3.493   6.820
  389    HZ1  LYS  56           3HZ      LYS  56   6.912  -5.194   8.041
  390    HZ2  LYS  56           1HZ      LYS  56   7.875  -5.744   6.763
  391    HZ3  LYS  56           2HZ      LYS  56   6.218  -5.502   6.530
  392    H    VAL  57           H        VAL  57   5.530  -1.119   4.782
  393    HA   VAL  57           HA       VAL  57   2.595  -1.131   4.917
  394    HB   VAL  57           HB       VAL  57   3.919  -2.173   2.477
  395   HG11  VAL  57          1HG1      VAL  57   1.561  -0.411   3.093
  396   HG12  VAL  57          2HG1      VAL  57   1.538  -2.098   2.576
  397   HG13  VAL  57          3HG1      VAL  57   2.060  -0.839   1.457
  398   HG21  VAL  57          3HG2      VAL  57   4.370   0.002   1.535
  399   HG22  VAL  57          1HG2      VAL  57   5.290  -0.168   3.028
  400   HG23  VAL  57          2HG2      VAL  57   3.819   0.800   3.007
  401    H    ILE  58           H        ILE  58   1.793  -2.889   5.844
  402    HA   ILE  58           HA       ILE  58   3.317  -5.383   5.818
  403    HB   ILE  58           HB       ILE  58   0.723  -4.824   7.259
  404   HG12  ILE  58          2HG1      ILE  58   2.503  -3.250   7.964
  405   HG13  ILE  58          1HG1      ILE  58   2.049  -4.365   9.249
  406   HG21  ILE  58          1HG2      ILE  58   2.825  -6.909   7.822
  407   HG22  ILE  58          2HG2      ILE  58   1.371  -7.205   6.870
  408   HG23  ILE  58          3HG2      ILE  58   1.236  -6.755   8.570
  409   HD11  ILE  58          3HD1      ILE  58   4.034  -5.726   8.716
  410   HD12  ILE  58          1HD1      ILE  58   4.433  -4.083   9.218
  411   HD13  ILE  58          2HD1      ILE  58   4.499  -4.524   7.512
  412    H    TYR  59           H        TYR  59   2.715  -7.189   4.738
  413    HA   TYR  59           HA       TYR  59   0.054  -7.509   3.664
  414    HB2  TYR  59           2HB      TYR  59   0.937  -7.744   1.293
  415    HB3  TYR  59           1HB      TYR  59   0.883  -6.101   1.922
  416    HD1  TYR  59           2HD      TYR  59   3.019  -5.070   2.786
  417    HD2  TYR  59           1HD      TYR  59   2.978  -8.686   0.549
  418    HE1  TYR  59           2HE      TYR  59   5.412  -4.789   2.309
  419    HE2  TYR  59           1HE      TYR  59   5.374  -8.422   0.067
  420    HH   TYR  59           HH       TYR  59   7.025  -5.646   0.376
  421    H    ASP  60           H        ASP  60   0.095  -9.546   2.114
  422    HA   ASP  60           HA       ASP  60   1.415 -11.646   3.631
  423    HB2  ASP  60           2HB      ASP  60  -1.055 -11.652   2.827
  424    HB3  ASP  60           1HB      ASP  60  -0.386 -12.102   1.263
  425    H    LYS  61           H        LYS  61   3.566 -11.600   3.027
  426    HA   LYS  61           HA       LYS  61   4.544 -11.296   0.419
  427    HB2  LYS  61           2HB      LYS  61   5.679 -12.509   2.915
  428    HB3  LYS  61           1HB      LYS  61   6.555 -12.646   1.396
  429    HG2  LYS  61           2HG      LYS  61   6.060 -10.016   1.373
  430    HG3  LYS  61           1HG      LYS  61   6.088 -10.294   3.115
  431    HD2  LYS  61           2HD      LYS  61   8.287 -11.611   2.556
  432    HD3  LYS  61           1HD      LYS  61   8.269 -10.612   1.101
  433    HE2  LYS  61           2HE      LYS  61   8.237  -8.600   2.432
  434    HE3  LYS  61           1HE      LYS  61   8.101  -9.543   3.915
  435    HZ1  LYS  61           3HZ      LYS  61  10.402  -8.630   3.026
  436    HZ2  LYS  61           1HZ      LYS  61  10.389 -10.103   2.192
  437    HZ3  LYS  61           2HZ      LYS  61  10.282 -10.085   3.879
  438    H    ASP  62           H        ASP  62   3.362 -14.131   2.125
  439    HA   ASP  62           HA       ASP  62   4.341 -16.086   0.333
  440    HB2  ASP  62           2HB      ASP  62   3.112 -16.223   2.730
  441    HB3  ASP  62           1HB      ASP  62   1.751 -16.609   1.681
  442    H    GLN  63           H        GLN  63   1.537 -13.983   0.252
  443    HA   GLN  63           HA       GLN  63   0.386 -15.412  -2.010
  444    HB2  GLN  63           2HB      GLN  63  -0.498 -13.211  -0.216
  445    HB3  GLN  63           1HB      GLN  63  -1.174 -13.253  -1.838
  446    HG2  GLN  63           2HG      GLN  63  -1.209 -15.828  -0.449
  447    HG3  GLN  63           1HG      GLN  63  -2.175 -14.570   0.318
  448   HE21  GLN  63          1HE2      GLN  63  -2.849 -17.069  -1.217
  449   HE22  GLN  63          2HE2      GLN  63  -3.971 -16.543  -2.421
  450    H    PHE  64           H        PHE  64   2.181 -12.474  -1.321
  451    HA   PHE  64           HA       PHE  64   1.829 -11.263  -3.868
  452    HB2  PHE  64           2HB      PHE  64   3.588 -10.802  -1.508
  453    HB3  PHE  64           1HB      PHE  64   4.097 -10.111  -3.044
  454    HD1  PHE  64           2HD      PHE  64   0.972 -10.384  -1.007
  455    HD2  PHE  64           1HD      PHE  64   3.459  -7.956  -3.462
  456    HE1  PHE  64           2HE      PHE  64  -0.542  -8.478  -0.647
  457    HE2  PHE  64           1HE      PHE  64   1.951  -6.047  -3.108
  458    HZ   PHE  64           HZ       PHE  64  -0.052  -6.305  -1.700
  459    H    VAL  65           H        VAL  65   4.787 -12.721  -2.465
  460    HA   VAL  65           HA       VAL  65   5.591 -13.437  -5.204
  461    HB   VAL  65           HB       VAL  65   7.098 -11.816  -4.189
  462   HG11  VAL  65          1HG1      VAL  65   7.852 -11.881  -2.093
  463   HG12  VAL  65          2HG1      VAL  65   8.297 -13.583  -2.213
  464   HG13  VAL  65          3HG1      VAL  65   6.639 -13.131  -1.821
  465   HG21  VAL  65          3HG2      VAL  65   9.229 -13.135  -4.389
  466   HG22  VAL  65          1HG2      VAL  65   8.114 -13.298  -5.746
  467   HG23  VAL  65          2HG2      VAL  65   8.235 -14.584  -4.544
  468    H    SER  66           H        SER  66   4.763 -15.457  -5.392
  469    HA   SER  66           HA       SER  66   6.159 -17.571  -4.016
  470    HB2  SER  66           2HB      SER  66   4.425 -17.267  -2.387
  471    HB3  SER  66           1HB      SER  66   3.184 -17.186  -3.637
  472    HG   SER  66           HG       SER  66   3.037 -19.263  -3.462
  473    H    GLY  67           H        GLY  67   6.865 -17.947  -6.163
  474    HA2  GLY  67           2HA      GLY  67   5.007 -19.611  -7.681
  475    HA3  GLY  67           1HA      GLY  67   5.670 -18.210  -8.512
  476    H    GLU  68           H        GLU  68   8.156 -18.042  -8.250
  477    HA   GLU  68           HA       GLU  68   9.251 -20.680  -8.936
  478    HB2  GLU  68           2HB      GLU  68  10.036 -17.870  -9.682
  479    HB3  GLU  68           1HB      GLU  68  11.172 -19.201  -9.853
  480    HG2  GLU  68           2HG      GLU  68   8.978 -20.217 -11.088
  481    HG3  GLU  68           1HG      GLU  68   8.830 -18.500 -11.462
  482    H    THR  69           H        THR  69   8.862 -20.012  -6.197
  483    HA   THR  69           HA       THR  69  11.657 -19.969  -5.288
  484    HB   THR  69           HB       THR  69   9.410 -18.716  -3.707
  485    HG1  THR  69           1HG      THR  69   9.522 -17.381  -5.417
  486   HG21  THR  69          3HG2      THR  69  11.232 -17.495  -2.603
  487   HG22  THR  69          1HG2      THR  69  12.401 -18.428  -3.538
  488   HG23  THR  69          2HG2      THR  69  11.349 -19.240  -2.378
  489    H    VAL  70           H        VAL  70  12.162 -21.780  -4.271
  490    HA   VAL  70           HA       VAL  70  10.338 -23.818  -3.660
  491    HB   VAL  70           HB       VAL  70  12.723 -24.232  -4.086
  492   HG11  VAL  70          1HG1      VAL  70  14.413 -23.799  -2.416
  493   HG12  VAL  70          2HG1      VAL  70  13.208 -23.107  -1.330
  494   HG13  VAL  70          3HG1      VAL  70  13.606 -22.289  -2.841
  495   HG21  VAL  70          3HG2      VAL  70  13.099 -25.886  -2.272
  496   HG22  VAL  70          1HG2      VAL  70  11.490 -25.975  -2.986
  497   HG23  VAL  70          2HG2      VAL  70  11.716 -25.205  -1.417
  498    HA   PRO  71           HA       PRO  71   8.496 -22.636   0.195
  499    HB2  PRO  71           2HB      PRO  71   8.660 -25.526   0.870
  500    HB3  PRO  71           1HB      PRO  71   7.257 -24.455   0.843
  501    HG2  PRO  71           2HG      PRO  71   7.630 -26.264  -1.075
  502    HG3  PRO  71           1HG      PRO  71   6.981 -24.657  -1.450
  503    HD2  PRO  71           2HD      PRO  71   9.732 -25.743  -1.873
  504    HD3  PRO  71           1HD      PRO  71   8.777 -24.660  -2.906
  505    H    ALA  72           H        ALA  72   8.786 -22.976   2.601
  506    HA   ALA  72           HA       ALA  72  11.566 -23.629   3.301
  507    HB1  ALA  72           1HB      ALA  72  10.161 -21.047   3.630
  508    HB2  ALA  72           2HB      ALA  72  11.869 -21.386   3.354
  509    HB3  ALA  72           3HB      ALA  72  11.182 -21.580   4.966
  510    HA   PRO  73           HA       PRO  73   9.839 -25.836   6.726
  511    HB2  PRO  73           2HB      PRO  73  11.902 -25.712   8.490
  512    HB3  PRO  73           1HB      PRO  73  11.938 -26.725   7.041
  513    HG2  PRO  73           2HG      PRO  73  13.150 -24.023   7.496
  514    HG3  PRO  73           1HG      PRO  73  13.849 -25.445   6.698
  515    HD2  PRO  73           2HD      PRO  73  12.798 -23.370   5.317
  516    HD3  PRO  73           1HD      PRO  73  12.736 -25.042   4.722
  517    H    SER  74           H        SER  74   9.350 -25.648   9.077
  518    HA   SER  74           HA       SER  74   8.640 -22.883   9.714
  519    HB2  SER  74           2HB      SER  74   7.222 -24.011  11.511
  520    HB3  SER  74           1HB      SER  74   6.757 -24.317   9.838
  521    HG   SER  74           HG       SER  74   7.577 -26.061  11.744
  522    H    ALA  75           H        ALA  75   9.223 -21.850  11.581
  523    HA   ALA  75           HA       ALA  75  10.386 -21.326  13.458
  524    HB1  ALA  75           1HB      ALA  75  10.483 -22.852  15.090
  525    HB2  ALA  75           2HB      ALA  75  11.405 -23.990  14.110
  526    HB3  ALA  75           3HB      ALA  75   9.651 -23.908  13.950
  527    H    ASN  76           H        ASN  76  12.264 -24.113  12.213
  528    HA   ASN  76           HA       ASN  76  14.318 -22.346  11.202
  529    HB2  ASN  76           2HB      ASN  76  16.133 -23.438  12.541
  530    HB3  ASN  76           1HB      ASN  76  15.051 -22.429  13.491
  531   HD21  ASN  76          1HD2      ASN  76  15.816 -23.590  15.332
  532   HD22  ASN  76          2HD2      ASN  76  15.171 -25.148  15.709
  533    H    LYS  77           H        LYS  77  16.135 -23.629  10.170
  534    HA   LYS  77           HA       LYS  77  15.002 -25.629   8.489
  535    HB2  LYS  77           2HB      LYS  77  17.662 -24.325   8.759
  536    HB3  LYS  77           1HB      LYS  77  17.607 -25.877   7.934
  537    HG2  LYS  77           2HG      LYS  77  15.784 -24.882   6.482
  538    HG3  LYS  77           1HG      LYS  77  16.228 -23.322   7.175
  539    HD2  LYS  77           2HD      LYS  77  17.505 -23.387   5.244
  540    HD3  LYS  77           1HD      LYS  77  18.636 -23.972   6.463
  541    HE2  LYS  77           2HE      LYS  77  18.950 -25.553   4.840
  542    HE3  LYS  77           1HE      LYS  77  17.662 -26.317   5.769
  543    HZ1  LYS  77           3HZ      LYS  77  16.152 -25.984   4.128
  544    HZ2  LYS  77           1HZ      LYS  77  17.538 -26.054   3.161
  545    HZ3  LYS  77           2HZ      LYS  77  16.870 -24.556   3.573
  546    H    GLU  78           H        GLU  78  14.933 -27.779   8.733
  547    HA   GLU  78           HA       GLU  78  16.622 -28.978  10.828
  548    HB2  GLU  78           2HB      GLU  78  13.743 -29.433  10.128
  549    HB3  GLU  78           1HB      GLU  78  14.678 -30.713  10.892
  550    HG2  GLU  78           2HG      GLU  78  15.285 -28.667  12.523
  551    HG3  GLU  78           1HG      GLU  78  13.676 -28.172  11.998
  552    H    LEU  79           H        LEU  79  18.089 -30.321  10.068
  553    HA   LEU  79           HA       LEU  79  17.409 -32.239   8.004
  554    HB2  LEU  79           2HB      LEU  79  19.559 -31.628   6.750
  555    HB3  LEU  79           1HB      LEU  79  18.146 -30.619   6.507
  556    HG   LEU  79           HG       LEU  79  20.111 -29.796   8.593
  557   HD11  LEU  79          1HD1      LEU  79  21.209 -30.487   6.289
  558   HD12  LEU  79          2HD1      LEU  79  21.720 -29.045   7.166
  559   HD13  LEU  79          3HD1      LEU  79  20.607 -28.901   5.805
  560   HD21  LEU  79          3HD2      LEU  79  19.473 -27.550   7.534
  561   HD22  LEU  79          1HD2      LEU  79  18.243 -28.399   8.469
  562   HD23  LEU  79          2HD2      LEU  79  18.202 -28.452   6.708
  563    H    VAL  80           H        VAL  80  18.083 -32.404  10.818
  564    HA   VAL  80           HA       VAL  80  20.623 -33.890  10.662
  565    HB   VAL  80           HB       VAL  80  20.740 -31.944  12.171
  566   HG11  VAL  80          1HG1      VAL  80  19.254 -31.460  13.787
  567   HG12  VAL  80          2HG1      VAL  80  19.021 -33.151  14.229
  568   HG13  VAL  80          3HG1      VAL  80  18.174 -32.479  12.836
  569   HG21  VAL  80          3HG2      VAL  80  21.147 -34.726  13.052
  570   HG22  VAL  80          1HG2      VAL  80  21.157 -33.514  14.334
  571   HG23  VAL  80          2HG2      VAL  80  22.280 -33.378  12.982
  572    H    LYS  81           H        LYS  81  20.567 -36.021  11.067
  573    HA   LYS  81           HA       LYS  81  18.055 -37.152  12.104
  574    HB2  LYS  81           2HB      LYS  81  19.120 -37.724   9.740
  575    HB3  LYS  81           1HB      LYS  81  20.075 -38.845  10.699
  576    HG2  LYS  81           2HG      LYS  81  18.306 -40.190  11.150
  577    HG3  LYS  81           1HG      LYS  81  17.144 -38.863  11.123
  578    HD2  LYS  81           2HD      LYS  81  17.908 -38.860   8.542
  579    HD3  LYS  81           1HD      LYS  81  18.137 -40.568   8.922
  580    HE2  LYS  81           2HE      LYS  81  15.923 -40.339   8.102
  581    HE3  LYS  81           1HE      LYS  81  15.798 -40.569   9.846
  582    HZ1  LYS  81           3HZ      LYS  81  14.447 -38.705   8.649
  583    HZ2  LYS  81           1HZ      LYS  81  15.891 -37.832   8.783
  584    HZ3  LYS  81           2HZ      LYS  81  15.127 -38.420  10.172
  585    H    LEU  82           H        LEU  82  18.939 -36.584  14.267
  586    HA   LEU  82           HA       LEU  82  20.371 -38.871  15.370
  587    HB2  LEU  82           2HB      LEU  82  21.403 -36.077  15.321
  588    HB3  LEU  82           1HB      LEU  82  21.661 -37.015  16.779
  589    HG   LEU  82           HG       LEU  82  22.445 -38.199  14.150
  590   HD11  LEU  82          1HD1      LEU  82  24.495 -37.077  14.060
  591   HD12  LEU  82          2HD1      LEU  82  24.298 -36.400  15.677
  592   HD13  LEU  82          3HD1      LEU  82  23.308 -35.804  14.346
  593   HD21  LEU  82          3HD2      LEU  82  22.528 -39.165  16.654
  594   HD22  LEU  82          1HD2      LEU  82  24.108 -38.384  16.584
  595   HD23  LEU  82          2HD2      LEU  82  23.681 -39.620  15.401
  596    H    GLU  83           H        GLU  83  20.394 -38.768  17.818
  597    HA   GLU  83           HA       GLU  83  17.741 -38.132  18.731
  598    HB2  GLU  83           2HB      GLU  83  20.132 -39.484  19.918
  599    HB3  GLU  83           1HB      GLU  83  18.863 -38.909  20.991
  600    HG2  GLU  83           2HG      GLU  83  17.911 -40.450  18.685
  601    HG3  GLU  83           1HG      GLU  83  18.918 -41.352  19.815
  602    H    HIS  84           H        HIS  84  21.020 -37.081  19.683
  603    HA   HIS  84           HA       HIS  84  19.882 -34.500  20.485
  604    HB2  HIS  84           2HB      HIS  84  21.372 -36.418  22.203
  605    HB3  HIS  84           1HB      HIS  84  21.760 -34.711  22.385
  606    HD1  HIS  84           1HD      HIS  84  20.415 -33.599  24.127
  607    HD2  HIS  84           2HD      HIS  84  18.360 -36.766  22.389
  608    HE1  HIS  84           1HE      HIS  84  18.210 -33.715  25.333
  609    HE2  HIS  84           2HE      HIS  84  16.970 -35.617  24.241
  Start of MODEL   15
    1    H1   MET   1           1HT      MET   1  20.622   3.705  13.534
    2    H2   MET   1           2HT      MET   1  21.192   2.248  12.830
    3    H3   MET   1           3HT      MET   1  19.704   2.264  13.686
    4    HA   MET   1           HA       MET   1  20.310   3.663  11.164
    5    HB2  MET   1           2HB      MET   1  18.605   1.258  11.847
    6    HB3  MET   1           1HB      MET   1  18.577   2.072  10.290
    7    HG2  MET   1           2HG      MET   1  20.085   0.518   9.728
    8    HG3  MET   1           1HG      MET   1  21.218   1.602  10.532
    9    HE1  MET   1           2HE      MET   1  19.757  -2.292  10.943
   10    HE2  MET   1           3HE      MET   1  18.605  -0.963  11.078
   11    HE3  MET   1           1HE      MET   1  19.081  -1.867  12.516
   12    H    ALA   2           H        ALA   2  18.028   4.148  10.124
   13    HA   ALA   2           HA       ALA   2  16.722   5.977  11.944
   14    HB1  ALA   2           1HB      ALA   2  15.325   6.371   9.749
   15    HB2  ALA   2           2HB      ALA   2  16.673   5.514   9.003
   16    HB3  ALA   2           3HB      ALA   2  16.966   6.997   9.911
   17    H    VAL   3           H        VAL   3  14.447   6.044  12.326
   18    HA   VAL   3           HA       VAL   3  13.221   3.373  12.308
   19    HB   VAL   3           HB       VAL   3  13.522   4.379  14.530
   20   HG11  VAL   3          1HG1      VAL   3  12.270   6.685  13.226
   21   HG12  VAL   3          2HG1      VAL   3  13.356   6.613  14.613
   22   HG13  VAL   3          3HG1      VAL   3  11.631   6.318  14.828
   23   HG21  VAL   3          3HG2      VAL   3  10.575   4.410  13.988
   24   HG22  VAL   3          1HG2      VAL   3  11.447   3.767  15.379
   25   HG23  VAL   3          2HG2      VAL   3  11.506   2.920  13.833
   26    H    PHE   4           H        PHE   4  11.048   3.091  11.698
   27    HA   PHE   4           HA       PHE   4  10.153   4.876   9.614
   28    HB2  PHE   4           2HB      PHE   4   9.392   2.178  10.609
   29    HB3  PHE   4           1HB      PHE   4   8.143   3.101   9.786
   30    HD1  PHE   4           1HD      PHE   4  11.814   2.743   9.152
   31    HD2  PHE   4           2HD      PHE   4   7.848   2.230   7.693
   32    HE1  PHE   4           1HE      PHE   4  12.709   2.012   6.978
   33    HE2  PHE   4           2HE      PHE   4   8.737   1.501   5.520
   34    HZ   PHE   4           HZ       PHE   4  11.169   1.390   5.159
   35    H    HIS   5           H        HIS   5   7.771   5.466   9.521
   36    HA   HIS   5           HA       HIS   5   7.118   6.974  11.886
   37    HB2  HIS   5           2HB      HIS   5   6.771   7.690   9.430
   38    HB3  HIS   5           1HB      HIS   5   5.334   6.676   9.472
   39    HD1  HIS   5           1HD      HIS   5   6.787   9.531  11.529
   40    HD2  HIS   5           2HD      HIS   5   3.133   8.057  10.211
   41    HE1  HIS   5           1HE      HIS   5   5.073  11.192  12.312
   42    HE2  HIS   5           2HE      HIS   5   2.860  10.247  11.560
   43    H    ASP   6           H        ASP   6   5.275   4.580   9.965
   44    HA   ASP   6           HA       ASP   6   4.384   3.231  12.338
   45    HB2  ASP   6           2HB      ASP   6   2.636   5.207  10.970
   46    HB3  ASP   6           1HB      ASP   6   1.887   3.679  11.422
   47    H    GLU   7           H        GLU   7   2.994   1.368  11.836
   48    HA   GLU   7           HA       GLU   7   3.510   0.358   9.115
   49    HB2  GLU   7           2HB      GLU   7   2.950  -1.299  11.578
   50    HB3  GLU   7           1HB      GLU   7   3.549  -1.859  10.022
   51    HG2  GLU   7           2HG      GLU   7   5.673  -0.930  10.383
   52    HG3  GLU   7           1HG      GLU   7   5.102   0.057  11.728
   53    H    VAL   8           H        VAL   8   1.829  -0.259   7.871
   54    HA   VAL   8           HA       VAL   8  -0.793  -0.655   9.121
   55    HB   VAL   8           HB       VAL   8  -0.437   1.066   6.663
   56   HG11  VAL   8          1HG1      VAL   8  -2.749  -0.018   8.148
   57   HG12  VAL   8          2HG1      VAL   8  -2.582   0.380   6.438
   58   HG13  VAL   8          3HG1      VAL   8  -2.875   1.658   7.618
   59   HG21  VAL   8          3HG2      VAL   8  -0.976   2.981   8.061
   60   HG22  VAL   8          1HG2      VAL   8   0.486   2.189   8.648
   61   HG23  VAL   8          2HG2      VAL   8  -1.046   1.944   9.486
   62    H    GLU   9           H        GLU   9  -2.095  -2.132   8.123
   63    HA   GLU   9           HA       GLU   9  -0.872  -4.044   6.430
   64    HB2  GLU   9           2HB      GLU   9  -3.734  -3.643   7.300
   65    HB3  GLU   9           1HB      GLU   9  -3.233  -4.980   6.275
   66    HG2  GLU   9           2HG      GLU   9  -1.847  -5.878   7.992
   67    HG3  GLU   9           1HG      GLU   9  -2.067  -4.449   8.997
   68    H    ILE  10           H        ILE  10  -1.059  -4.434   4.283
   69    HA   ILE  10           HA       ILE  10  -1.448  -2.334   2.503
   70    HB   ILE  10           HB       ILE  10  -0.130  -4.375   2.022
   71   HG12  ILE  10          2HG1      ILE  10  -0.979  -4.624  -0.378
   72   HG13  ILE  10          1HG1      ILE  10  -2.262  -3.508   0.075
   73   HG21  ILE  10          1HG2      ILE  10  -2.824  -5.663   1.598
   74   HG22  ILE  10          2HG2      ILE  10  -1.674  -6.046   2.879
   75   HG23  ILE  10          3HG2      ILE  10  -1.264  -6.383   1.198
   76   HD11  ILE  10          3HD1      ILE  10  -0.882  -1.726   0.112
   77   HD12  ILE  10          1HD1      ILE  10   0.034  -2.724  -1.014
   78   HD13  ILE  10          2HD1      ILE  10   0.497  -2.663   0.686
   79    H    GLU  11           H        GLU  11  -3.770  -4.640   3.769
   80    HA   GLU  11           HA       GLU  11  -5.794  -4.361   1.844
   81    HB2  GLU  11           2HB      GLU  11  -7.339  -5.103   3.630
   82    HB3  GLU  11           1HB      GLU  11  -5.910  -6.117   3.503
   83    HG2  GLU  11           2HG      GLU  11  -5.229  -5.625   5.579
   84    HG3  GLU  11           1HG      GLU  11  -5.641  -3.920   5.414
   85    H    ASP  12           H        ASP  12  -4.820  -2.303   4.501
   86    HA   ASP  12           HA       ASP  12  -7.167  -0.678   4.540
   87    HB2  ASP  12           2HB      ASP  12  -5.236  -0.982   6.323
   88    HB3  ASP  12           1HB      ASP  12  -4.518   0.368   5.451
   89    H    PHE  13           H        PHE  13  -4.159  -0.637   2.744
   90    HA   PHE  13           HA       PHE  13  -4.220   2.014   1.812
   91    HB2  PHE  13           2HB      PHE  13  -2.965  -0.522   0.806
   92    HB3  PHE  13           1HB      PHE  13  -2.911   0.935  -0.178
   93    HD1  PHE  13           2HD      PHE  13  -2.392   0.138   3.444
   94    HD2  PHE  13           1HD      PHE  13  -0.910   2.025  -0.074
   95    HE1  PHE  13           2HE      PHE  13  -0.417   0.909   4.691
   96    HE2  PHE  13           1HE      PHE  13   1.065   2.796   1.168
   97    HZ   PHE  13           HZ       PHE  13   1.314   2.239   3.554
   98    H    GLN  14           H        GLN  14  -4.759   2.796  -0.324
   99    HA   GLN  14           HA       GLN  14  -7.252   1.623  -1.289
  100    HB2  GLN  14           2HB      GLN  14  -6.670   4.188  -0.781
  101    HB3  GLN  14           1HB      GLN  14  -6.169   4.135  -2.465
  102    HG2  GLN  14           2HG      GLN  14  -8.828   3.007  -1.806
  103    HG3  GLN  14           1HG      GLN  14  -8.638   4.756  -1.712
  104   HE21  GLN  14          1HE2      GLN  14  -9.967   2.718  -3.623
  105   HE22  GLN  14          2HE2      GLN  14  -9.512   3.299  -5.185
  106    H    TYR  15           H        TYR  15  -6.315  -0.194  -2.341
  107    HA   TYR  15           HA       TYR  15  -4.342   0.047  -4.353
  108    HB2  TYR  15           2HB      TYR  15  -4.784  -2.087  -3.231
  109    HB3  TYR  15           1HB      TYR  15  -6.397  -2.136  -3.933
  110    HD1  TYR  15           1HD      TYR  15  -2.814  -1.905  -4.970
  111    HD2  TYR  15           2HD      TYR  15  -6.717  -3.317  -5.903
  112    HE1  TYR  15           1HE      TYR  15  -1.914  -3.067  -6.938
  113    HE2  TYR  15           2HE      TYR  15  -5.829  -4.486  -7.875
  114    HH   TYR  15           HH       TYR  15  -2.829  -5.280  -8.348
  115    H    ASP  16           H        ASP  16  -4.567  -0.199  -6.617
  116    HA   ASP  16           HA       ASP  16  -7.180   0.185  -7.808
  117    HB2  ASP  16           2HB      ASP  16  -5.815   2.454  -7.202
  118    HB3  ASP  16           1HB      ASP  16  -5.170   2.119  -8.807
  119    H    GLU  17           H        GLU  17  -7.024  -1.665  -8.991
  120    HA   GLU  17           HA       GLU  17  -4.783  -2.765 -10.176
  121    HB2  GLU  17           2HB      GLU  17  -6.439  -3.765 -11.863
  122    HB3  GLU  17           1HB      GLU  17  -6.680  -4.141 -10.165
  123    HG2  GLU  17           2HG      GLU  17  -8.567  -2.810 -10.006
  124    HG3  GLU  17           1HG      GLU  17  -8.131  -1.846 -11.415
  125    H    ASP  18           H        ASP  18  -6.786  -0.122 -11.311
  126    HA   ASP  18           HA       ASP  18  -6.093   0.030 -13.986
  127    HB2  ASP  18           2HB      ASP  18  -7.693   1.513 -12.526
  128    HB3  ASP  18           1HB      ASP  18  -6.271   2.531 -12.333
  129    H    SER  19           H        SER  19  -4.352   1.291 -11.163
  130    HA   SER  19           HA       SER  19  -2.099   2.010 -12.913
  131    HB2  SER  19           2HB      SER  19  -3.221   3.699 -11.297
  132    HB3  SER  19           1HB      SER  19  -2.343   2.837 -10.035
  133    HG   SER  19           HG       SER  19  -0.432   3.428 -10.954
  134    H    GLU  20           H        GLU  20  -3.059  -0.237 -10.474
  135    HA   GLU  20           HA       GLU  20  -1.998  -1.963  -9.458
  136    HB2  GLU  20           2HB      GLU  20  -1.098  -2.252 -11.827
  137    HB3  GLU  20           1HB      GLU  20   0.359  -1.445 -11.269
  138    HG2  GLU  20           2HG      GLU  20   0.284  -3.280  -9.404
  139    HG3  GLU  20           1HG      GLU  20  -0.701  -4.136 -10.590
  140    H    THR  21           H        THR  21  -1.871   0.507  -8.223
  141    HA   THR  21           HA       THR  21   0.622   0.249  -6.718
  142    HB   THR  21           HB       THR  21  -0.400   2.922  -7.708
  143    HG1  THR  21           1HG      THR  21   1.127   2.847  -9.235
  144   HG21  THR  21          3HG2      THR  21   1.406   3.943  -6.740
  145   HG22  THR  21          1HG2      THR  21   2.348   2.454  -6.666
  146   HG23  THR  21          2HG2      THR  21   1.020   2.715  -5.535
  147    H    TYR  22           H        TYR  22   0.472   0.873  -4.555
  148    HA   TYR  22           HA       TYR  22  -2.273   1.239  -3.573
  149    HB2  TYR  22           2HB      TYR  22   0.217   0.341  -2.103
  150    HB3  TYR  22           1HB      TYR  22  -1.381   0.502  -1.387
  151    HD1  TYR  22           1HD      TYR  22   0.608  -1.395  -3.854
  152    HD2  TYR  22           2HD      TYR  22  -3.008  -1.208  -1.617
  153    HE1  TYR  22           1HE      TYR  22   0.103  -3.711  -4.493
  154    HE2  TYR  22           2HE      TYR  22  -3.522  -3.530  -2.250
  155    HH   TYR  22           HH       TYR  22  -2.569  -5.058  -4.564
  156    H    PHE  23           H        PHE  23  -2.846   2.924  -2.251
  157    HA   PHE  23           HA       PHE  23  -0.783   4.957  -1.715
  158    HB2  PHE  23           2HB      PHE  23  -3.633   5.549  -2.542
  159    HB3  PHE  23           1HB      PHE  23  -2.349   6.723  -2.263
  160    HD1  PHE  23           2HD      PHE  23  -3.541   4.058  -4.509
  161    HD2  PHE  23           1HD      PHE  23  -0.735   7.207  -3.938
  162    HE1  PHE  23           2HE      PHE  23  -2.902   3.911  -6.878
  163    HE2  PHE  23           1HE      PHE  23  -0.090   7.066  -6.308
  164    HZ   PHE  23           HZ       PHE  23  -1.173   5.416  -7.782
  165    H    TYR  24           H        TYR  24  -1.038   6.214   0.157
  166    HA   TYR  24           HA       TYR  24  -3.125   5.327   2.033
  167    HB2  TYR  24           2HB      TYR  24  -0.758   4.326   2.401
  168    HB3  TYR  24           1HB      TYR  24  -0.340   5.932   2.987
  169    HD1  TYR  24           2HD      TYR  24  -2.703   3.112   3.525
  170    HD2  TYR  24           1HD      TYR  24  -0.842   6.558   5.191
  171    HE1  TYR  24           2HE      TYR  24  -3.626   2.540   5.727
  172    HE2  TYR  24           1HE      TYR  24  -1.762   5.994   7.399
  173    HH   TYR  24           HH       TYR  24  -4.229   3.909   7.885
  174    HA   PRO  25           HA       PRO  25  -3.726   9.702   2.505
  175    HB2  PRO  25           2HB      PRO  25  -5.295   9.675   4.708
  176    HB3  PRO  25           1HB      PRO  25  -5.879   9.179   3.115
  177    HG2  PRO  25           2HG      PRO  25  -4.955   7.487   5.406
  178    HG3  PRO  25           1HG      PRO  25  -6.350   7.257   4.337
  179    HD2  PRO  25           2HD      PRO  25  -4.014   5.908   4.026
  180    HD3  PRO  25           1HD      PRO  25  -5.075   6.325   2.666
  181    H    CYS  26           H        CYS  26  -2.287  11.114   3.261
  182    HA   CYS  26           HA       CYS  26  -0.877  10.531   5.757
  183    HB2  CYS  26           2HB      CYS  26  -0.018  11.503   3.286
  184    HB3  CYS  26           1HB      CYS  26   0.015  12.911   4.345
  185    HA   PRO  27           HA       PRO  27  -3.131  13.582   8.032
  186    HB2  PRO  27           2HB      PRO  27  -1.249  14.285   9.872
  187    HB3  PRO  27           1HB      PRO  27  -2.156  12.770   9.940
  188    HG2  PRO  27           2HG      PRO  27   0.610  13.277   8.917
  189    HG3  PRO  27           1HG      PRO  27   0.011  11.936   9.910
  190    HD2  PRO  27           2HD      PRO  27   0.424  11.692   7.252
  191    HD3  PRO  27           1HD      PRO  27  -0.876  10.821   8.094
  192    H    CYS  28           H        CYS  28  -0.131  14.344   6.443
  193    HA   CYS  28           HA       CYS  28  -0.184  17.152   7.034
  194    HB2  CYS  28           2HB      CYS  28   1.627  17.311   5.367
  195    HB3  CYS  28           1HB      CYS  28   1.935  16.052   6.557
  196    H    GLY  29           H        GLY  29  -1.372  15.092   4.435
  197    HA2  GLY  29           2HA      GLY  29  -3.468  16.375   3.508
  198    HA3  GLY  29           1HA      GLY  29  -2.211  17.421   2.867
  199    H    ASP  30           H        ASP  30  -0.294  15.571   2.116
  200    HA   ASP  30           HA       ASP  30  -1.402  14.603  -0.340
  201    HB2  ASP  30           2HB      ASP  30   1.267  14.927   0.838
  202    HB3  ASP  30           1HB      ASP  30   1.120  13.502  -0.183
  203    H    ASN  31           H        ASN  31  -0.277  12.218  -0.910
  204    HA   ASN  31           HA       ASN  31  -1.062  10.365   1.219
  205    HB2  ASN  31           2HB      ASN  31  -2.055  10.088  -1.627
  206    HB3  ASN  31           1HB      ASN  31  -2.454   9.055  -0.259
  207   HD21  ASN  31          1HD2      ASN  31  -2.797  12.318  -1.549
  208   HD22  ASN  31          2HD2      ASN  31  -4.261  12.688  -0.707
  209    H    PHE  32           H        PHE  32   0.210   8.628   1.392
  210    HA   PHE  32           HA       PHE  32   2.649   8.439   0.007
  211    HB2  PHE  32           2HB      PHE  32   1.143   6.572   1.821
  212    HB3  PHE  32           1HB      PHE  32   2.633   6.054   1.044
  213    HD1  PHE  32           1HD      PHE  32   4.686   7.605   1.372
  214    HD2  PHE  32           2HD      PHE  32   1.237   7.662   3.862
  215    HE1  PHE  32           1HE      PHE  32   6.003   8.648   3.167
  216    HE2  PHE  32           2HE      PHE  32   2.549   8.711   5.659
  217    HZ   PHE  32           HZ       PHE  32   4.936   9.204   5.313
  218    H    SER  33           H        SER  33   3.414   6.639  -1.343
  219    HA   SER  33           HA       SER  33   1.361   5.173  -2.807
  220    HB2  SER  33           2HB      SER  33   2.549   5.887  -4.992
  221    HB3  SER  33           1HB      SER  33   1.433   7.026  -4.241
  222    HG   SER  33           HG       SER  33   4.264   7.045  -4.162
  223    H    ILE  34           H        ILE  34   2.011   3.238  -3.583
  224    HA   ILE  34           HA       ILE  34   4.823   2.576  -3.827
  225    HB   ILE  34           HB       ILE  34   4.463   2.122  -1.462
  226   HG12  ILE  34          2HG1      ILE  34   4.565  -0.430  -3.090
  227   HG13  ILE  34          1HG1      ILE  34   5.938   0.614  -2.733
  228   HG21  ILE  34          1HG2      ILE  34   1.901   1.573  -2.076
  229   HG22  ILE  34          2HG2      ILE  34   2.674   1.076  -0.571
  230   HG23  ILE  34          3HG2      ILE  34   2.536  -0.064  -1.909
  231   HD11  ILE  34          3HD1      ILE  34   6.042  -0.050  -0.542
  232   HD12  ILE  34          1HD1      ILE  34   5.524  -1.534  -1.340
  233   HD13  ILE  34          2HD1      ILE  34   4.345  -0.531  -0.493
  234    H    THR  35           H        THR  35   5.069   1.322  -5.572
  235    HA   THR  35           HA       THR  35   2.805   0.352  -7.009
  236    HB   THR  35           HB       THR  35   4.411  -0.504  -8.630
  237    HG1  THR  35           1HG      THR  35   6.456   0.235  -6.811
  238   HG21  THR  35          3HG2      THR  35   4.008   2.030  -8.372
  239   HG22  THR  35          1HG2      THR  35   5.348   1.465  -9.370
  240   HG23  THR  35          2HG2      THR  35   5.654   2.057  -7.738
  241    H    LYS  36           H        LYS  36   2.294  -1.803  -7.576
  242    HA   LYS  36           HA       LYS  36   2.226  -3.625  -5.459
  243    HB2  LYS  36           2HB      LYS  36   0.632  -3.685  -7.315
  244    HB3  LYS  36           1HB      LYS  36   1.915  -4.146  -8.422
  245    HG2  LYS  36           2HG      LYS  36   0.672  -6.096  -7.905
  246    HG3  LYS  36           1HG      LYS  36   2.226  -6.226  -7.079
  247    HD2  LYS  36           2HD      LYS  36   1.205  -5.535  -4.990
  248    HD3  LYS  36           1HD      LYS  36  -0.342  -5.288  -5.802
  249    HE2  LYS  36           2HE      LYS  36   0.011  -7.804  -6.500
  250    HE3  LYS  36           1HE      LYS  36   1.046  -7.821  -5.073
  251    HZ1  LYS  36           3HZ      LYS  36  -1.080  -6.664  -4.039
  252    HZ2  LYS  36           1HZ      LYS  36  -0.920  -8.347  -4.110
  253    HZ3  LYS  36           2HZ      LYS  36  -1.853  -7.538  -5.266
  254    H    GLU  37           H        GLU  37   4.485  -3.306  -8.146
  255    HA   GLU  37           HA       GLU  37   5.861  -5.730  -7.839
  256    HB2  GLU  37           2HB      GLU  37   6.006  -3.944  -9.720
  257    HB3  GLU  37           1HB      GLU  37   7.226  -3.194  -8.700
  258    HG2  GLU  37           2HG      GLU  37   8.726  -4.899  -8.997
  259    HG3  GLU  37           1HG      GLU  37   7.476  -6.089  -9.348
  260    H    ASP  38           H        ASP  38   6.270  -2.593  -6.246
  261    HA   ASP  38           HA       ASP  38   8.711  -3.051  -4.960
  262    HB2  ASP  38           2HB      ASP  38   6.357  -1.286  -4.426
  263    HB3  ASP  38           1HB      ASP  38   7.559  -1.474  -3.153
  264    H    LEU  39           H        LEU  39   5.394  -3.696  -3.830
  265    HA   LEU  39           HA       LEU  39   6.129  -4.761  -1.323
  266    HB2  LEU  39           2HB      LEU  39   3.680  -5.399  -2.965
  267    HB3  LEU  39           1HB      LEU  39   3.873  -5.684  -1.246
  268    HG   LEU  39           HG       LEU  39   4.205  -2.893  -2.215
  269   HD11  LEU  39          1HD1      LEU  39   2.258  -3.535  -3.449
  270   HD12  LEU  39          2HD1      LEU  39   1.754  -2.555  -2.072
  271   HD13  LEU  39          3HD1      LEU  39   1.554  -4.307  -2.027
  272   HD21  LEU  39          3HD2      LEU  39   2.813  -4.052   0.195
  273   HD22  LEU  39          1HD2      LEU  39   3.233  -2.362  -0.083
  274   HD23  LEU  39          2HD2      LEU  39   4.507  -3.558   0.156
  275    H    GLU  40           H        GLU  40   5.581  -6.296  -4.478
  276    HA   GLU  40           HA       GLU  40   5.889  -8.961  -3.551
  277    HB2  GLU  40           2HB      GLU  40   6.256  -7.799  -6.313
  278    HB3  GLU  40           1HB      GLU  40   6.203  -9.519  -5.949
  279    HG2  GLU  40           2HG      GLU  40   3.928  -9.325  -5.170
  280    HG3  GLU  40           1HG      GLU  40   3.971  -7.576  -5.398
  281    H    ASN  41           H        ASN  41   8.179  -6.499  -4.537
  282    HA   ASN  41           HA       ASN  41  10.387  -8.361  -4.733
  283    HB2  ASN  41           2HB      ASN  41  10.006  -5.442  -5.164
  284    HB3  ASN  41           1HB      ASN  41  11.628  -5.990  -4.750
  285   HD21  ASN  41          1HD2      ASN  41   9.224  -5.799  -7.165
  286   HD22  ASN  41          2HD2      ASN  41  10.101  -6.593  -8.423
  287    H    GLY  42           H        GLY  42   9.256  -5.889  -2.446
  288    HA2  GLY  42           2HA      GLY  42   9.819  -6.830  -0.069
  289    HA3  GLY  42           1HA      GLY  42  11.461  -6.538  -0.624
  290    H    GLU  43           H        GLU  43  10.087  -4.138  -2.167
  291    HA   GLU  43           HA       GLU  43  10.846  -2.136  -0.309
  292    HB2  GLU  43           2HB      GLU  43   9.498  -2.093  -2.998
  293    HB3  GLU  43           1HB      GLU  43   9.658  -0.619  -2.056
  294    HG2  GLU  43           2HG      GLU  43  11.886  -2.366  -3.065
  295    HG3  GLU  43           1HG      GLU  43  11.442  -0.765  -3.652
  296    H    ASP  44           H        ASP  44   9.499  -2.748   1.501
  297    HA   ASP  44           HA       ASP  44   6.650  -2.172   1.265
  298    HB2  ASP  44           2HB      ASP  44   6.567  -2.984   3.651
  299    HB3  ASP  44           1HB      ASP  44   7.097  -4.174   2.474
  300    H    VAL  45           H        VAL  45   8.354   0.019   0.908
  301    HA   VAL  45           HA       VAL  45   7.668   1.625   3.270
  302    HB   VAL  45           HB       VAL  45  10.089   1.243   3.280
  303   HG11  VAL  45          1HG1      VAL  45  10.439   2.850   0.795
  304   HG12  VAL  45          2HG1      VAL  45  10.088   1.128   0.653
  305   HG13  VAL  45          3HG1      VAL  45  11.517   1.665   1.534
  306   HG21  VAL  45          3HG2      VAL  45  10.581   3.364   3.918
  307   HG22  VAL  45          1HG2      VAL  45   8.837   3.556   3.737
  308   HG23  VAL  45          2HG2      VAL  45   9.920   4.079   2.447
  309    H    ALA  46           H        ALA  46   6.595   3.453   2.875
  310    HA   ALA  46           HA       ALA  46   6.344   4.297   0.067
  311    HB1  ALA  46           1HB      ALA  46   4.126   4.554   0.307
  312    HB2  ALA  46           2HB      ALA  46   4.273   5.220   1.933
  313    HB3  ALA  46           3HB      ALA  46   4.322   3.474   1.686
  314    H    THR  47           H        THR  47   6.686   6.401  -0.467
  315    HA   THR  47           HA       THR  47   7.514   8.201   1.715
  316    HB   THR  47           HB       THR  47   8.544   8.266  -1.130
  317    HG1  THR  47           1HG      THR  47   9.528   6.513  -0.437
  318   HG21  THR  47          3HG2      THR  47   9.699  10.074  -0.592
  319   HG22  THR  47          1HG2      THR  47  10.295   9.328   0.890
  320   HG23  THR  47          2HG2      THR  47   8.746  10.169   0.889
  321    H    CYS  48           H        CYS  48   6.548  10.132   1.870
  322    HA   CYS  48           HA       CYS  48   4.410  10.754  -0.004
  323    HB2  CYS  48           2HB      CYS  48   4.118  10.843   2.516
  324    HB3  CYS  48           1HB      CYS  48   5.151  12.268   2.505
  325    HA   PRO  49           HA       PRO  49   6.934  13.748  -2.122
  326    HB2  PRO  49           2HB      PRO  49   4.998  14.934  -3.587
  327    HB3  PRO  49           1HB      PRO  49   5.609  13.316  -3.949
  328    HG2  PRO  49           2HG      PRO  49   3.114  14.124  -2.510
  329    HG3  PRO  49           1HG      PRO  49   3.347  12.842  -3.710
  330    HD2  PRO  49           2HD      PRO  49   3.228  12.383  -1.027
  331    HD3  PRO  49           1HD      PRO  49   4.145  11.359  -2.150
  332    H    SER  50           H        SER  50   4.645  14.503   0.266
  333    HA   SER  50           HA       SER  50   5.126  17.387   0.021
  334    HB2  SER  50           2HB      SER  50   2.780  16.051   0.476
  335    HB3  SER  50           1HB      SER  50   3.266  16.487   2.115
  336    HG   SER  50           HG       SER  50   2.347  18.066   0.087
  337    H    CYS  51           H        CYS  51   4.720  15.102   2.752
  338    HA   CYS  51           HA       CYS  51   6.480  16.692   4.391
  339    HB2  CYS  51           2HB      CYS  51   5.989  15.083   6.155
  340    HB3  CYS  51           1HB      CYS  51   4.504  15.595   5.361
  341    H    SER  52           H        SER  52   6.770  13.817   2.434
  342    HA   SER  52           HA       SER  52   8.565  12.569   1.817
  343    HB2  SER  52           2HB      SER  52   9.623  15.042   2.097
  344    HB3  SER  52           1HB      SER  52  10.562  14.172   3.310
  345    HG   SER  52           HG       SER  52  11.549  13.091   1.781
  346    H    LEU  53           H        LEU  53   7.111  11.836   4.085
  347    HA   LEU  53           HA       LEU  53   9.070  10.945   6.059
  348    HB2  LEU  53           2HB      LEU  53   6.085  11.091   5.957
  349    HB3  LEU  53           1HB      LEU  53   6.838   9.955   7.060
  350    HG   LEU  53           HG       LEU  53   7.603  12.860   7.082
  351   HD11  LEU  53          1HD1      LEU  53   5.026  12.169   7.405
  352   HD12  LEU  53          2HD1      LEU  53   5.797  13.501   8.265
  353   HD13  LEU  53          3HD1      LEU  53   5.616  11.933   9.050
  354   HD21  LEU  53          3HD2      LEU  53   8.809  10.866   8.307
  355   HD22  LEU  53          1HD2      LEU  53   7.491  11.069   9.461
  356   HD23  LEU  53          2HD2      LEU  53   8.572  12.417   9.111
  357    H    ILE  54           H        ILE  54   8.373   8.591   6.928
  358    HA   ILE  54           HA       ILE  54   8.220   6.813   4.579
  359    HB   ILE  54           HB       ILE  54   9.759   5.258   5.776
  360   HG12  ILE  54          2HG1      ILE  54  10.211   7.644   7.588
  361   HG13  ILE  54          1HG1      ILE  54   9.444   6.129   8.054
  362   HG21  ILE  54          1HG2      ILE  54  11.722   6.285   5.007
  363   HG22  ILE  54          2HG2      ILE  54  11.108   7.904   5.337
  364   HG23  ILE  54          3HG2      ILE  54  10.439   6.962   4.005
  365   HD11  ILE  54          3HD1      ILE  54  11.459   4.944   7.910
  366   HD12  ILE  54          1HD1      ILE  54  11.865   6.457   8.718
  367   HD13  ILE  54          2HD1      ILE  54  12.251   6.236   7.011
  368    H    ILE  55           H        ILE  55   7.064   4.918   4.809
  369    HA   ILE  55           HA       ILE  55   5.892   4.301   7.417
  370    HB   ILE  55           HB       ILE  55   3.647   3.964   6.389
  371   HG12  ILE  55          2HG1      ILE  55   4.301   5.810   4.162
  372   HG13  ILE  55          1HG1      ILE  55   4.876   4.155   3.990
  373   HG21  ILE  55          1HG2      ILE  55   4.685   6.792   6.261
  374   HG22  ILE  55          2HG2      ILE  55   4.162   5.951   7.720
  375   HG23  ILE  55          3HG2      ILE  55   3.000   6.306   6.443
  376   HD11  ILE  55          3HD1      ILE  55   2.863   3.484   3.381
  377   HD12  ILE  55          1HD1      ILE  55   2.321   5.160   3.444
  378   HD13  ILE  55          2HD1      ILE  55   2.157   4.128   4.864
  379    H    LYS  56           H        LYS  56   5.376   2.146   7.730
  380    HA   LYS  56           HA       LYS  56   6.541   0.315   5.781
  381    HB2  LYS  56           2HB      LYS  56   7.166   0.161   8.189
  382    HB3  LYS  56           1HB      LYS  56   5.502  -0.262   8.562
  383    HG2  LYS  56           2HG      LYS  56   6.373  -2.348   8.458
  384    HG3  LYS  56           1HG      LYS  56   5.976  -2.145   6.751
  385    HD2  LYS  56           2HD      LYS  56   8.226  -1.601   6.206
  386    HD3  LYS  56           1HD      LYS  56   8.670  -1.453   7.907
  387    HE2  LYS  56           2HE      LYS  56   7.619  -4.038   6.817
  388    HE3  LYS  56           1HE      LYS  56   9.315  -3.603   6.612
  389    HZ1  LYS  56           3HZ      LYS  56   9.149  -3.177   9.172
  390    HZ2  LYS  56           1HZ      LYS  56   9.386  -4.743   8.574
  391    HZ3  LYS  56           2HZ      LYS  56   7.846  -4.250   9.069
  392    H    VAL  57           H        VAL  57   5.496  -1.097   4.601
  393    HA   VAL  57           HA       VAL  57   2.569  -1.141   4.826
  394    HB   VAL  57           HB       VAL  57   3.829  -2.190   2.356
  395   HG11  VAL  57          1HG1      VAL  57   1.485  -0.444   3.047
  396   HG12  VAL  57          2HG1      VAL  57   1.462  -2.119   2.493
  397   HG13  VAL  57          3HG1      VAL  57   1.948  -0.831   1.391
  398   HG21  VAL  57          3HG2      VAL  57   3.769   0.781   2.908
  399   HG22  VAL  57          1HG2      VAL  57   4.230  -0.000   1.397
  400   HG23  VAL  57          2HG2      VAL  57   5.229  -0.203   2.833
  401    H    ILE  58           H        ILE  58   1.814  -2.896   5.801
  402    HA   ILE  58           HA       ILE  58   3.345  -5.376   5.755
  403    HB   ILE  58           HB       ILE  58   0.746  -4.859   7.200
  404   HG12  ILE  58          2HG1      ILE  58   2.462  -3.232   7.907
  405   HG13  ILE  58          1HG1      ILE  58   2.085  -4.376   9.191
  406   HG21  ILE  58          1HG2      ILE  58   1.071  -7.162   7.139
  407   HG22  ILE  58          2HG2      ILE  58   1.775  -6.695   8.688
  408   HG23  ILE  58          3HG2      ILE  58   2.821  -7.018   7.305
  409   HD11  ILE  58          3HD1      ILE  58   4.188  -5.594   7.964
  410   HD12  ILE  58          1HD1      ILE  58   4.299  -4.557   9.385
  411   HD13  ILE  58          2HD1      ILE  58   4.593  -3.887   7.780
  412    H    TYR  59           H        TYR  59   2.785  -7.175   4.670
  413    HA   TYR  59           HA       TYR  59   0.122  -7.540   3.596
  414    HB2  TYR  59           2HB      TYR  59   1.009  -7.829   1.246
  415    HB3  TYR  59           1HB      TYR  59   1.006  -6.168   1.834
  416    HD1  TYR  59           1HD      TYR  59   3.099  -5.031   2.371
  417    HD2  TYR  59           2HD      TYR  59   3.090  -9.001   0.844
  418    HE1  TYR  59           1HE      TYR  59   5.502  -4.848   1.902
  419    HE2  TYR  59           2HE      TYR  59   5.494  -8.828   0.367
  420    HH   TYR  59           HH       TYR  59   7.148  -6.785  -0.097
  421    H    ASP  60           H        ASP  60   0.202  -9.634   2.111
  422    HA   ASP  60           HA       ASP  60   1.538 -11.653   3.725
  423    HB2  ASP  60           2HB      ASP  60  -0.960 -11.620   2.766
  424    HB3  ASP  60           1HB      ASP  60  -0.171 -12.421   1.411
  425    H    LYS  61           H        LYS  61   3.646 -11.786   3.153
  426    HA   LYS  61           HA       LYS  61   4.687 -11.495   0.563
  427    HB2  LYS  61           2HB      LYS  61   5.705 -12.634   3.122
  428    HB3  LYS  61           1HB      LYS  61   6.588 -13.006   1.647
  429    HG2  LYS  61           2HG      LYS  61   6.313 -10.348   1.360
  430    HG3  LYS  61           1HG      LYS  61   6.337 -10.469   3.121
  431    HD2  LYS  61           2HD      LYS  61   8.394 -12.089   2.541
  432    HD3  LYS  61           1HD      LYS  61   8.470 -11.012   1.144
  433    HE2  LYS  61           2HE      LYS  61   8.325  -9.107   2.854
  434    HE3  LYS  61           1HE      LYS  61   8.721 -10.334   4.056
  435    HZ1  LYS  61           3HZ      LYS  61  10.430 -10.189   1.693
  436    HZ2  LYS  61           1HZ      LYS  61  10.831 -10.524   3.302
  437    HZ3  LYS  61           2HZ      LYS  61  10.564  -8.928   2.812
  438    H    ASP  62           H        ASP  62   3.286 -14.263   2.188
  439    HA   ASP  62           HA       ASP  62   4.278 -16.278   0.475
  440    HB2  ASP  62           2HB      ASP  62   2.916 -16.358   2.777
  441    HB3  ASP  62           1HB      ASP  62   1.566 -16.587   1.668
  442    H    GLN  63           H        GLN  63   1.482 -14.134   0.290
  443    HA   GLN  63           HA       GLN  63   0.409 -15.448  -2.054
  444    HB2  GLN  63           2HB      GLN  63  -0.338 -12.937  -0.559
  445    HB3  GLN  63           1HB      GLN  63  -1.136 -13.418  -2.049
  446    HG2  GLN  63           2HG      GLN  63  -1.927 -15.445  -1.042
  447    HG3  GLN  63           1HG      GLN  63  -0.998 -15.128   0.423
  448   HE21  GLN  63          1HE2      GLN  63  -3.921 -14.610  -1.235
  449   HE22  GLN  63          2HE2      GLN  63  -4.664 -13.560  -0.085
  450    H    PHE  64           H        PHE  64   2.088 -12.405  -1.322
  451    HA   PHE  64           HA       PHE  64   2.065 -11.369  -3.947
  452    HB2  PHE  64           2HB      PHE  64   3.708 -10.823  -1.496
  453    HB3  PHE  64           1HB      PHE  64   4.169 -10.100  -3.032
  454    HD1  PHE  64           2HD      PHE  64   0.997 -10.605  -1.110
  455    HD2  PHE  64           1HD      PHE  64   3.475  -7.942  -3.321
  456    HE1  PHE  64           2HE      PHE  64  -0.629  -8.796  -0.747
  457    HE2  PHE  64           1HE      PHE  64   1.852  -6.131  -2.962
  458    HZ   PHE  64           HZ       PHE  64  -0.203  -6.554  -1.674
  459    H    VAL  65           H        VAL  65   4.335 -13.487  -2.251
  460    HA   VAL  65           HA       VAL  65   5.874 -13.766  -4.749
  461    HB   VAL  65           HB       VAL  65   6.828 -14.491  -1.975
  462   HG11  VAL  65          1HG1      VAL  65   8.711 -13.862  -4.161
  463   HG12  VAL  65          2HG1      VAL  65   7.801 -15.363  -4.324
  464   HG13  VAL  65          3HG1      VAL  65   8.801 -15.090  -2.898
  465   HG21  VAL  65          3HG2      VAL  65   6.603 -12.180  -1.816
  466   HG22  VAL  65          1HG2      VAL  65   7.046 -11.921  -3.503
  467   HG23  VAL  65          2HG2      VAL  65   8.277 -12.387  -2.330
  468    H    SER  66           H        SER  66   4.414 -15.312  -5.601
  469    HA   SER  66           HA       SER  66   4.392 -17.916  -4.225
  470    HB2  SER  66           2HB      SER  66   2.448 -18.440  -5.709
  471    HB3  SER  66           1HB      SER  66   2.156 -17.067  -4.641
  472    HG   SER  66           HG       SER  66   1.518 -16.331  -6.575
  473    H    GLY  67           H        GLY  67   6.730 -17.153  -5.599
  474    HA2  GLY  67           2HA      GLY  67   6.723 -18.215  -8.263
  475    HA3  GLY  67           1HA      GLY  67   8.135 -17.738  -7.337
  476    H    GLU  68           H        GLU  68   8.618 -19.302  -5.439
  477    HA   GLU  68           HA       GLU  68   8.333 -22.055  -6.457
  478    HB2  GLU  68           2HB      GLU  68  10.641 -20.616  -5.196
  479    HB3  GLU  68           1HB      GLU  68  10.520 -22.366  -5.063
  480    HG2  GLU  68           2HG      GLU  68  11.078 -22.701  -7.202
  481    HG3  GLU  68           1HG      GLU  68  10.132 -21.328  -7.771
  482    H    THR  69           H        THR  69   6.358 -22.234  -5.202
  483    HA   THR  69           HA       THR  69   6.901 -23.232  -2.541
  484    HB   THR  69           HB       THR  69   4.762 -21.119  -2.846
  485    HG1  THR  69           1HG      THR  69   7.452 -20.824  -2.007
  486   HG21  THR  69          3HG2      THR  69   4.795 -22.836  -0.910
  487   HG22  THR  69          1HG2      THR  69   4.530 -21.126  -0.568
  488   HG23  THR  69          2HG2      THR  69   6.118 -21.842  -0.299
  489    H    VAL  70           H        VAL  70   5.770 -25.040  -2.231
  490    HA   VAL  70           HA       VAL  70   3.443 -25.556  -3.957
  491    HB   VAL  70           HB       VAL  70   5.077 -27.593  -2.435
  492   HG11  VAL  70          1HG1      VAL  70   2.788 -28.275  -3.014
  493   HG12  VAL  70          2HG1      VAL  70   4.003 -29.219  -3.874
  494   HG13  VAL  70          3HG1      VAL  70   3.128 -27.937  -4.711
  495   HG21  VAL  70          3HG2      VAL  70   5.410 -26.486  -5.201
  496   HG22  VAL  70          1HG2      VAL  70   5.911 -28.134  -4.817
  497   HG23  VAL  70          2HG2      VAL  70   6.629 -26.771  -3.959
  498    HA   PRO  71           HA       PRO  71   0.695 -25.320  -0.479
  499    HB2  PRO  71           2HB      PRO  71  -0.874 -27.426  -1.850
  500    HB3  PRO  71           1HB      PRO  71  -1.359 -25.798  -1.366
  501    HG2  PRO  71           2HG      PRO  71  -0.933 -26.411  -3.931
  502    HG3  PRO  71           1HG      PRO  71  -0.476 -24.827  -3.274
  503    HD2  PRO  71           2HD      PRO  71   1.245 -27.196  -3.887
  504    HD3  PRO  71           1HD      PRO  71   1.571 -25.470  -4.145
  505    H    ALA  72           H        ALA  72  -0.689 -26.988   0.885
  506    HA   ALA  72           HA       ALA  72   0.543 -29.578   1.217
  507    HB1  ALA  72           1HB      ALA  72   1.052 -27.340   3.138
  508    HB2  ALA  72           2HB      ALA  72   2.182 -28.520   2.471
  509    HB3  ALA  72           3HB      ALA  72   1.014 -29.013   3.698
  510    HA   PRO  73           HA       PRO  73  -3.534 -30.309   2.820
  511    HB2  PRO  73           2HB      PRO  73  -3.255 -32.853   3.604
  512    HB3  PRO  73           1HB      PRO  73  -3.189 -32.409   1.893
  513    HG2  PRO  73           2HG      PRO  73  -0.951 -33.014   3.784
  514    HG3  PRO  73           1HG      PRO  73  -1.150 -33.501   2.092
  515    HD2  PRO  73           2HD      PRO  73   0.403 -31.382   2.939
  516    HD3  PRO  73           1HD      PRO  73  -0.277 -31.543   1.308
  517    H    SER  74           H        SER  74  -2.150 -28.727   4.579
  518    HA   SER  74           HA       SER  74  -2.107 -28.064   6.738
  519    HB2  SER  74           2HB      SER  74  -3.646 -30.352   7.817
  520    HB3  SER  74           1HB      SER  74  -3.889 -28.623   8.038
  521    HG   SER  74           HG       SER  74  -4.816 -28.564   5.944
  522    H    ALA  75           H        ALA  75  -2.249 -31.601   7.223
  523    HA   ALA  75           HA       ALA  75   0.501 -31.978   7.671
  524    HB1  ALA  75           1HB      ALA  75   0.623 -30.895   9.660
  525    HB2  ALA  75           2HB      ALA  75   0.017 -32.435  10.269
  526    HB3  ALA  75           3HB      ALA  75  -1.096 -31.094   9.999
  527    H    ASN  76           H        ASN  76   0.786 -34.097   9.138
  528    HA   ASN  76           HA       ASN  76  -1.146 -36.017   8.060
  529    HB2  ASN  76           2HB      ASN  76   1.733 -36.131   8.760
  530    HB3  ASN  76           1HB      ASN  76   0.801 -37.601   9.027
  531   HD21  ASN  76          1HD2      ASN  76   2.915 -36.775   7.032
  532   HD22  ASN  76          2HD2      ASN  76   2.236 -37.198   5.501
  533    H    LYS  77           H        LYS  77   0.443 -35.113  11.093
  534    HA   LYS  77           HA       LYS  77  -1.808 -35.717  12.672
  535    HB2  LYS  77           2HB      LYS  77  -0.766 -37.639  13.964
  536    HB3  LYS  77           1HB      LYS  77  -1.400 -38.023  12.371
  537    HG2  LYS  77           2HG      LYS  77   0.565 -39.087  12.147
  538    HG3  LYS  77           1HG      LYS  77   1.152 -37.479  11.726
  539    HD2  LYS  77           2HD      LYS  77   2.321 -37.255  13.652
  540    HD3  LYS  77           1HD      LYS  77   1.117 -38.124  14.606
  541    HE2  LYS  77           2HE      LYS  77   3.341 -39.266  14.393
  542    HE3  LYS  77           1HE      LYS  77   1.952 -40.232  13.898
  543    HZ1  LYS  77           3HZ      LYS  77   3.559 -38.688  11.946
  544    HZ2  LYS  77           1HZ      LYS  77   2.488 -39.964  11.649
  545    HZ3  LYS  77           2HZ      LYS  77   3.974 -40.264  12.395
  546    H    GLU  78           H        GLU  78  -1.659 -34.339  14.298
  547    HA   GLU  78           HA       GLU  78   0.746 -34.109  15.869
  548    HB2  GLU  78           2HB      GLU  78  -0.147 -31.915  14.030
  549    HB3  GLU  78           1HB      GLU  78   0.640 -31.516  15.551
  550    HG2  GLU  78           2HG      GLU  78   2.468 -33.159  14.773
  551    HG3  GLU  78           1HG      GLU  78   1.745 -32.959  13.179
  552    H    LEU  79           H        LEU  79  -0.426 -34.684  17.652
  553    HA   LEU  79           HA       LEU  79  -2.570 -32.832  18.467
  554    HB2  LEU  79           2HB      LEU  79  -3.376 -34.731  19.916
  555    HB3  LEU  79           1HB      LEU  79  -3.580 -34.948  18.189
  556    HG   LEU  79           HG       LEU  79  -1.120 -36.079  19.417
  557   HD11  LEU  79          1HD1      LEU  79  -3.519 -37.799  19.551
  558   HD12  LEU  79          2HD1      LEU  79  -3.368 -36.552  20.789
  559   HD13  LEU  79          3HD1      LEU  79  -2.092 -37.752  20.586
  560   HD21  LEU  79          3HD2      LEU  79  -1.129 -36.638  17.221
  561   HD22  LEU  79          1HD2      LEU  79  -2.885 -36.550  17.089
  562   HD23  LEU  79          2HD2      LEU  79  -2.123 -37.971  17.806
  563    H    VAL  80           H        VAL  80   0.257 -32.420  18.903
  564    HA   VAL  80           HA       VAL  80   0.492 -32.794  21.808
  565    HB   VAL  80           HB       VAL  80   2.329 -33.667  20.370
  566   HG11  VAL  80          1HG1      VAL  80   3.894 -32.125  19.321
  567   HG12  VAL  80          2HG1      VAL  80   2.884 -30.760  19.799
  568   HG13  VAL  80          3HG1      VAL  80   2.277 -31.940  18.639
  569   HG21  VAL  80          3HG2      VAL  80   3.948 -33.194  21.919
  570   HG22  VAL  80          1HG2      VAL  80   2.517 -32.658  22.797
  571   HG23  VAL  80          2HG2      VAL  80   3.542 -31.479  21.981
  572    H    LYS  81           H        LYS  81  -1.100 -30.694  20.349
  573    HA   LYS  81           HA       LYS  81  -0.256 -28.459  21.967
  574    HB2  LYS  81           2HB      LYS  81   1.046 -28.349  19.756
  575    HB3  LYS  81           1HB      LYS  81  -0.499 -27.982  19.000
  576    HG2  LYS  81           2HG      LYS  81   0.284 -25.876  19.352
  577    HG3  LYS  81           1HG      LYS  81  -0.597 -26.126  20.860
  578    HD2  LYS  81           2HD      LYS  81   1.641 -26.994  21.784
  579    HD3  LYS  81           1HD      LYS  81   2.363 -26.226  20.367
  580    HE2  LYS  81           2HE      LYS  81   1.998 -24.132  21.148
  581    HE3  LYS  81           1HE      LYS  81   0.473 -24.570  21.914
  582    HZ1  LYS  81           3HZ      LYS  81   3.162 -25.258  22.977
  583    HZ2  LYS  81           1HZ      LYS  81   1.678 -25.568  23.728
  584    HZ3  LYS  81           2HZ      LYS  81   2.204 -23.975  23.523
  585    H    LEU  82           H        LEU  82  -2.265 -28.670  22.966
  586    HA   LEU  82           HA       LEU  82  -4.448 -28.191  23.359
  587    HB2  LEU  82           2HB      LEU  82  -3.635 -26.166  21.815
  588    HB3  LEU  82           1HB      LEU  82  -4.837 -26.851  20.740
  589    HG   LEU  82           HG       LEU  82  -6.422 -26.709  22.793
  590   HD11  LEU  82          1HD1      LEU  82  -5.763 -24.628  24.158
  591   HD12  LEU  82          2HD1      LEU  82  -4.119 -24.987  23.631
  592   HD13  LEU  82          3HD1      LEU  82  -5.022 -26.174  24.571
  593   HD21  LEU  82          3HD2      LEU  82  -6.752 -24.201  22.265
  594   HD22  LEU  82          1HD2      LEU  82  -6.967 -25.380  20.972
  595   HD23  LEU  82          2HD2      LEU  82  -5.474 -24.448  21.075
  596    H    GLU  83           H        GLU  83  -5.610 -30.013  23.345
  597    HA   GLU  83           HA       GLU  83  -6.574 -31.022  20.746
  598    HB2  GLU  83           2HB      GLU  83  -4.935 -32.517  21.965
  599    HB3  GLU  83           1HB      GLU  83  -6.149 -32.692  23.225
  600    HG2  GLU  83           2HG      GLU  83  -7.108 -33.250  20.510
  601    HG3  GLU  83           1HG      GLU  83  -5.868 -34.352  21.104
  602    H    HIS  84           H        HIS  84  -8.725 -31.237  20.496
  603    HA   HIS  84           HA       HIS  84 -10.486 -31.457  22.790
  604    HB2  HIS  84           2HB      HIS  84 -10.265 -28.983  21.148
  605    HB3  HIS  84           1HB      HIS  84 -11.884 -29.512  21.589
  606    HD1  HIS  84           1HD      HIS  84  -8.810 -27.978  22.980
  607    HD2  HIS  84           2HD      HIS  84 -12.438 -29.449  24.373
  608    HE1  HIS  84           1HE      HIS  84  -9.007 -27.149  25.347
  609    HE2  HIS  84           2HE      HIS  84 -11.145 -28.165  26.208
  Start of MODEL   16
    1    H1   MET   1           1HT      MET   1  19.701   0.692   8.338
    2    H2   MET   1           2HT      MET   1  19.631  -0.646   9.411
    3    H3   MET   1           3HT      MET   1  20.934   0.465   9.507
    4    HA   MET   1           HA       MET   1  19.486   0.914  11.266
    5    HB2  MET   1           2HB      MET   1  19.598   2.788   8.945
    6    HB3  MET   1           1HB      MET   1  18.565   3.223  10.297
    7    HG2  MET   1           2HG      MET   1  20.504   4.251  10.902
    8    HG3  MET   1           1HG      MET   1  20.702   2.697  11.711
    9    HE1  MET   1           2HE      MET   1  22.879   4.178   7.962
   10    HE2  MET   1           3HE      MET   1  22.492   5.225   9.328
   11    HE3  MET   1           1HE      MET   1  21.195   4.501   8.378
   12    H    ALA   2           H        ALA   2  17.339   1.767  11.939
   13    HA   ALA   2           HA       ALA   2  15.105   1.092  10.196
   14    HB1  ALA   2           1HB      ALA   2  14.084  -0.456  11.682
   15    HB2  ALA   2           2HB      ALA   2  15.285  -0.149  12.935
   16    HB3  ALA   2           3HB      ALA   2  15.749  -0.991  11.457
   17    H    VAL   3           H        VAL   3  14.433   3.222  10.227
   18    HA   VAL   3           HA       VAL   3  13.276   4.126  12.762
   19    HB   VAL   3           HB       VAL   3  14.015   6.474  12.258
   20   HG11  VAL   3          1HG1      VAL   3  15.178   4.644  13.774
   21   HG12  VAL   3          2HG1      VAL   3  15.884   6.244  13.544
   22   HG13  VAL   3          3HG1      VAL   3  16.490   4.871  12.618
   23   HG21  VAL   3          3HG2      VAL   3  14.722   6.679  10.105
   24   HG22  VAL   3          1HG2      VAL   3  15.397   5.051  10.051
   25   HG23  VAL   3          2HG2      VAL   3  16.281   6.346  10.857
   26    H    PHE   4           H        PHE   4  11.327   3.350  11.704
   27    HA   PHE   4           HA       PHE   4  10.348   5.023   9.495
   28    HB2  PHE   4           2HB      PHE   4   9.725   2.290  10.487
   29    HB3  PHE   4           1HB      PHE   4   8.398   3.201   9.780
   30    HD1  PHE   4           1HD      PHE   4  12.010   3.015   8.854
   31    HD2  PHE   4           2HD      PHE   4   7.973   2.301   7.715
   32    HE1  PHE   4           1HE      PHE   4  12.764   2.362   6.607
   33    HE2  PHE   4           2HE      PHE   4   8.718   1.646   5.466
   34    HZ   PHE   4           HZ       PHE   4  11.117   1.676   4.907
   35    H    HIS   5           H        HIS   5   7.833   5.343   9.639
   36    HA   HIS   5           HA       HIS   5   7.360   6.814  12.103
   37    HB2  HIS   5           2HB      HIS   5   6.800   7.447   9.538
   38    HB3  HIS   5           1HB      HIS   5   5.263   6.732  10.007
   39    HD1  HIS   5           1HD      HIS   5   7.650   9.377  11.358
   40    HD2  HIS   5           2HD      HIS   5   3.588   8.520  11.150
   41    HE1  HIS   5           1HE      HIS   5   6.491  11.361  12.379
   42    HE2  HIS   5           2HE      HIS   5   4.036  10.798  12.289
   43    H    ASP   6           H        ASP   6   5.393   4.572  10.122
   44    HA   ASP   6           HA       ASP   6   4.645   3.026  12.433
   45    HB2  ASP   6           2HB      ASP   6   2.795   5.055  11.272
   46    HB3  ASP   6           1HB      ASP   6   2.108   3.496  11.714
   47    H    GLU   7           H        GLU   7   3.413   1.117  11.887
   48    HA   GLU   7           HA       GLU   7   3.736   0.358   9.063
   49    HB2  GLU   7           2HB      GLU   7   3.264  -1.483  11.415
   50    HB3  GLU   7           1HB      GLU   7   3.748  -1.939   9.788
   51    HG2  GLU   7           2HG      GLU   7   5.805  -1.998  10.641
   52    HG3  GLU   7           1HG      GLU   7   5.752  -0.245  10.474
   53    H    VAL   8           H        VAL   8   2.023  -0.212   7.819
   54    HA   VAL   8           HA       VAL   8  -0.592  -0.561   9.120
   55    HB   VAL   8           HB       VAL   8  -0.219   1.089   6.617
   56   HG11  VAL   8          1HG1      VAL   8  -2.460   1.305   6.529
   57   HG12  VAL   8          2HG1      VAL   8  -2.634   1.341   8.283
   58   HG13  VAL   8          3HG1      VAL   8  -2.442  -0.199   7.447
   59   HG21  VAL   8          3HG2      VAL   8   0.796   2.290   8.456
   60   HG22  VAL   8          1HG2      VAL   8  -0.627   2.015   9.461
   61   HG23  VAL   8          2HG2      VAL   8  -0.740   3.046   8.036
   62    H    GLU   9           H        GLU   9  -1.920  -2.058   8.200
   63    HA   GLU   9           HA       GLU   9  -0.773  -4.009   6.496
   64    HB2  GLU   9           2HB      GLU   9  -3.632  -3.583   7.383
   65    HB3  GLU   9           1HB      GLU   9  -3.088  -4.980   6.463
   66    HG2  GLU   9           2HG      GLU   9  -1.787  -5.785   8.239
   67    HG3  GLU   9           1HG      GLU   9  -1.856  -4.246   9.096
   68    H    ILE  10           H        ILE  10  -1.042  -4.440   4.360
   69    HA   ILE  10           HA       ILE  10  -1.477  -2.354   2.569
   70    HB   ILE  10           HB       ILE  10  -0.194  -4.398   2.043
   71   HG12  ILE  10          2HG1      ILE  10  -1.623  -4.726  -0.268
   72   HG13  ILE  10          1HG1      ILE  10  -2.215  -3.168   0.296
   73   HG21  ILE  10          1HG2      ILE  10  -2.917  -5.681   1.911
   74   HG22  ILE  10          2HG2      ILE  10  -1.569  -6.117   2.960
   75   HG23  ILE  10          3HG2      ILE  10  -1.458  -6.391   1.222
   76   HD11  ILE  10          3HD1      ILE  10   0.716  -3.707   0.174
   77   HD12  ILE  10          1HD1      ILE  10  -0.145  -2.169   0.112
   78   HD13  ILE  10          2HD1      ILE  10  -0.182  -3.255  -1.276
   79    H    GLU  11           H        GLU  11  -3.758  -4.624   3.960
   80    HA   GLU  11           HA       GLU  11  -5.872  -4.360   2.140
   81    HB2  GLU  11           2HB      GLU  11  -5.665  -5.083   5.030
   82    HB3  GLU  11           1HB      GLU  11  -7.256  -4.744   4.366
   83    HG2  GLU  11           2HG      GLU  11  -5.657  -6.567   2.736
   84    HG3  GLU  11           1HG      GLU  11  -6.022  -7.170   4.352
   85    H    ASP  12           H        ASP  12  -4.778  -2.271   4.744
   86    HA   ASP  12           HA       ASP  12  -7.078  -0.589   4.800
   87    HB2  ASP  12           2HB      ASP  12  -4.983  -0.907   6.465
   88    HB3  ASP  12           1HB      ASP  12  -4.452   0.535   5.603
   89    H    PHE  13           H        PHE  13  -4.159  -0.674   2.875
   90    HA   PHE  13           HA       PHE  13  -4.231   1.974   1.876
   91    HB2  PHE  13           2HB      PHE  13  -2.949  -0.586   0.964
   92    HB3  PHE  13           1HB      PHE  13  -2.917   0.831  -0.077
   93    HD1  PHE  13           2HD      PHE  13  -2.259   0.021   3.518
   94    HD2  PHE  13           1HD      PHE  13  -1.026   2.102   0.016
   95    HE1  PHE  13           2HE      PHE  13  -0.274   0.850   4.712
   96    HE2  PHE  13           1HE      PHE  13   0.962   2.931   1.201
   97    HZ   PHE  13           HZ       PHE  13   1.340   2.306   3.553
   98    H    GLN  14           H        GLN  14  -4.472   2.347  -0.595
   99    HA   GLN  14           HA       GLN  14  -7.058   1.204  -1.414
  100    HB2  GLN  14           2HB      GLN  14  -6.412   3.829  -1.120
  101    HB3  GLN  14           1HB      GLN  14  -6.042   3.595  -2.822
  102    HG2  GLN  14           2HG      GLN  14  -8.194   3.497  -3.398
  103    HG3  GLN  14           1HG      GLN  14  -8.610   2.460  -2.035
  104   HE21  GLN  14          1HE2      GLN  14  -8.356   3.750   0.149
  105   HE22  GLN  14          2HE2      GLN  14  -9.178   5.269   0.167
  106    H    TYR  15           H        TYR  15  -6.816  -0.417  -2.827
  107    HA   TYR  15           HA       TYR  15  -4.512  -0.776  -4.437
  108    HB2  TYR  15           2HB      TYR  15  -5.908  -2.673  -3.748
  109    HB3  TYR  15           1HB      TYR  15  -7.251  -2.046  -4.698
  110    HD1  TYR  15           1HD      TYR  15  -3.735  -3.237  -5.038
  111    HD2  TYR  15           2HD      TYR  15  -7.515  -2.724  -6.918
  112    HE1  TYR  15           1HE      TYR  15  -2.926  -4.495  -6.986
  113    HE2  TYR  15           2HE      TYR  15  -6.719  -3.983  -8.874
  114    HH   TYR  15           HH       TYR  15  -4.095  -5.916  -8.875
  115    H    ASP  16           H        ASP  16  -3.973   0.485  -6.075
  116    HA   ASP  16           HA       ASP  16  -6.042   1.815  -7.644
  117    HB2  ASP  16           2HB      ASP  16  -3.813   2.865  -6.668
  118    HB3  ASP  16           1HB      ASP  16  -3.120   2.222  -8.152
  119    H    GLU  17           H        GLU  17  -6.821   0.043  -8.827
  120    HA   GLU  17           HA       GLU  17  -5.314  -1.808 -10.262
  121    HB2  GLU  17           2HB      GLU  17  -7.379  -1.923 -11.781
  122    HB3  GLU  17           1HB      GLU  17  -7.591  -2.313 -10.080
  123    HG2  GLU  17           2HG      GLU  17  -8.780  -0.389  -9.647
  124    HG3  GLU  17           1HG      GLU  17  -8.085   0.476 -11.018
  125    H    ASP  18           H        ASP  18  -6.075   1.512 -11.014
  126    HA   ASP  18           HA       ASP  18  -5.785   1.689 -13.725
  127    HB2  ASP  18           2HB      ASP  18  -6.021   3.515 -11.760
  128    HB3  ASP  18           1HB      ASP  18  -4.322   3.746 -12.156
  129    H    SER  19           H        SER  19  -3.155   1.530 -11.329
  130    HA   SER  19           HA       SER  19  -1.366   0.611 -13.449
  131    HB2  SER  19           2HB      SER  19  -0.848   3.010 -11.693
  132    HB3  SER  19           1HB      SER  19   0.445   2.149 -12.525
  133    HG   SER  19           HG       SER  19  -1.531   3.809 -13.541
  134    H    GLU  20           H        GLU  20  -2.683  -0.635 -11.093
  135    HA   GLU  20           HA       GLU  20  -2.238  -1.971  -9.299
  136    HB2  GLU  20           2HB      GLU  20   0.385  -2.513 -10.684
  137    HB3  GLU  20           1HB      GLU  20  -0.553  -3.607  -9.678
  138    HG2  GLU  20           2HG      GLU  20  -1.124  -4.434 -11.701
  139    HG3  GLU  20           1HG      GLU  20  -2.362  -3.185 -11.578
  140    H    THR  21           H        THR  21  -1.923   0.284  -8.201
  141    HA   THR  21           HA       THR  21   0.592   0.125  -6.695
  142    HB   THR  21           HB       THR  21  -0.572   2.736  -7.697
  143    HG1  THR  21           1HG      THR  21   0.323   1.744  -9.450
  144   HG21  THR  21          3HG2      THR  21   1.330   3.820  -6.882
  145   HG22  THR  21          1HG2      THR  21   2.179   2.301  -6.591
  146   HG23  THR  21          2HG2      THR  21   0.816   2.760  -5.570
  147    H    TYR  22           H        TYR  22   0.478   0.967  -4.539
  148    HA   TYR  22           HA       TYR  22  -2.288   1.251  -3.551
  149    HB2  TYR  22           2HB      TYR  22   0.128   0.224  -2.044
  150    HB3  TYR  22           1HB      TYR  22  -1.507   0.353  -1.408
  151    HD1  TYR  22           1HD      TYR  22   0.456  -1.307  -4.108
  152    HD2  TYR  22           2HD      TYR  22  -2.967  -1.455  -1.584
  153    HE1  TYR  22           1HE      TYR  22  -0.020  -3.580  -4.901
  154    HE2  TYR  22           2HE      TYR  22  -3.453  -3.733  -2.372
  155    HH   TYR  22           HH       TYR  22  -1.678  -5.705  -3.499
  156    H    PHE  23           H        PHE  23  -2.815   2.943  -2.225
  157    HA   PHE  23           HA       PHE  23  -0.664   4.847  -1.563
  158    HB2  PHE  23           2HB      PHE  23  -3.422   5.591  -2.565
  159    HB3  PHE  23           1HB      PHE  23  -2.136   6.711  -2.132
  160    HD1  PHE  23           1HD      PHE  23  -2.865   3.888  -4.453
  161    HD2  PHE  23           2HD      PHE  23  -0.716   7.500  -3.778
  162    HE1  PHE  23           1HE      PHE  23  -2.033   3.820  -6.764
  163    HE2  PHE  23           2HE      PHE  23   0.119   7.438  -6.091
  164    HZ   PHE  23           HZ       PHE  23  -0.539   5.595  -7.587
  165    H    TYR  24           H        TYR  24  -1.042   6.213   0.265
  166    HA   TYR  24           HA       TYR  24  -3.227   5.371   2.044
  167    HB2  TYR  24           2HB      TYR  24  -0.839   4.343   2.494
  168    HB3  TYR  24           1HB      TYR  24  -0.531   5.915   3.222
  169    HD1  TYR  24           1HD      TYR  24  -3.250   3.337   3.266
  170    HD2  TYR  24           2HD      TYR  24  -0.829   6.032   5.500
  171    HE1  TYR  24           1HE      TYR  24  -4.331   2.581   5.338
  172    HE2  TYR  24           2HE      TYR  24  -1.903   5.281   7.578
  173    HH   TYR  24           HH       TYR  24  -4.205   4.216   8.181
  174    HA   PRO  25           HA       PRO  25  -3.732   9.761   2.469
  175    HB2  PRO  25           2HB      PRO  25  -5.320   9.800   4.670
  176    HB3  PRO  25           1HB      PRO  25  -5.903   9.343   3.065
  177    HG2  PRO  25           2HG      PRO  25  -5.082   7.594   5.353
  178    HG3  PRO  25           1HG      PRO  25  -6.470   7.432   4.262
  179    HD2  PRO  25           2HD      PRO  25  -4.206   5.978   3.965
  180    HD3  PRO  25           1HD      PRO  25  -5.204   6.483   2.587
  181    H    CYS  26           H        CYS  26  -2.336  11.200   3.251
  182    HA   CYS  26           HA       CYS  26  -0.937  10.616   5.756
  183    HB2  CYS  26           2HB      CYS  26   0.015  11.467   3.322
  184    HB3  CYS  26           1HB      CYS  26  -0.070  12.971   4.235
  185    HA   PRO  27           HA       PRO  27  -3.232  13.661   7.996
  186    HB2  PRO  27           2HB      PRO  27  -1.351  14.347   9.859
  187    HB3  PRO  27           1HB      PRO  27  -2.313  12.867   9.930
  188    HG2  PRO  27           2HG      PRO  27   0.486  13.260   8.951
  189    HG3  PRO  27           1HG      PRO  27  -0.181  11.948   9.941
  190    HD2  PRO  27           2HD      PRO  27   0.272  11.657   7.302
  191    HD3  PRO  27           1HD      PRO  27  -1.094  10.865   8.116
  192    H    CYS  28           H        CYS  28  -0.200  14.410   6.455
  193    HA   CYS  28           HA       CYS  28  -0.243  17.208   7.072
  194    HB2  CYS  28           2HB      CYS  28   1.613  17.394   5.510
  195    HB3  CYS  28           1HB      CYS  28   1.856  16.015   6.575
  196    H    GLY  29           H        GLY  29  -1.219  15.228   4.280
  197    HA2  GLY  29           2HA      GLY  29  -3.355  16.670   3.441
  198    HA3  GLY  29           1HA      GLY  29  -2.006  17.540   2.734
  199    H    ASP  30           H        ASP  30  -0.323  15.728   1.813
  200    HA   ASP  30           HA       ASP  30  -1.726  14.598  -0.419
  201    HB2  ASP  30           2HB      ASP  30   0.911  15.414   0.133
  202    HB3  ASP  30           1HB      ASP  30   1.008  13.693  -0.217
  203    H    ASN  31           H        ASN  31  -0.658  12.239  -1.061
  204    HA   ASN  31           HA       ASN  31  -1.124  10.483   1.252
  205    HB2  ASN  31           2HB      ASN  31  -2.153   9.912  -1.531
  206    HB3  ASN  31           1HB      ASN  31  -2.479   8.998  -0.064
  207   HD21  ASN  31          1HD2      ASN  31  -3.932  10.905  -2.162
  208   HD22  ASN  31          2HD2      ASN  31  -5.052  11.732  -1.140
  209    H    PHE  32           H        PHE  32   0.029   8.592   1.343
  210    HA   PHE  32           HA       PHE  32   2.556   8.522   0.058
  211    HB2  PHE  32           2HB      PHE  32   1.054   6.470   1.696
  212    HB3  PHE  32           1HB      PHE  32   2.685   6.208   1.097
  213    HD1  PHE  32           2HD      PHE  32   4.443   8.010   1.769
  214    HD2  PHE  32           1HD      PHE  32   0.740   7.414   3.778
  215    HE1  PHE  32           2HE      PHE  32   5.359   9.094   3.775
  216    HE2  PHE  32           1HE      PHE  32   1.653   8.495   5.790
  217    HZ   PHE  32           HZ       PHE  32   3.967   9.335   5.790
  218    H    SER  33           H        SER  33   3.340   6.470  -1.106
  219    HA   SER  33           HA       SER  33   1.336   5.121  -2.707
  220    HB2  SER  33           2HB      SER  33   2.607   5.778  -4.851
  221    HB3  SER  33           1HB      SER  33   1.527   6.977  -4.143
  222    HG   SER  33           HG       SER  33   3.178   8.226  -3.796
  223    H    ILE  34           H        ILE  34   1.977   3.156  -3.440
  224    HA   ILE  34           HA       ILE  34   4.784   2.422  -3.539
  225    HB   ILE  34           HB       ILE  34   4.262   2.015  -1.182
  226   HG12  ILE  34          2HG1      ILE  34   4.314  -0.713  -2.429
  227   HG13  ILE  34          1HG1      ILE  34   5.653   0.397  -2.705
  228   HG21  ILE  34          1HG2      ILE  34   2.357  -0.167  -1.781
  229   HG22  ILE  34          2HG2      ILE  34   1.750   1.482  -1.927
  230   HG23  ILE  34          3HG2      ILE  34   2.434   0.927  -0.400
  231   HD11  ILE  34          3HD1      ILE  34   4.836   0.100   0.096
  232   HD12  ILE  34          1HD1      ILE  34   6.445   0.156  -0.625
  233   HD13  ILE  34          2HD1      ILE  34   5.516  -1.342  -0.658
  234    H    THR  35           H        THR  35   5.064   1.195  -5.301
  235    HA   THR  35           HA       THR  35   2.839   0.208  -6.795
  236    HB   THR  35           HB       THR  35   4.495  -0.625  -8.376
  237    HG1  THR  35           1HG      THR  35   6.497   0.154  -6.529
  238   HG21  THR  35          3HG2      THR  35   4.053   1.830  -8.323
  239   HG22  THR  35          1HG2      THR  35   5.623   1.371  -8.980
  240   HG23  THR  35          2HG2      THR  35   5.508   2.007  -7.340
  241    H    LYS  36           H        LYS  36   2.357  -1.953  -7.371
  242    HA   LYS  36           HA       LYS  36   2.316  -3.787  -5.246
  243    HB2  LYS  36           2HB      LYS  36   0.684  -3.814  -7.087
  244    HB3  LYS  36           1HB      LYS  36   1.948  -4.310  -8.204
  245    HG2  LYS  36           2HG      LYS  36   1.068  -6.345  -7.783
  246    HG3  LYS  36           1HG      LYS  36   2.191  -6.279  -6.424
  247    HD2  LYS  36           2HD      LYS  36   0.419  -5.521  -4.957
  248    HD3  LYS  36           1HD      LYS  36  -0.712  -5.464  -6.310
  249    HE2  LYS  36           2HE      LYS  36   0.693  -7.968  -5.395
  250    HE3  LYS  36           1HE      LYS  36  -0.912  -7.489  -4.846
  251    HZ1  LYS  36           3HZ      LYS  36  -1.313  -8.934  -6.606
  252    HZ2  LYS  36           1HZ      LYS  36  -0.061  -8.303  -7.555
  253    HZ3  LYS  36           2HZ      LYS  36  -1.476  -7.410  -7.321
  254    H    GLU  37           H        GLU  37   4.475  -3.484  -8.024
  255    HA   GLU  37           HA       GLU  37   5.864  -5.902  -7.743
  256    HB2  GLU  37           2HB      GLU  37   5.921  -4.097  -9.633
  257    HB3  GLU  37           1HB      GLU  37   7.230  -3.405  -8.687
  258    HG2  GLU  37           2HG      GLU  37   8.489  -5.465  -8.867
  259    HG3  GLU  37           1HG      GLU  37   7.160  -6.225  -9.741
  260    H    ASP  38           H        ASP  38   6.349  -2.748  -6.210
  261    HA   ASP  38           HA       ASP  38   8.843  -3.187  -5.034
  262    HB2  ASP  38           2HB      ASP  38   6.500  -1.444  -4.379
  263    HB3  ASP  38           1HB      ASP  38   7.771  -1.618  -3.174
  264    H    LEU  39           H        LEU  39   5.592  -3.854  -3.767
  265    HA   LEU  39           HA       LEU  39   6.397  -4.892  -1.283
  266    HB2  LEU  39           2HB      LEU  39   3.951  -5.695  -2.852
  267    HB3  LEU  39           1HB      LEU  39   4.179  -5.826  -1.118
  268    HG   LEU  39           HG       LEU  39   4.300  -3.133  -2.421
  269   HD11  LEU  39          1HD1      LEU  39   1.783  -4.599  -1.653
  270   HD12  LEU  39          2HD1      LEU  39   2.263  -4.117  -3.280
  271   HD13  LEU  39          3HD1      LEU  39   1.886  -2.889  -2.071
  272   HD21  LEU  39          3HD2      LEU  39   4.905  -3.615   0.006
  273   HD22  LEU  39          1HD2      LEU  39   3.186  -3.917   0.257
  274   HD23  LEU  39          2HD2      LEU  39   3.732  -2.331  -0.289
  275    H    GLU  40           H        GLU  40   5.697  -6.526  -4.368
  276    HA   GLU  40           HA       GLU  40   6.101  -9.156  -3.488
  277    HB2  GLU  40           2HB      GLU  40   6.568  -7.973  -6.227
  278    HB3  GLU  40           1HB      GLU  40   6.497  -9.694  -5.875
  279    HG2  GLU  40           2HG      GLU  40   4.208  -9.599  -5.349
  280    HG3  GLU  40           1HG      GLU  40   4.222  -7.839  -5.252
  281    H    ASN  41           H        ASN  41   8.408  -6.659  -4.295
  282    HA   ASN  41           HA       ASN  41  10.627  -8.536  -4.433
  283    HB2  ASN  41           2HB      ASN  41  10.241  -5.646  -5.012
  284    HB3  ASN  41           1HB      ASN  41  11.852  -6.152  -4.515
  285   HD21  ASN  41          1HD2      ASN  41   9.252  -7.160  -6.712
  286   HD22  ASN  41          2HD2      ASN  41  10.297  -7.590  -8.019
  287    H    GLY  42           H        GLY  42   9.389  -6.038  -2.255
  288    HA2  GLY  42           2HA      GLY  42   9.901  -6.811   0.159
  289    HA3  GLY  42           1HA      GLY  42  11.568  -6.617  -0.362
  290    H    GLU  43           H        GLU  43  10.009  -4.268  -2.018
  291    HA   GLU  43           HA       GLU  43  10.892  -2.198  -0.245
  292    HB2  GLU  43           2HB      GLU  43   9.614  -2.262  -2.962
  293    HB3  GLU  43           1HB      GLU  43   9.709  -0.750  -2.071
  294    HG2  GLU  43           2HG      GLU  43  12.019  -2.487  -2.899
  295    HG3  GLU  43           1HG      GLU  43  11.552  -0.940  -3.608
  296    H    ASP  44           H        ASP  44   9.548  -2.743   1.556
  297    HA   ASP  44           HA       ASP  44   6.675  -2.304   1.320
  298    HB2  ASP  44           2HB      ASP  44   8.212  -2.917   3.848
  299    HB3  ASP  44           1HB      ASP  44   6.501  -3.162   3.537
  300    H    VAL  45           H        VAL  45   8.397  -0.013   0.846
  301    HA   VAL  45           HA       VAL  45   7.667   1.680   3.150
  302    HB   VAL  45           HB       VAL  45  10.104   1.396   3.038
  303   HG11  VAL  45          1HG1      VAL  45  10.254   2.941   0.495
  304   HG12  VAL  45          2HG1      VAL  45   9.965   1.203   0.422
  305   HG13  VAL  45          3HG1      VAL  45  11.417   1.823   1.208
  306   HG21  VAL  45          3HG2      VAL  45  10.475   4.040   2.430
  307   HG22  VAL  45          1HG2      VAL  45   9.935   3.421   3.990
  308   HG23  VAL  45          2HG2      VAL  45   8.755   3.985   2.807
  309    H    ALA  46           H        ALA  46   6.484   3.461   2.758
  310    HA   ALA  46           HA       ALA  46   6.063   4.245  -0.056
  311    HB1  ALA  46           1HB      ALA  46   3.841   4.419   0.275
  312    HB2  ALA  46           2HB      ALA  46   4.022   5.024   1.920
  313    HB3  ALA  46           3HB      ALA  46   4.155   3.295   1.596
  314    H    THR  47           H        THR  47   6.572   6.272  -0.625
  315    HA   THR  47           HA       THR  47   7.255   8.175   1.513
  316    HB   THR  47           HB       THR  47   8.115   8.410  -1.366
  317    HG1  THR  47           1HG      THR  47   9.851   7.173  -0.950
  318   HG21  THR  47          3HG2      THR  47  10.134   9.251   0.353
  319   HG22  THR  47          1HG2      THR  47   8.644   9.907   1.029
  320   HG23  THR  47          2HG2      THR  47   9.083  10.259  -0.643
  321    H    CYS  48           H        CYS  48   6.182  10.050   1.710
  322    HA   CYS  48           HA       CYS  48   3.915  10.532  -0.036
  323    HB2  CYS  48           2HB      CYS  48   3.615  10.724   2.388
  324    HB3  CYS  48           1HB      CYS  48   4.839  11.987   2.454
  325    HA   PRO  49           HA       PRO  49   6.136  13.608  -2.364
  326    HB2  PRO  49           2HB      PRO  49   4.131  14.390  -3.977
  327    HB3  PRO  49           1HB      PRO  49   4.897  12.807  -4.131
  328    HG2  PRO  49           2HG      PRO  49   2.271  13.534  -2.934
  329    HG3  PRO  49           1HG      PRO  49   2.731  12.084  -3.841
  330    HD2  PRO  49           2HD      PRO  49   2.523  12.278  -1.066
  331    HD3  PRO  49           1HD      PRO  49   3.366  10.996  -1.955
  332    H    SER  50           H        SER  50   5.226  14.481   0.231
  333    HA   SER  50           HA       SER  50   4.905  17.300  -0.353
  334    HB2  SER  50           2HB      SER  50   2.736  15.644   0.722
  335    HB3  SER  50           1HB      SER  50   3.108  17.045   1.731
  336    HG   SER  50           HG       SER  50   1.562  17.193  -0.207
  337    H    CYS  51           H        CYS  51   4.774  15.006   2.391
  338    HA   CYS  51           HA       CYS  51   6.499  16.788   3.929
  339    HB2  CYS  51           2HB      CYS  51   5.960  15.401   5.840
  340    HB3  CYS  51           1HB      CYS  51   4.480  15.839   4.992
  341    H    SER  52           H        SER  52   6.725  13.873   2.091
  342    HA   SER  52           HA       SER  52   8.477  12.529   1.557
  343    HB2  SER  52           2HB      SER  52  10.284  14.334   3.167
  344    HB3  SER  52           1HB      SER  52  10.709  13.315   1.792
  345    HG   SER  52           HG       SER  52   9.453  15.808   1.853
  346    H    LEU  53           H        LEU  53   6.888  11.945   3.818
  347    HA   LEU  53           HA       LEU  53   8.677  10.986   5.898
  348    HB2  LEU  53           2HB      LEU  53   6.462  12.037   6.392
  349    HB3  LEU  53           1HB      LEU  53   5.686  10.662   5.633
  350    HG   LEU  53           HG       LEU  53   6.659   9.181   7.356
  351   HD11  LEU  53          1HD1      LEU  53   8.546  10.025   8.272
  352   HD12  LEU  53          2HD1      LEU  53   7.407  10.687   9.445
  353   HD13  LEU  53          3HD1      LEU  53   8.001  11.696   8.127
  354   HD21  LEU  53          3HD2      LEU  53   4.789  11.395   7.928
  355   HD22  LEU  53          1HD2      LEU  53   5.384  10.485   9.315
  356   HD23  LEU  53          2HD2      LEU  53   4.545   9.651   8.007
  357    H    ILE  54           H        ILE  54   8.541   8.721   6.643
  358    HA   ILE  54           HA       ILE  54   8.159   6.878   4.374
  359    HB   ILE  54           HB       ILE  54   9.831   5.403   5.471
  360   HG12  ILE  54          2HG1      ILE  54  10.241   7.782   7.301
  361   HG13  ILE  54          1HG1      ILE  54   9.595   6.214   7.773
  362   HG21  ILE  54          1HG2      ILE  54  11.696   6.497   4.597
  363   HG22  ILE  54          2HG2      ILE  54  11.085   8.092   5.033
  364   HG23  ILE  54          3HG2      ILE  54  10.344   7.197   3.706
  365   HD11  ILE  54          3HD1      ILE  54  12.139   6.907   8.120
  366   HD12  ILE  54          1HD1      ILE  54  12.259   6.222   6.500
  367   HD13  ILE  54          2HD1      ILE  54  11.631   5.244   7.826
  368    H    ILE  55           H        ILE  55   7.082   4.950   4.706
  369    HA   ILE  55           HA       ILE  55   6.094   4.330   7.387
  370    HB   ILE  55           HB       ILE  55   3.787   3.978   6.556
  371   HG12  ILE  55          2HG1      ILE  55   4.528   5.631   4.147
  372   HG13  ILE  55          1HG1      ILE  55   4.576   3.871   4.102
  373   HG21  ILE  55          1HG2      ILE  55   4.673   6.825   6.137
  374   HG22  ILE  55          2HG2      ILE  55   4.525   6.064   7.722
  375   HG23  ILE  55          3HG2      ILE  55   3.101   6.253   6.699
  376   HD11  ILE  55          3HD1      ILE  55   2.263   3.694   4.406
  377   HD12  ILE  55          1HD1      ILE  55   2.476   5.006   3.248
  378   HD13  ILE  55          2HD1      ILE  55   2.119   5.370   4.935
  379    H    LYS  56           H        LYS  56   5.541   2.150   7.703
  380    HA   LYS  56           HA       LYS  56   6.649   0.358   5.681
  381    HB2  LYS  56           2HB      LYS  56   7.426   0.143   8.020
  382    HB3  LYS  56           1HB      LYS  56   5.784  -0.239   8.517
  383    HG2  LYS  56           2HG      LYS  56   6.994  -2.279   8.367
  384    HG3  LYS  56           1HG      LYS  56   5.865  -2.228   7.013
  385    HD2  LYS  56           2HD      LYS  56   7.712  -2.849   5.851
  386    HD3  LYS  56           1HD      LYS  56   7.996  -1.107   5.841
  387    HE2  LYS  56           2HE      LYS  56   9.300  -1.476   8.001
  388    HE3  LYS  56           1HE      LYS  56   9.241  -3.195   7.609
  389    HZ1  LYS  56           3HZ      LYS  56  11.277  -1.954   6.856
  390    HZ2  LYS  56           1HZ      LYS  56  10.296  -1.165   5.724
  391    HZ3  LYS  56           2HZ      LYS  56  10.482  -2.844   5.657
  392    H    VAL  57           H        VAL  57   5.569  -1.077   4.552
  393    HA   VAL  57           HA       VAL  57   2.653  -1.123   4.888
  394    HB   VAL  57           HB       VAL  57   3.840  -2.164   2.378
  395   HG11  VAL  57          1HG1      VAL  57   1.917  -0.894   1.447
  396   HG12  VAL  57          2HG1      VAL  57   1.518  -0.390   3.089
  397   HG13  VAL  57          3HG1      VAL  57   1.457  -2.097   2.652
  398   HG21  VAL  57          3HG2      VAL  57   4.277   0.610   3.323
  399   HG22  VAL  57          1HG2      VAL  57   3.711   0.420   1.664
  400   HG23  VAL  57          2HG2      VAL  57   5.204  -0.360   2.180
  401    H    ILE  58           H        ILE  58   1.930  -2.875   5.896
  402    HA   ILE  58           HA       ILE  58   3.445  -5.365   5.781
  403    HB   ILE  58           HB       ILE  58   0.920  -4.832   7.346
  404   HG12  ILE  58          2HG1      ILE  58   2.684  -3.219   7.972
  405   HG13  ILE  58          1HG1      ILE  58   2.343  -4.355   9.272
  406   HG21  ILE  58          1HG2      ILE  58   3.007  -6.990   7.403
  407   HG22  ILE  58          2HG2      ILE  58   1.259  -7.147   7.224
  408   HG23  ILE  58          3HG2      ILE  58   1.948  -6.681   8.779
  409   HD11  ILE  58          3HD1      ILE  58   4.823  -3.739   8.094
  410   HD12  ILE  58          1HD1      ILE  58   4.445  -5.408   7.664
  411   HD13  ILE  58          2HD1      ILE  58   4.476  -4.918   9.358
  412    H    TYR  59           H        TYR  59   2.811  -7.167   4.727
  413    HA   TYR  59           HA       TYR  59   0.098  -7.423   3.707
  414    HB2  TYR  59           2HB      TYR  59   0.929  -7.812   1.376
  415    HB3  TYR  59           1HB      TYR  59   1.130  -6.153   1.929
  416    HD1  TYR  59           2HD      TYR  59   2.943  -9.360   1.492
  417    HD2  TYR  59           1HD      TYR  59   3.254  -5.136   1.899
  418    HE1  TYR  59           2HE      TYR  59   5.338  -9.495   0.973
  419    HE2  TYR  59           1HE      TYR  59   5.654  -5.245   1.380
  420    HH   TYR  59           HH       TYR  59   7.142  -7.175  -0.050
  421    H    ASP  60           H        ASP  60   0.152  -9.557   2.180
  422    HA   ASP  60           HA       ASP  60   1.228 -11.638   3.912
  423    HB2  ASP  60           2HB      ASP  60  -1.173 -11.510   2.820
  424    HB3  ASP  60           1HB      ASP  60  -0.356 -12.235   1.440
  425    H    LYS  61           H        LYS  61   3.374 -11.916   3.515
  426    HA   LYS  61           HA       LYS  61   4.627 -11.693   1.009
  427    HB2  LYS  61           2HB      LYS  61   5.426 -13.045   3.572
  428    HB3  LYS  61           1HB      LYS  61   6.440 -13.142   2.140
  429    HG2  LYS  61           2HG      LYS  61   5.575 -10.430   2.879
  430    HG3  LYS  61           1HG      LYS  61   6.645 -11.230   4.033
  431    HD2  LYS  61           2HD      LYS  61   7.899 -11.803   1.698
  432    HD3  LYS  61           1HD      LYS  61   7.195 -10.230   1.314
  433    HE2  LYS  61           2HE      LYS  61   8.178  -9.465   3.556
  434    HE3  LYS  61           1HE      LYS  61   9.143 -10.939   3.486
  435    HZ1  LYS  61           3HZ      LYS  61  10.461  -9.278   2.532
  436    HZ2  LYS  61           1HZ      LYS  61   9.183  -8.634   1.630
  437    HZ3  LYS  61           2HZ      LYS  61   9.849 -10.131   1.206
  438    H    ASP  62           H        ASP  62   2.990 -14.380   2.557
  439    HA   ASP  62           HA       ASP  62   3.979 -16.450   0.903
  440    HB2  ASP  62           2HB      ASP  62   2.462 -16.435   3.124
  441    HB3  ASP  62           1HB      ASP  62   1.192 -16.642   1.923
  442    H    GLN  63           H        GLN  63   1.343 -14.149   0.561
  443    HA   GLN  63           HA       GLN  63   0.328 -15.406  -1.845
  444    HB2  GLN  63           2HB      GLN  63  -0.413 -12.841  -0.429
  445    HB3  GLN  63           1HB      GLN  63  -1.217 -13.434  -1.874
  446    HG2  GLN  63           2HG      GLN  63  -1.042 -15.332   0.373
  447    HG3  GLN  63           1HG      GLN  63  -2.062 -13.917   0.628
  448   HE21  GLN  63          1HE2      GLN  63  -4.090 -14.568   0.379
  449   HE22  GLN  63          2HE2      GLN  63  -4.694 -15.495  -0.947
  450    H    PHE  64           H        PHE  64   2.007 -12.383  -0.988
  451    HA   PHE  64           HA       PHE  64   2.139 -11.353  -3.615
  452    HB2  PHE  64           2HB      PHE  64   3.565 -10.757  -1.052
  453    HB3  PHE  64           1HB      PHE  64   4.179 -10.068  -2.550
  454    HD1  PHE  64           1HD      PHE  64   0.994 -10.410  -0.637
  455    HD2  PHE  64           2HD      PHE  64   3.359  -8.036  -3.261
  456    HE1  PHE  64           1HE      PHE  64  -0.658  -8.597  -0.478
  457    HE2  PHE  64           2HE      PHE  64   1.711  -6.218  -3.107
  458    HZ   PHE  64           HZ       PHE  64  -0.301  -6.496  -1.713
  459    H    VAL  65           H        VAL  65   4.614 -13.067  -1.679
  460    HA   VAL  65           HA       VAL  65   6.434 -13.181  -3.905
  461    HB   VAL  65           HB       VAL  65   6.606 -14.727  -1.313
  462   HG11  VAL  65          1HG1      VAL  65   8.745 -15.273  -1.859
  463   HG12  VAL  65          2HG1      VAL  65   8.998 -13.810  -2.808
  464   HG13  VAL  65          3HG1      VAL  65   8.084 -15.157  -3.490
  465   HG21  VAL  65          3HG2      VAL  65   7.312 -11.900  -1.983
  466   HG22  VAL  65          1HG2      VAL  65   8.253 -12.785  -0.782
  467   HG23  VAL  65          2HG2      VAL  65   6.522 -12.547  -0.546
  468    H    SER  66           H        SER  66   4.954 -14.196  -5.410
  469    HA   SER  66           HA       SER  66   5.456 -16.958  -5.708
  470    HB2  SER  66           2HB      SER  66   3.485 -16.698  -3.930
  471    HB3  SER  66           1HB      SER  66   2.519 -16.530  -5.396
  472    HG   SER  66           HG       SER  66   2.591 -18.686  -4.937
  473    H    GLY  67           H        GLY  67   6.104 -16.362  -7.760
  474    HA2  GLY  67           2HA      GLY  67   4.779 -16.686  -9.969
  475    HA3  GLY  67           1HA      GLY  67   4.096 -15.129  -9.519
  476    H    GLU  68           H        GLU  68   5.975 -13.521  -8.824
  477    HA   GLU  68           HA       GLU  68   7.769 -13.433 -11.137
  478    HB2  GLU  68           2HB      GLU  68   6.854 -11.325  -9.179
  479    HB3  GLU  68           1HB      GLU  68   8.120 -11.036 -10.365
  480    HG2  GLU  68           2HG      GLU  68   5.651 -12.164 -11.469
  481    HG3  GLU  68           1HG      GLU  68   5.480 -10.559 -10.759
  482    H    THR  69           H        THR  69   8.338 -15.212  -8.889
  483    HA   THR  69           HA       THR  69  10.995 -14.182  -8.220
  484    HB   THR  69           HB       THR  69   9.128 -15.447  -6.197
  485    HG1  THR  69           1HG      THR  69   8.468 -13.392  -6.341
  486   HG21  THR  69          3HG2      THR  69  11.931 -14.404  -5.922
  487   HG22  THR  69          1HG2      THR  69  11.346 -16.036  -5.598
  488   HG23  THR  69          2HG2      THR  69  10.853 -14.698  -4.558
  489    H    VAL  70           H        VAL  70  12.443 -15.612  -8.917
  490    HA   VAL  70           HA       VAL  70  11.668 -18.443  -9.127
  491    HB   VAL  70           HB       VAL  70  14.015 -17.099 -10.478
  492   HG11  VAL  70          1HG1      VAL  70  12.621 -19.720 -11.016
  493   HG12  VAL  70          2HG1      VAL  70  14.208 -19.520 -10.272
  494   HG13  VAL  70          3HG1      VAL  70  13.957 -19.051 -11.953
  495   HG21  VAL  70          3HG2      VAL  70  11.154 -17.316 -11.294
  496   HG22  VAL  70          1HG2      VAL  70  12.411 -17.410 -12.528
  497   HG23  VAL  70          2HG2      VAL  70  12.287 -15.981 -11.502
  498    HA   PRO  71           HA       PRO  71  14.329 -19.594  -5.766
  499    HB2  PRO  71           2HB      PRO  71  14.876 -22.034  -7.376
  500    HB3  PRO  71           1HB      PRO  71  14.266 -21.889  -5.724
  501    HG2  PRO  71           2HG      PRO  71  12.639 -22.576  -7.718
  502    HG3  PRO  71           1HG      PRO  71  12.091 -21.502  -6.417
  503    HD2  PRO  71           2HD      PRO  71  12.903 -20.831  -9.217
  504    HD3  PRO  71           1HD      PRO  71  11.595 -20.149  -8.226
  505    H    ALA  72           H        ALA  72  16.541 -19.924  -5.251
  506    HA   ALA  72           HA       ALA  72  18.807 -19.834  -5.502
  507    HB1  ALA  72           1HB      ALA  72  18.791 -19.865  -8.458
  508    HB2  ALA  72           2HB      ALA  72  18.141 -21.291  -7.649
  509    HB3  ALA  72           3HB      ALA  72  19.792 -20.765  -7.318
  510    HA   PRO  73           HA       PRO  73  19.568 -15.547  -6.215
  511    HB2  PRO  73           2HB      PRO  73  22.234 -15.475  -6.711
  512    HB3  PRO  73           1HB      PRO  73  21.564 -15.796  -5.108
  513    HG2  PRO  73           2HG      PRO  73  22.609 -17.724  -7.146
  514    HG3  PRO  73           1HG      PRO  73  22.867 -17.701  -5.392
  515    HD2  PRO  73           2HD      PRO  73  21.071 -19.342  -6.589
  516    HD3  PRO  73           1HD      PRO  73  20.833 -18.693  -4.954
  517    H    SER  74           H        SER  74  19.407 -14.107  -7.844
  518    HA   SER  74           HA       SER  74  19.851 -15.102 -10.567
  519    HB2  SER  74           2HB      SER  74  17.581 -14.207  -9.838
  520    HB3  SER  74           1HB      SER  74  18.328 -12.611  -9.789
  521    HG   SER  74           HG       SER  74  17.638 -14.185 -11.960
  522    H    ALA  75           H        ALA  75  21.697 -14.533 -11.504
  523    HA   ALA  75           HA       ALA  75  23.117 -12.134 -10.630
  524    HB1  ALA  75           1HB      ALA  75  24.800 -13.197 -12.404
  525    HB2  ALA  75           2HB      ALA  75  23.864 -14.641 -12.021
  526    HB3  ALA  75           3HB      ALA  75  24.694 -13.762 -10.737
  527    H    ASN  76           H        ASN  76  24.225 -10.822 -12.364
  528    HA   ASN  76           HA       ASN  76  22.262 -10.161 -14.430
  529    HB2  ASN  76           2HB      ASN  76  24.552  -8.643 -13.200
  530    HB3  ASN  76           1HB      ASN  76  23.758  -8.085 -14.668
  531   HD21  ASN  76          1HD2      ASN  76  23.844  -6.672 -12.222
  532   HD22  ASN  76          2HD2      ASN  76  22.225  -6.524 -11.640
  533    H    LYS  77           H        LYS  77  25.652 -11.068 -14.069
  534    HA   LYS  77           HA       LYS  77  27.175 -11.927 -15.514
  535    HB2  LYS  77           2HB      LYS  77  24.610 -12.465 -16.911
  536    HB3  LYS  77           1HB      LYS  77  26.074 -12.579 -17.875
  537    HG2  LYS  77           2HG      LYS  77  26.027 -13.979 -15.257
  538    HG3  LYS  77           1HG      LYS  77  25.070 -14.654 -16.579
  539    HD2  LYS  77           2HD      LYS  77  27.968 -13.914 -16.910
  540    HD3  LYS  77           1HD      LYS  77  27.466 -15.500 -16.320
  541    HE2  LYS  77           2HE      LYS  77  26.150 -14.538 -18.787
  542    HE3  LYS  77           1HE      LYS  77  27.864 -14.932 -18.922
  543    HZ1  LYS  77           3HZ      LYS  77  25.954 -16.729 -19.224
  544    HZ2  LYS  77           1HZ      LYS  77  26.175 -16.879 -17.554
  545    HZ3  LYS  77           2HZ      LYS  77  27.478 -17.123 -18.604
  546    H    GLU  78           H        GLU  78  28.573 -10.346 -16.017
  547    HA   GLU  78           HA       GLU  78  28.025  -8.752 -18.422
  548    HB2  GLU  78           2HB      GLU  78  27.824  -7.613 -15.964
  549    HB3  GLU  78           1HB      GLU  78  29.533  -7.365 -16.289
  550    HG2  GLU  78           2HG      GLU  78  29.146  -5.810 -17.853
  551    HG3  GLU  78           1HG      GLU  78  27.749  -6.661 -18.507
  552    H    LEU  79           H        LEU  79  29.506  -9.629 -19.786
  553    HA   LEU  79           HA       LEU  79  32.301  -9.192 -19.204
  554    HB2  LEU  79           2HB      LEU  79  33.046 -11.461 -19.564
  555    HB3  LEU  79           1HB      LEU  79  31.930 -11.409 -18.215
  556    HG   LEU  79           HG       LEU  79  30.382 -12.004 -20.507
  557   HD11  LEU  79          1HD1      LEU  79  32.346 -14.182 -20.375
  558   HD12  LEU  79          2HD1      LEU  79  32.927 -12.705 -21.145
  559   HD13  LEU  79          3HD1      LEU  79  31.483 -13.509 -21.759
  560   HD21  LEU  79          3HD2      LEU  79  31.342 -13.911 -18.384
  561   HD22  LEU  79          1HD2      LEU  79  29.841 -13.985 -19.305
  562   HD23  LEU  79          2HD2      LEU  79  30.082 -12.708 -18.113
  563    H    VAL  80           H        VAL  80  30.707  -7.943 -21.055
  564    HA   VAL  80           HA       VAL  80  31.531  -9.113 -23.629
  565    HB   VAL  80           HB       VAL  80  29.378  -7.037 -23.196
  566   HG11  VAL  80          1HG1      VAL  80  28.692  -8.016 -25.495
  567   HG12  VAL  80          2HG1      VAL  80  30.360  -8.586 -25.561
  568   HG13  VAL  80          3HG1      VAL  80  30.022  -6.860 -25.415
  569   HG21  VAL  80          3HG2      VAL  80  28.570  -9.753 -23.974
  570   HG22  VAL  80          1HG2      VAL  80  27.815  -8.619 -22.854
  571   HG23  VAL  80          2HG2      VAL  80  29.179  -9.605 -22.327
  572    H    LYS  81           H        LYS  81  32.379  -7.727 -25.250
  573    HA   LYS  81           HA       LYS  81  33.702  -6.096 -26.100
  574    HB2  LYS  81           2HB      LYS  81  32.069  -4.569 -24.120
  575    HB3  LYS  81           1HB      LYS  81  33.475  -3.781 -24.817
  576    HG2  LYS  81           2HG      LYS  81  32.590  -3.828 -26.970
  577    HG3  LYS  81           1HG      LYS  81  31.415  -5.079 -26.561
  578    HD2  LYS  81           2HD      LYS  81  29.956  -3.596 -25.633
  579    HD3  LYS  81           1HD      LYS  81  31.236  -2.522 -25.069
  580    HE2  LYS  81           2HE      LYS  81  31.270  -1.330 -26.992
  581    HE3  LYS  81           1HE      LYS  81  30.932  -2.737 -27.996
  582    HZ1  LYS  81           3HZ      LYS  81  29.088  -1.223 -28.075
  583    HZ2  LYS  81           1HZ      LYS  81  28.960  -1.200 -26.388
  584    HZ3  LYS  81           2HZ      LYS  81  28.603  -2.614 -27.246
  585    H    LEU  82           H        LEU  82  35.479  -7.408 -25.332
  586    HA   LEU  82           HA       LEU  82  37.203  -5.908 -23.522
  587    HB2  LEU  82           2HB      LEU  82  35.831  -7.908 -22.418
  588    HB3  LEU  82           1HB      LEU  82  37.130  -8.859 -23.110
  589    HG   LEU  82           HG       LEU  82  37.810  -6.491 -21.414
  590   HD11  LEU  82          1HD1      LEU  82  36.041  -8.097 -20.345
  591   HD12  LEU  82          2HD1      LEU  82  37.436  -7.550 -19.414
  592   HD13  LEU  82          3HD1      LEU  82  37.434  -9.158 -20.140
  593   HD21  LEU  82          3HD2      LEU  82  39.786  -7.745 -20.939
  594   HD22  LEU  82          1HD2      LEU  82  39.530  -7.790 -22.683
  595   HD23  LEU  82          2HD2      LEU  82  39.118  -9.192 -21.693
  596    H    GLU  83           H        GLU  83  37.856  -5.592 -25.901
  597    HA   GLU  83           HA       GLU  83  39.431  -5.825 -27.517
  598    HB2  GLU  83           2HB      GLU  83  40.616  -7.343 -25.248
  599    HB3  GLU  83           1HB      GLU  83  41.348  -7.544 -26.835
  600    HG2  GLU  83           2HG      GLU  83  40.830  -4.805 -25.769
  601    HG3  GLU  83           1HG      GLU  83  42.229  -5.722 -25.214
  602    H    HIS  84           H        HIS  84  40.504  -7.417 -29.021
  603    HA   HIS  84           HA       HIS  84  39.734 -10.105 -29.181
  604    HB2  HIS  84           2HB      HIS  84  38.089 -10.013 -31.022
  605    HB3  HIS  84           1HB      HIS  84  37.471  -9.274 -29.551
  606    HD1  HIS  84           1HD      HIS  84  36.679  -6.895 -29.718
  607    HD2  HIS  84           2HD      HIS  84  38.838  -8.095 -33.060
  608    HE1  HIS  84           1HE      HIS  84  36.416  -5.036 -31.392
  609    HE2  HIS  84           2HE      HIS  84  37.685  -5.809 -33.427
  Start of MODEL   17
    1    H1   MET   1           1HT      MET   1  21.223   8.625  10.431
    2    H2   MET   1           2HT      MET   1  20.238   9.993  10.110
    3    H3   MET   1           3HT      MET   1  20.249   8.667   9.022
    4    HA   MET   1           HA       MET   1  19.416   7.274  10.867
    5    HB2  MET   1           2HB      MET   1  19.309  10.021  12.081
    6    HB3  MET   1           1HB      MET   1  18.145   8.796  12.567
    7    HG2  MET   1           2HG      MET   1  21.050   8.143  12.612
    8    HG3  MET   1           1HG      MET   1  20.363   9.137  13.894
    9    HE1  MET   1           2HE      MET   1  20.030   8.417  15.747
   10    HE2  MET   1           3HE      MET   1  20.197   6.738  16.260
   11    HE3  MET   1           1HE      MET   1  18.594   7.453  16.087
   12    H    ALA   2           H        ALA   2  17.260   6.713  10.670
   13    HA   ALA   2           HA       ALA   2  15.237   8.491   9.757
   14    HB1  ALA   2           1HB      ALA   2  16.627   8.161   7.674
   15    HB2  ALA   2           2HB      ALA   2  14.915   7.764   7.524
   16    HB3  ALA   2           3HB      ALA   2  16.107   6.477   7.695
   17    H    VAL   3           H        VAL   3  14.004   7.605  11.397
   18    HA   VAL   3           HA       VAL   3  13.523   4.727  11.402
   19    HB   VAL   3           HB       VAL   3  12.109   5.219  13.425
   20   HG11  VAL   3          1HG1      VAL   3  14.132   4.412  14.075
   21   HG12  VAL   3          2HG1      VAL   3  14.257   6.032  14.759
   22   HG13  VAL   3          3HG1      VAL   3  15.033   5.662  13.219
   23   HG21  VAL   3          3HG2      VAL   3  13.406   7.894  13.610
   24   HG22  VAL   3          1HG2      VAL   3  11.916   7.306  14.350
   25   HG23  VAL   3          2HG2      VAL   3  11.944   7.728  12.637
   26    H    PHE   4           H        PHE   4  11.549   3.765  11.034
   27    HA   PHE   4           HA       PHE   4   9.835   5.013   9.157
   28    HB2  PHE   4           2HB      PHE   4   9.947   2.401  10.555
   29    HB3  PHE   4           1HB      PHE   4   8.364   2.895   9.966
   30    HD1  PHE   4           2HD      PHE   4  11.878   2.966   8.679
   31    HD2  PHE   4           1HD      PHE   4   7.796   2.018   7.939
   32    HE1  PHE   4           2HE      PHE   4  12.473   2.177   6.426
   33    HE2  PHE   4           1HE      PHE   4   8.385   1.226   5.686
   34    HZ   PHE   4           HZ       PHE   4  10.725   1.305   4.926
   35    H    HIS   5           H        HIS   5   7.814   5.894   9.353
   36    HA   HIS   5           HA       HIS   5   7.134   7.090  11.838
   37    HB2  HIS   5           2HB      HIS   5   6.626   7.895   9.418
   38    HB3  HIS   5           1HB      HIS   5   5.212   6.857   9.536
   39    HD1  HIS   5           1HD      HIS   5   5.340   7.927  12.815
   40    HD2  HIS   5           2HD      HIS   5   4.497   9.913   9.260
   41    HE1  HIS   5           1HE      HIS   5   4.026   9.963  13.477
   42    HE2  HIS   5           2HE      HIS   5   3.579  11.182  11.317
   43    H    ASP   6           H        ASP   6   5.219   4.806   9.853
   44    HA   ASP   6           HA       ASP   6   4.534   3.238  12.175
   45    HB2  ASP   6           2HB      ASP   6   2.568   5.105  10.892
   46    HB3  ASP   6           1HB      ASP   6   2.000   3.569  11.537
   47    H    GLU   7           H        GLU   7   3.154   1.354  11.599
   48    HA   GLU   7           HA       GLU   7   3.601   0.561   8.793
   49    HB2  GLU   7           2HB      GLU   7   3.231  -1.340  11.106
   50    HB3  GLU   7           1HB      GLU   7   3.842  -1.698   9.499
   51    HG2  GLU   7           2HG      GLU   7   5.834  -1.626  10.510
   52    HG3  GLU   7           1HG      GLU   7   5.662   0.116  10.311
   53    H    VAL   8           H        VAL   8   1.903  -0.123   7.584
   54    HA   VAL   8           HA       VAL   8  -0.659  -0.638   8.931
   55    HB   VAL   8           HB       VAL   8  -0.447   1.062   6.442
   56   HG11  VAL   8          1HG1      VAL   8  -2.686   1.065   6.365
   57   HG12  VAL   8          2HG1      VAL   8  -2.846   1.196   8.114
   58   HG13  VAL   8          3HG1      VAL   8  -2.571  -0.376   7.370
   59   HG21  VAL   8          3HG2      VAL   8  -0.440   1.809   9.323
   60   HG22  VAL   8          1HG2      VAL   8  -1.342   2.822   8.195
   61   HG23  VAL   8          2HG2      VAL   8   0.385   2.559   7.958
   62    H    GLU   9           H        GLU   9  -1.937  -2.179   7.989
   63    HA   GLU   9           HA       GLU   9  -0.693  -4.038   6.244
   64    HB2  GLU   9           2HB      GLU   9  -3.582  -3.830   7.115
   65    HB3  GLU   9           1HB      GLU   9  -2.877  -5.207   6.282
   66    HG2  GLU   9           2HG      GLU   9  -1.514  -5.751   8.136
   67    HG3  GLU   9           1HG      GLU   9  -1.866  -4.218   8.931
   68    H    ILE  10           H        ILE  10  -0.978  -4.449   4.105
   69    HA   ILE  10           HA       ILE  10  -1.561  -2.383   2.347
   70    HB   ILE  10           HB       ILE  10  -0.243  -4.391   1.757
   71   HG12  ILE  10          2HG1      ILE  10  -1.649  -4.746  -0.518
   72   HG13  ILE  10          1HG1      ILE  10  -2.425  -3.286   0.083
   73   HG21  ILE  10          1HG2      ILE  10  -2.916  -5.773   1.537
   74   HG22  ILE  10          2HG2      ILE  10  -1.699  -6.080   2.777
   75   HG23  ILE  10          3HG2      ILE  10  -1.350  -6.449   1.088
   76   HD11  ILE  10          3HD1      ILE  10  -0.582  -2.010  -0.227
   77   HD12  ILE  10          1HD1      ILE  10  -0.307  -3.214  -1.485
   78   HD13  ILE  10          2HD1      ILE  10   0.532  -3.347   0.061
   79    H    GLU  11           H        GLU  11  -3.717  -4.728   3.803
   80    HA   GLU  11           HA       GLU  11  -5.898  -4.541   2.060
   81    HB2  GLU  11           2HB      GLU  11  -5.950  -4.939   5.059
   82    HB3  GLU  11           1HB      GLU  11  -7.259  -5.313   3.946
   83    HG2  GLU  11           2HG      GLU  11  -5.969  -7.047   2.912
   84    HG3  GLU  11           1HG      GLU  11  -4.541  -6.599   3.842
   85    H    ASP  12           H        ASP  12  -4.794  -2.401   4.615
   86    HA   ASP  12           HA       ASP  12  -7.160  -0.798   4.718
   87    HB2  ASP  12           2HB      ASP  12  -4.333  -0.211   5.630
   88    HB3  ASP  12           1HB      ASP  12  -5.732   0.797   5.987
   89    H    PHE  13           H        PHE  13  -4.224  -0.775   2.807
   90    HA   PHE  13           HA       PHE  13  -4.355   1.861   1.821
   91    HB2  PHE  13           2HB      PHE  13  -3.053  -0.670   0.869
   92    HB3  PHE  13           1HB      PHE  13  -3.058   0.752  -0.166
   93    HD1  PHE  13           2HD      PHE  13  -2.276  -0.159   3.377
   94    HD2  PHE  13           1HD      PHE  13  -1.261   2.154  -0.048
   95    HE1  PHE  13           2HE      PHE  13  -0.294   0.704   4.551
   96    HE2  PHE  13           1HE      PHE  13   0.722   3.018   1.118
   97    HZ   PHE  13           HZ       PHE  13   1.209   2.296   3.421
   98    H    GLN  14           H        GLN  14  -4.663   2.317  -0.594
   99    HA   GLN  14           HA       GLN  14  -7.226   1.139  -1.433
  100    HB2  GLN  14           2HB      GLN  14  -6.781   3.724  -0.979
  101    HB3  GLN  14           1HB      GLN  14  -6.189   3.666  -2.631
  102    HG2  GLN  14           2HG      GLN  14  -8.287   3.016  -3.475
  103    HG3  GLN  14           1HG      GLN  14  -8.898   2.627  -1.868
  104   HE21  GLN  14          1HE2      GLN  14  -8.815   4.575  -0.323
  105   HE22  GLN  14          2HE2      GLN  14  -9.402   6.065  -0.972
  106    H    TYR  15           H        TYR  15  -7.011  -0.361  -2.976
  107    HA   TYR  15           HA       TYR  15  -4.698  -0.647  -4.579
  108    HB2  TYR  15           2HB      TYR  15  -6.131  -2.559  -4.052
  109    HB3  TYR  15           1HB      TYR  15  -7.459  -1.834  -4.951
  110    HD1  TYR  15           2HD      TYR  15  -3.905  -2.880  -5.462
  111    HD2  TYR  15           1HD      TYR  15  -7.800  -2.527  -7.132
  112    HE1  TYR  15           2HE      TYR  15  -3.124  -4.011  -7.500
  113    HE2  TYR  15           1HE      TYR  15  -7.033  -3.656  -9.176
  114    HH   TYR  15           HH       TYR  15  -4.920  -5.443  -9.611
  115    H    ASP  16           H        ASP  16  -4.102   0.596  -6.212
  116    HA   ASP  16           HA       ASP  16  -6.106   2.157  -7.654
  117    HB2  ASP  16           2HB      ASP  16  -3.690   2.903  -6.686
  118    HB3  ASP  16           1HB      ASP  16  -3.234   2.461  -8.327
  119    H    GLU  17           H        GLU  17  -7.028   0.543  -8.939
  120    HA   GLU  17           HA       GLU  17  -5.693  -1.339 -10.489
  121    HB2  GLU  17           2HB      GLU  17  -7.752  -1.171 -12.013
  122    HB3  GLU  17           1HB      GLU  17  -8.008  -1.639 -10.337
  123    HG2  GLU  17           2HG      GLU  17  -9.138   0.257  -9.834
  124    HG3  GLU  17           1HG      GLU  17  -8.198   1.248 -10.950
  125    H    ASP  18           H        ASP  18  -6.129   2.075 -11.032
  126    HA   ASP  18           HA       ASP  18  -5.827   2.432 -13.708
  127    HB2  ASP  18           2HB      ASP  18  -5.792   4.110 -11.608
  128    HB3  ASP  18           1HB      ASP  18  -4.080   4.140 -12.014
  129    H    SER  19           H        SER  19  -3.170   1.835 -11.395
  130    HA   SER  19           HA       SER  19  -1.588   0.714 -13.572
  131    HB2  SER  19           2HB      SER  19  -0.320   2.788 -11.789
  132    HB3  SER  19           1HB      SER  19   0.302   2.104 -13.291
  133    HG   SER  19           HG       SER  19  -0.715   4.308 -13.307
  134    H    GLU  20           H        GLU  20  -2.901  -0.343 -11.159
  135    HA   GLU  20           HA       GLU  20  -2.532  -1.682  -9.364
  136    HB2  GLU  20           2HB      GLU  20  -1.452  -2.865 -11.413
  137    HB3  GLU  20           1HB      GLU  20   0.069  -2.484 -10.617
  138    HG2  GLU  20           2HG      GLU  20  -0.717  -3.675  -8.607
  139    HG3  GLU  20           1HG      GLU  20  -2.191  -4.108  -9.468
  140    H    THR  21           H        THR  21  -2.146   0.410  -8.177
  141    HA   THR  21           HA       THR  21   0.434   0.233  -6.790
  142    HB   THR  21           HB       THR  21  -0.797   2.888  -7.554
  143    HG1  THR  21           1HG      THR  21  -0.120   2.290  -9.481
  144   HG21  THR  21          3HG2      THR  21   1.397   3.797  -7.071
  145   HG22  THR  21          1HG2      THR  21   1.982   2.191  -6.635
  146   HG23  THR  21          2HG2      THR  21   0.736   2.971  -5.661
  147    H    TYR  22           H        TYR  22   0.405   1.204  -4.641
  148    HA   TYR  22           HA       TYR  22  -2.317   1.435  -3.523
  149    HB2  TYR  22           2HB      TYR  22   0.108   0.242  -2.159
  150    HB3  TYR  22           1HB      TYR  22  -1.495   0.411  -1.453
  151    HD1  TYR  22           2HD      TYR  22   0.396  -1.296  -4.156
  152    HD2  TYR  22           1HD      TYR  22  -3.142  -1.239  -1.791
  153    HE1  TYR  22           2HE      TYR  22  -0.212  -3.510  -5.025
  154    HE2  TYR  22           1HE      TYR  22  -3.759  -3.458  -2.655
  155    HH   TYR  22           HH       TYR  22  -3.108  -4.782  -4.975
  156    H    PHE  23           H        PHE  23  -2.709   3.094  -2.101
  157    HA   PHE  23           HA       PHE  23  -0.442   4.771  -1.296
  158    HB2  PHE  23           2HB      PHE  23  -1.927   6.801  -1.809
  159    HB3  PHE  23           1HB      PHE  23  -1.155   5.994  -3.165
  160    HD1  PHE  23           1HD      PHE  23  -2.542   4.326  -4.496
  161    HD2  PHE  23           2HD      PHE  23  -4.232   7.114  -1.761
  162    HE1  PHE  23           1HE      PHE  23  -4.721   4.069  -5.593
  163    HE2  PHE  23           2HE      PHE  23  -6.425   6.858  -2.851
  164    HZ   PHE  23           HZ       PHE  23  -6.672   5.334  -4.772
  165    H    TYR  24           H        TYR  24  -0.793   6.088   0.544
  166    HA   TYR  24           HA       TYR  24  -3.191   5.408   2.113
  167    HB2  TYR  24           2HB      TYR  24  -0.775   4.377   2.710
  168    HB3  TYR  24           1HB      TYR  24  -0.668   5.893   3.600
  169    HD1  TYR  24           2HD      TYR  24  -3.293   3.281   3.025
  170    HD2  TYR  24           1HD      TYR  24  -1.194   5.697   5.830
  171    HE1  TYR  24           2HE      TYR  24  -4.609   2.295   4.850
  172    HE2  TYR  24           1HE      TYR  24  -2.506   4.717   7.662
  173    HH   TYR  24           HH       TYR  24  -4.725   3.598   7.951
  174    HA   PRO  25           HA       PRO  25  -3.662   9.790   2.543
  175    HB2  PRO  25           2HB      PRO  25  -5.187   9.831   4.806
  176    HB3  PRO  25           1HB      PRO  25  -5.819   9.427   3.206
  177    HG2  PRO  25           2HG      PRO  25  -4.981   7.603   5.427
  178    HG3  PRO  25           1HG      PRO  25  -6.399   7.498   4.366
  179    HD2  PRO  25           2HD      PRO  25  -4.204   5.990   3.966
  180    HD3  PRO  25           1HD      PRO  25  -5.181   6.604   2.617
  181    H    CYS  26           H        CYS  26  -2.187  11.182   3.246
  182    HA   CYS  26           HA       CYS  26  -0.755  10.622   5.735
  183    HB2  CYS  26           2HB      CYS  26   0.101  11.484   3.231
  184    HB3  CYS  26           1HB      CYS  26   0.176  12.932   4.232
  185    HA   PRO  27           HA       PRO  27  -2.887  13.803   7.947
  186    HB2  PRO  27           2HB      PRO  27  -0.977  14.465   9.771
  187    HB3  PRO  27           1HB      PRO  27  -1.943  12.988   9.867
  188    HG2  PRO  27           2HG      PRO  27   0.842  13.367   8.835
  189    HG3  PRO  27           1HG      PRO  27   0.191  12.069   9.852
  190    HD2  PRO  27           2HD      PRO  27   0.592  11.764   7.197
  191    HD3  PRO  27           1HD      PRO  27  -0.736  10.955   8.058
  192    H    CYS  28           H        CYS  28   0.111  14.411   6.305
  193    HA   CYS  28           HA       CYS  28   0.218  17.218   6.865
  194    HB2  CYS  28           2HB      CYS  28   1.994  17.276   5.172
  195    HB3  CYS  28           1HB      CYS  28   2.249  15.962   6.314
  196    H    GLY  29           H        GLY  29  -0.970  15.228   4.173
  197    HA2  GLY  29           2HA      GLY  29  -3.069  16.756   3.383
  198    HA3  GLY  29           1HA      GLY  29  -1.705  17.524   2.586
  199    H    ASP  30           H        ASP  30  -0.179  15.696   1.578
  200    HA   ASP  30           HA       ASP  30  -1.734  14.502  -0.507
  201    HB2  ASP  30           2HB      ASP  30   0.830  15.402  -0.324
  202    HB3  ASP  30           1HB      ASP  30   1.086  13.666  -0.202
  203    H    ASN  31           H        ASN  31  -0.703  12.100  -1.105
  204    HA   ASN  31           HA       ASN  31  -1.121  10.425   1.278
  205    HB2  ASN  31           2HB      ASN  31  -2.172   9.780  -1.485
  206    HB3  ASN  31           1HB      ASN  31  -2.457   8.875  -0.003
  207   HD21  ASN  31          1HD2      ASN  31  -4.448   9.126   0.709
  208   HD22  ASN  31          2HD2      ASN  31  -5.390  10.570   0.616
  209    H    PHE  32           H        PHE  32   0.120   8.588   1.428
  210    HA   PHE  32           HA       PHE  32   2.614   8.530   0.117
  211    HB2  PHE  32           2HB      PHE  32   1.117   6.631   1.890
  212    HB3  PHE  32           1HB      PHE  32   2.573   6.073   1.075
  213    HD1  PHE  32           1HD      PHE  32   4.692   7.520   1.392
  214    HD2  PHE  32           2HD      PHE  32   1.280   7.720   3.928
  215    HE1  PHE  32           1HE      PHE  32   6.078   8.494   3.176
  216    HE2  PHE  32           2HE      PHE  32   2.662   8.699   5.713
  217    HZ   PHE  32           HZ       PHE  32   5.064   9.087   5.338
  218    H    SER  33           H        SER  33   3.402   6.421  -1.022
  219    HA   SER  33           HA       SER  33   1.406   5.144  -2.684
  220    HB2  SER  33           2HB      SER  33   2.595   5.817  -4.809
  221    HB3  SER  33           1HB      SER  33   1.714   7.116  -4.007
  222    HG   SER  33           HG       SER  33   3.526   8.147  -3.824
  223    H    ILE  34           H        ILE  34   2.022   3.183  -3.432
  224    HA   ILE  34           HA       ILE  34   4.813   2.406  -3.506
  225    HB   ILE  34           HB       ILE  34   4.254   1.985  -1.160
  226   HG12  ILE  34          2HG1      ILE  34   4.286  -0.768  -2.281
  227   HG13  ILE  34          1HG1      ILE  34   5.566   0.319  -2.809
  228   HG21  ILE  34          1HG2      ILE  34   1.751   1.430  -1.991
  229   HG22  ILE  34          2HG2      ILE  34   2.394   0.953  -0.421
  230   HG23  ILE  34          3HG2      ILE  34   2.375  -0.202  -1.752
  231   HD11  ILE  34          3HD1      ILE  34   5.189   0.410   0.057
  232   HD12  ILE  34          1HD1      ILE  34   6.648   0.109  -0.888
  233   HD13  ILE  34          2HD1      ILE  34   5.545  -1.217  -0.523
  234    H    THR  35           H        THR  35   5.113   1.162  -5.241
  235    HA   THR  35           HA       THR  35   2.915   0.264  -6.825
  236    HB   THR  35           HB       THR  35   4.892  -0.901  -8.100
  237    HG1  THR  35           1HG      THR  35   6.877  -0.221  -7.550
  238   HG21  THR  35          3HG2      THR  35   5.305   2.026  -8.058
  239   HG22  THR  35          1HG2      THR  35   3.699   1.438  -8.493
  240   HG23  THR  35          2HG2      THR  35   5.108   0.920  -9.419
  241    H    LYS  36           H        LYS  36   2.301  -1.848  -7.372
  242    HA   LYS  36           HA       LYS  36   2.195  -3.704  -5.270
  243    HB2  LYS  36           2HB      LYS  36   0.539  -3.662  -7.073
  244    HB3  LYS  36           1HB      LYS  36   1.763  -4.159  -8.231
  245    HG2  LYS  36           2HG      LYS  36   0.897  -6.198  -7.855
  246    HG3  LYS  36           1HG      LYS  36   1.970  -6.169  -6.455
  247    HD2  LYS  36           2HD      LYS  36   0.212  -5.575  -4.995
  248    HD3  LYS  36           1HD      LYS  36  -0.861  -5.167  -6.336
  249    HE2  LYS  36           2HE      LYS  36  -0.283  -7.767  -6.886
  250    HE3  LYS  36           1HE      LYS  36  -0.250  -7.773  -5.123
  251    HZ1  LYS  36           3HZ      LYS  36  -2.459  -7.229  -4.989
  252    HZ2  LYS  36           1HZ      LYS  36  -2.463  -8.176  -6.390
  253    HZ3  LYS  36           2HZ      LYS  36  -2.502  -6.491  -6.511
  254    H    GLU  37           H        GLU  37   4.327  -3.503  -8.084
  255    HA   GLU  37           HA       GLU  37   5.616  -5.979  -7.801
  256    HB2  GLU  37           2HB      GLU  37   5.722  -4.209  -9.713
  257    HB3  GLU  37           1HB      GLU  37   7.054  -3.535  -8.785
  258    HG2  GLU  37           2HG      GLU  37   8.205  -5.706  -8.897
  259    HG3  GLU  37           1HG      GLU  37   6.888  -6.332  -9.888
  260    H    ASP  38           H        ASP  38   6.243  -2.830  -6.315
  261    HA   ASP  38           HA       ASP  38   8.728  -3.360  -5.156
  262    HB2  ASP  38           2HB      ASP  38   6.498  -1.467  -4.589
  263    HB3  ASP  38           1HB      ASP  38   7.681  -1.715  -3.308
  264    H    LEU  39           H        LEU  39   5.462  -3.871  -3.848
  265    HA   LEU  39           HA       LEU  39   6.276  -4.911  -1.359
  266    HB2  LEU  39           2HB      LEU  39   3.743  -5.587  -2.844
  267    HB3  LEU  39           1HB      LEU  39   4.014  -5.698  -1.115
  268    HG   LEU  39           HG       LEU  39   4.255  -3.048  -2.485
  269   HD11  LEU  39          1HD1      LEU  39   1.847  -2.680  -1.957
  270   HD12  LEU  39          2HD1      LEU  39   1.700  -4.414  -1.674
  271   HD13  LEU  39          3HD1      LEU  39   2.142  -3.816  -3.273
  272   HD21  LEU  39          3HD2      LEU  39   3.716  -2.178  -0.337
  273   HD22  LEU  39          1HD2      LEU  39   4.946  -3.421  -0.104
  274   HD23  LEU  39          2HD2      LEU  39   3.258  -3.773   0.262
  275    H    GLU  40           H        GLU  40   5.505  -6.505  -4.441
  276    HA   GLU  40           HA       GLU  40   5.718  -9.159  -3.527
  277    HB2  GLU  40           2HB      GLU  40   6.216  -8.024  -6.280
  278    HB3  GLU  40           1HB      GLU  40   6.055  -9.736  -5.916
  279    HG2  GLU  40           2HG      GLU  40   3.773  -9.372  -5.152
  280    HG3  GLU  40           1HG      GLU  40   3.931  -7.648  -5.483
  281    H    ASN  41           H        ASN  41   8.160  -6.821  -4.418
  282    HA   ASN  41           HA       ASN  41  10.257  -8.828  -4.535
  283    HB2  ASN  41           2HB      ASN  41  10.044  -5.925  -5.129
  284    HB3  ASN  41           1HB      ASN  41  11.623  -6.521  -4.629
  285   HD21  ASN  41          1HD2      ASN  41  12.356  -5.952  -6.743
  286   HD22  ASN  41          2HD2      ASN  41  12.057  -7.005  -8.079
  287    H    GLY  42           H        GLY  42   9.145  -6.264  -2.369
  288    HA2  GLY  42           2HA      GLY  42   9.623  -7.121   0.044
  289    HA3  GLY  42           1HA      GLY  42  11.288  -6.896  -0.465
  290    H    GLU  43           H        GLU  43  10.079  -4.522  -2.143
  291    HA   GLU  43           HA       GLU  43  10.799  -2.486  -0.310
  292    HB2  GLU  43           2HB      GLU  43   9.582  -2.478  -3.062
  293    HB3  GLU  43           1HB      GLU  43   9.765  -0.986  -2.153
  294    HG2  GLU  43           2HG      GLU  43  12.241  -1.826  -1.909
  295    HG3  GLU  43           1HG      GLU  43  11.832  -2.737  -3.363
  296    H    ASP  44           H        ASP  44   9.383  -2.966   1.444
  297    HA   ASP  44           HA       ASP  44   6.551  -2.331   1.081
  298    HB2  ASP  44           2HB      ASP  44   6.438  -3.054   3.543
  299    HB3  ASP  44           1HB      ASP  44   6.784  -4.294   2.350
  300    H    VAL  45           H        VAL  45   8.326  -0.194   0.755
  301    HA   VAL  45           HA       VAL  45   7.669   1.438   3.111
  302    HB   VAL  45           HB       VAL  45  10.084   1.065   3.062
  303   HG11  VAL  45          1HG1      VAL  45  11.486   1.608   1.273
  304   HG12  VAL  45          2HG1      VAL  45  10.243   2.567   0.470
  305   HG13  VAL  45          3HG1      VAL  45  10.114   0.809   0.506
  306   HG21  VAL  45          3HG2      VAL  45   9.061   3.250   3.791
  307   HG22  VAL  45          1HG2      VAL  45   9.523   3.896   2.216
  308   HG23  VAL  45          2HG2      VAL  45  10.762   3.320   3.331
  309    H    ALA  46           H        ALA  46   6.560   3.245   2.740
  310    HA   ALA  46           HA       ALA  46   6.236   4.103  -0.059
  311    HB1  ALA  46           1HB      ALA  46   4.026   4.352   0.242
  312    HB2  ALA  46           2HB      ALA  46   4.217   5.023   1.860
  313    HB3  ALA  46           3HB      ALA  46   4.259   3.277   1.620
  314    H    THR  47           H        THR  47   6.685   6.168  -0.593
  315    HA   THR  47           HA       THR  47   7.495   7.970   1.591
  316    HB   THR  47           HB       THR  47   8.542   8.184  -1.223
  317    HG1  THR  47           1HG      THR  47   9.277   6.214  -0.762
  318   HG21  THR  47          3HG2      THR  47   8.894   9.813   0.935
  319   HG22  THR  47          1HG2      THR  47   9.989   9.684  -0.441
  320   HG23  THR  47          2HG2      THR  47  10.304   8.757   1.026
  321    H    CYS  48           H        CYS  48   6.555   9.911   1.735
  322    HA   CYS  48           HA       CYS  48   4.434  10.547  -0.146
  323    HB2  CYS  48           2HB      CYS  48   4.144  10.681   2.363
  324    HB3  CYS  48           1HB      CYS  48   5.215  12.079   2.339
  325    HA   PRO  49           HA       PRO  49   6.997  13.519  -2.257
  326    HB2  PRO  49           2HB      PRO  49   5.139  14.533  -3.912
  327    HB3  PRO  49           1HB      PRO  49   5.773  12.895  -4.113
  328    HG2  PRO  49           2HG      PRO  49   3.192  13.796  -2.901
  329    HG3  PRO  49           1HG      PRO  49   3.510  12.410  -3.957
  330    HD2  PRO  49           2HD      PRO  49   3.250  12.255  -1.222
  331    HD3  PRO  49           1HD      PRO  49   4.136  11.078  -2.213
  332    H    SER  50           H        SER  50   4.722  14.248   0.064
  333    HA   SER  50           HA       SER  50   4.945  17.147  -0.341
  334    HB2  SER  50           2HB      SER  50   2.651  16.425  -0.155
  335    HB3  SER  50           1HB      SER  50   3.008  15.509   1.308
  336    HG   SER  50           HG       SER  50   2.371  17.296   2.233
  337    H    CYS  51           H        CYS  51   5.014  14.732   2.297
  338    HA   CYS  51           HA       CYS  51   6.616  16.592   3.895
  339    HB2  CYS  51           2HB      CYS  51   6.126  15.147   5.785
  340    HB3  CYS  51           1HB      CYS  51   4.636  15.565   4.946
  341    H    SER  52           H        SER  52   6.957  13.701   2.033
  342    HA   SER  52           HA       SER  52   8.743  12.400   1.524
  343    HB2  SER  52           2HB      SER  52  10.011  14.865   2.588
  344    HB3  SER  52           1HB      SER  52  11.035  13.431   2.503
  345    HG   SER  52           HG       SER  52   9.500  14.442   0.341
  346    H    LEU  53           H        LEU  53   7.239  11.652   3.694
  347    HA   LEU  53           HA       LEU  53   9.116  10.845   5.788
  348    HB2  LEU  53           2HB      LEU  53   6.132  10.938   5.558
  349    HB3  LEU  53           1HB      LEU  53   6.869   9.869   6.734
  350    HG   LEU  53           HG       LEU  53   7.315  12.853   6.619
  351   HD11  LEU  53          1HD1      LEU  53   5.198  12.871   7.395
  352   HD12  LEU  53          2HD1      LEU  53   5.986  12.447   8.914
  353   HD13  LEU  53          3HD1      LEU  53   5.256  11.188   7.918
  354   HD21  LEU  53          3HD2      LEU  53   9.150  12.175   7.769
  355   HD22  LEU  53          1HD2      LEU  53   8.414  10.653   8.273
  356   HD23  LEU  53          2HD2      LEU  53   7.995  12.152   9.102
  357    H    ILE  54           H        ILE  54   8.400   8.506   6.683
  358    HA   ILE  54           HA       ILE  54   8.277   6.667   4.381
  359    HB   ILE  54           HB       ILE  54   9.826   5.153   5.713
  360   HG12  ILE  54          2HG1      ILE  54  10.515   7.751   7.109
  361   HG13  ILE  54          1HG1      ILE  54   9.630   6.423   7.853
  362   HG21  ILE  54          1HG2      ILE  54  10.356   6.756   3.706
  363   HG22  ILE  54          2HG2      ILE  54  11.653   5.919   4.559
  364   HG23  ILE  54          3HG2      ILE  54  11.311   7.611   4.918
  365   HD11  ILE  54          3HD1      ILE  54  12.334   5.960   6.674
  366   HD12  ILE  54          1HD1      ILE  54  11.493   5.063   7.937
  367   HD13  ILE  54          2HD1      ILE  54  12.159   6.658   8.284
  368    H    ILE  55           H        ILE  55   7.151   4.769   4.675
  369    HA   ILE  55           HA       ILE  55   6.048   4.160   7.310
  370    HB   ILE  55           HB       ILE  55   3.764   3.849   6.366
  371   HG12  ILE  55          2HG1      ILE  55   4.354   5.702   4.124
  372   HG13  ILE  55          1HG1      ILE  55   4.895   4.040   3.923
  373   HG21  ILE  55          1HG2      ILE  55   4.308   5.815   7.691
  374   HG22  ILE  55          2HG2      ILE  55   3.147   6.212   6.426
  375   HG23  ILE  55          3HG2      ILE  55   4.842   6.662   6.240
  376   HD11  ILE  55          3HD1      ILE  55   2.851   3.634   3.160
  377   HD12  ILE  55          1HD1      ILE  55   2.226   5.159   3.785
  378   HD13  ILE  55          2HD1      ILE  55   2.321   3.748   4.837
  379    H    LYS  56           H        LYS  56   5.501   1.995   7.607
  380    HA   LYS  56           HA       LYS  56   6.590   0.188   5.586
  381    HB2  LYS  56           2HB      LYS  56   7.301   0.003   7.977
  382    HB3  LYS  56           1HB      LYS  56   5.654  -0.447   8.388
  383    HG2  LYS  56           2HG      LYS  56   6.604  -2.510   8.233
  384    HG3  LYS  56           1HG      LYS  56   6.054  -2.305   6.569
  385    HD2  LYS  56           2HD      LYS  56   8.179  -1.978   5.762
  386    HD3  LYS  56           1HD      LYS  56   8.784  -1.354   7.296
  387    HE2  LYS  56           2HE      LYS  56   9.614  -3.647   6.592
  388    HE3  LYS  56           1HE      LYS  56   8.962  -3.511   8.224
  389    HZ1  LYS  56           3HZ      LYS  56   7.098  -4.710   7.674
  390    HZ2  LYS  56           1HZ      LYS  56   8.253  -5.467   6.696
  391    HZ3  LYS  56           2HZ      LYS  56   7.188  -4.337   6.026
  392    H    VAL  57           H        VAL  57   5.495  -1.223   4.444
  393    HA   VAL  57           HA       VAL  57   2.576  -1.252   4.780
  394    HB   VAL  57           HB       VAL  57   3.742  -2.285   2.255
  395   HG11  VAL  57          1HG1      VAL  57   1.445  -0.487   2.996
  396   HG12  VAL  57          2HG1      VAL  57   1.360  -2.190   2.544
  397   HG13  VAL  57          3HG1      VAL  57   1.826  -0.980   1.348
  398   HG21  VAL  57          3HG2      VAL  57   4.216   0.479   3.212
  399   HG22  VAL  57          1HG2      VAL  57   3.641   0.302   1.555
  400   HG23  VAL  57          2HG2      VAL  57   5.128  -0.498   2.062
  401    H    ILE  58           H        ILE  58   1.855  -3.015   5.772
  402    HA   ILE  58           HA       ILE  58   3.382  -5.498   5.654
  403    HB   ILE  58           HB       ILE  58   0.836  -4.980   7.191
  404   HG12  ILE  58          2HG1      ILE  58   2.511  -3.358   7.898
  405   HG13  ILE  58          1HG1      ILE  58   2.301  -4.581   9.148
  406   HG21  ILE  58          1HG2      ILE  58   1.165  -6.976   8.246
  407   HG22  ILE  58          2HG2      ILE  58   2.915  -6.930   8.036
  408   HG23  ILE  58          3HG2      ILE  58   1.875  -7.358   6.678
  409   HD11  ILE  58          3HD1      ILE  58   4.357  -5.570   7.589
  410   HD12  ILE  58          1HD1      ILE  58   4.510  -4.765   9.149
  411   HD13  ILE  58          2HD1      ILE  58   4.664  -3.835   7.659
  412    H    TYR  59           H        TYR  59   2.773  -7.302   4.582
  413    HA   TYR  59           HA       TYR  59   0.070  -7.594   3.560
  414    HB2  TYR  59           2HB      TYR  59   1.014  -8.013   1.212
  415    HB3  TYR  59           1HB      TYR  59   0.919  -6.338   1.744
  416    HD1  TYR  59           2HD      TYR  59   3.228  -9.173   1.185
  417    HD2  TYR  59           1HD      TYR  59   2.859  -5.018   1.999
  418    HE1  TYR  59           2HE      TYR  59   5.628  -8.882   0.745
  419    HE2  TYR  59           1HE      TYR  59   5.250  -4.712   1.558
  420    HH   TYR  59           HH       TYR  59   7.062  -6.088   0.094
  421    H    ASP  60           H        ASP  60   0.102  -9.687   2.036
  422    HA   ASP  60           HA       ASP  60   1.106 -11.814   3.706
  423    HB2  ASP  60           2HB      ASP  60  -1.170 -11.744   2.501
  424    HB3  ASP  60           1HB      ASP  60  -0.272 -12.155   1.044
  425    H    LYS  61           H        LYS  61   3.293 -12.026   3.527
  426    HA   LYS  61           HA       LYS  61   4.783 -11.688   1.173
  427    HB2  LYS  61           2HB      LYS  61   5.403 -13.262   3.670
  428    HB3  LYS  61           1HB      LYS  61   6.559 -13.011   2.370
  429    HG2  LYS  61           2HG      LYS  61   5.247 -10.630   3.576
  430    HG3  LYS  61           1HG      LYS  61   6.511 -11.458   4.488
  431    HD2  LYS  61           2HD      LYS  61   7.972 -11.256   2.447
  432    HD3  LYS  61           1HD      LYS  61   6.729 -10.218   1.747
  433    HE2  LYS  61           2HE      LYS  61   6.982  -8.910   4.002
  434    HE3  LYS  61           1HE      LYS  61   8.549  -9.714   4.061
  435    HZ1  LYS  61           3HZ      LYS  61   8.335  -7.409   2.947
  436    HZ2  LYS  61           1HZ      LYS  61   7.737  -8.276   1.623
  437    HZ3  LYS  61           2HZ      LYS  61   9.290  -8.595   2.210
  438    H    ASP  62           H        ASP  62   3.047 -14.474   2.428
  439    HA   ASP  62           HA       ASP  62   4.267 -16.424   0.780
  440    HB2  ASP  62           2HB      ASP  62   2.533 -16.607   2.825
  441    HB3  ASP  62           1HB      ASP  62   1.405 -16.784   1.485
  442    H    GLN  63           H        GLN  63   1.693 -14.106   0.218
  443    HA   GLN  63           HA       GLN  63   1.094 -15.304  -2.384
  444    HB2  GLN  63           2HB      GLN  63  -0.254 -13.333  -0.609
  445    HB3  GLN  63           1HB      GLN  63  -0.538 -13.203  -2.338
  446    HG2  GLN  63           2HG      GLN  63  -0.951 -15.729  -0.760
  447    HG3  GLN  63           1HG      GLN  63  -2.219 -14.551  -1.086
  448   HE21  GLN  63          1HE2      GLN  63  -2.762 -14.140  -3.328
  449   HE22  GLN  63          2HE2      GLN  63  -2.575 -15.404  -4.489
  450    H    PHE  64           H        PHE  64   2.610 -12.474  -0.964
  451    HA   PHE  64           HA       PHE  64   2.850 -11.083  -3.477
  452    HB2  PHE  64           2HB      PHE  64   3.634 -10.547  -0.653
  453    HB3  PHE  64           1HB      PHE  64   4.532  -9.713  -1.916
  454    HD1  PHE  64           2HD      PHE  64   1.153 -10.232  -0.502
  455    HD2  PHE  64           1HD      PHE  64   3.600  -7.885  -3.075
  456    HE1  PHE  64           2HE      PHE  64  -0.637  -8.554  -0.668
  457    HE2  PHE  64           1HE      PHE  64   1.814  -6.203  -3.245
  458    HZ   PHE  64           HZ       PHE  64  -0.309  -6.536  -2.042
  459    H    VAL  65           H        VAL  65   5.314 -12.323  -1.182
  460    HA   VAL  65           HA       VAL  65   7.099 -12.718  -3.492
  461    HB   VAL  65           HB       VAL  65   7.930 -11.025  -1.966
  462   HG11  VAL  65          1HG1      VAL  65   8.561 -12.819   0.250
  463   HG12  VAL  65          2HG1      VAL  65   6.840 -12.508   0.045
  464   HG13  VAL  65          3HG1      VAL  65   7.956 -11.163   0.264
  465   HG21  VAL  65          3HG2      VAL  65   9.354 -13.481  -2.577
  466   HG22  VAL  65          1HG2      VAL  65  10.032 -12.634  -1.188
  467   HG23  VAL  65          2HG2      VAL  65   9.873 -11.804  -2.735
  468    H    SER  66           H        SER  66   6.390 -14.813  -3.937
  469    HA   SER  66           HA       SER  66   7.654 -16.856  -2.318
  470    HB2  SER  66           2HB      SER  66   5.193 -16.427  -1.511
  471    HB3  SER  66           1HB      SER  66   4.766 -17.343  -2.956
  472    HG   SER  66           HG       SER  66   5.010 -18.673  -1.091
  473    H    GLY  67           H        GLY  67   8.206 -15.905  -4.913
  474    HA2  GLY  67           2HA      GLY  67   7.517 -18.293  -6.507
  475    HA3  GLY  67           1HA      GLY  67   7.547 -16.684  -7.216
  476    H    GLU  68           H        GLU  68   9.576 -15.596  -7.417
  477    HA   GLU  68           HA       GLU  68  11.812 -17.477  -7.676
  478    HB2  GLU  68           2HB      GLU  68  11.291 -14.761  -8.886
  479    HB3  GLU  68           1HB      GLU  68  12.838 -15.583  -9.021
  480    HG2  GLU  68           2HG      GLU  68  11.822 -17.404 -10.222
  481    HG3  GLU  68           1HG      GLU  68  10.220 -16.710  -9.984
  482    H    THR  69           H        THR  69  11.129 -16.577  -5.064
  483    HA   THR  69           HA       THR  69  13.016 -14.497  -4.364
  484    HB   THR  69           HB       THR  69  10.854 -14.588  -3.214
  485    HG1  THR  69           1HG      THR  69  12.433 -13.702  -1.972
  486   HG21  THR  69          3HG2      THR  69   9.944 -16.392  -2.324
  487   HG22  THR  69          1HG2      THR  69  11.408 -16.772  -1.421
  488   HG23  THR  69          2HG2      THR  69  11.229 -17.330  -3.084
  489    H    VAL  70           H        VAL  70  15.102 -15.025  -4.366
  490    HA   VAL  70           HA       VAL  70  15.974 -17.298  -2.755
  491    HB   VAL  70           HB       VAL  70  15.829 -18.189  -5.029
  492   HG11  VAL  70          1HG1      VAL  70  16.447 -15.749  -5.932
  493   HG12  VAL  70          2HG1      VAL  70  16.667 -17.213  -6.891
  494   HG13  VAL  70          3HG1      VAL  70  18.038 -16.503  -6.038
  495   HG21  VAL  70          3HG2      VAL  70  18.217 -18.916  -5.266
  496   HG22  VAL  70          1HG2      VAL  70  17.528 -19.141  -3.658
  497   HG23  VAL  70          2HG2      VAL  70  18.621 -17.793  -3.968
  498    HA   PRO  71           HA       PRO  71  18.933 -14.212  -1.539
  499    HB2  PRO  71           2HB      PRO  71  20.481 -15.743   0.051
  500    HB3  PRO  71           1HB      PRO  71  18.849 -15.248   0.518
  501    HG2  PRO  71           2HG      PRO  71  19.791 -17.857  -0.606
  502    HG3  PRO  71           1HG      PRO  71  18.633 -17.555   0.702
  503    HD2  PRO  71           2HD      PRO  71  17.900 -18.162  -1.858
  504    HD3  PRO  71           1HD      PRO  71  16.896 -17.200  -0.755
  505    H    ALA  72           H        ALA  72  20.543 -13.431  -2.754
  506    HA   ALA  72           HA       ALA  72  22.953 -14.839  -3.227
  507    HB1  ALA  72           1HB      ALA  72  22.192 -16.061  -4.976
  508    HB2  ALA  72           2HB      ALA  72  22.540 -14.577  -5.861
  509    HB3  ALA  72           3HB      ALA  72  20.892 -14.929  -5.344
  510    HA   PRO  73           HA       PRO  73  24.319 -10.662  -3.725
  511    HB2  PRO  73           2HB      PRO  73  26.672 -11.034  -5.026
  512    HB3  PRO  73           1HB      PRO  73  26.449 -11.428  -3.318
  513    HG2  PRO  73           2HG      PRO  73  26.406 -13.236  -5.702
  514    HG3  PRO  73           1HG      PRO  73  27.155 -13.492  -4.116
  515    HD2  PRO  73           2HD      PRO  73  24.773 -14.588  -4.815
  516    HD3  PRO  73           1HD      PRO  73  25.172 -14.138  -3.145
  517    H    SER  74           H        SER  74  23.131  -9.434  -5.081
  518    HA   SER  74           HA       SER  74  22.356  -8.429  -6.967
  519    HB2  SER  74           2HB      SER  74  25.140  -9.227  -7.745
  520    HB3  SER  74           1HB      SER  74  24.068  -8.527  -8.958
  521    HG   SER  74           HG       SER  74  24.984  -6.781  -8.083
  522    H    ALA  75           H        ALA  75  21.384 -11.004  -6.531
  523    HA   ALA  75           HA       ALA  75  21.362 -12.279  -9.169
  524    HB1  ALA  75           1HB      ALA  75  19.994 -14.030  -7.790
  525    HB2  ALA  75           2HB      ALA  75  20.719 -13.204  -6.409
  526    HB3  ALA  75           3HB      ALA  75  21.750 -13.942  -7.637
  527    H    ASN  76           H        ASN  76  19.558 -12.462 -10.407
  528    HA   ASN  76           HA       ASN  76  17.206 -10.925  -9.542
  529    HB2  ASN  76           2HB      ASN  76  18.629 -10.574 -11.794
  530    HB3  ASN  76           1HB      ASN  76  17.487 -11.783 -12.375
  531   HD21  ASN  76          1HD2      ASN  76  15.534 -11.123 -12.999
  532   HD22  ASN  76          2HD2      ASN  76  14.877  -9.550 -12.722
  533    H    LYS  77           H        LYS  77  18.224 -14.032 -10.856
  534    HA   LYS  77           HA       LYS  77  16.040 -15.414  -9.711
  535    HB2  LYS  77           2HB      LYS  77  14.891 -16.135 -11.747
  536    HB3  LYS  77           1HB      LYS  77  14.800 -14.391 -11.561
  537    HG2  LYS  77           2HG      LYS  77  16.533 -14.083 -13.215
  538    HG3  LYS  77           1HG      LYS  77  16.746 -15.828 -13.353
  539    HD2  LYS  77           2HD      LYS  77  14.081 -15.587 -13.818
  540    HD3  LYS  77           1HD      LYS  77  14.684 -14.074 -14.497
  541    HE2  LYS  77           2HE      LYS  77  16.385 -15.451 -15.751
  542    HE3  LYS  77           1HE      LYS  77  15.494 -16.880 -15.229
  543    HZ1  LYS  77           3HZ      LYS  77  13.955 -14.761 -16.517
  544    HZ2  LYS  77           1HZ      LYS  77  13.791 -16.442 -16.628
  545    HZ3  LYS  77           2HZ      LYS  77  15.000 -15.651 -17.505
  546    H    GLU  78           H        GLU  78  16.290 -17.669  -9.809
  547    HA   GLU  78           HA       GLU  78  18.762 -18.583 -11.134
  548    HB2  GLU  78           2HB      GLU  78  18.686 -18.459  -8.547
  549    HB3  GLU  78           1HB      GLU  78  17.650 -19.875  -8.656
  550    HG2  GLU  78           2HG      GLU  78  19.350 -21.239  -9.156
  551    HG3  GLU  78           1HG      GLU  78  20.123 -20.061 -10.215
  552    H    LEU  79           H        LEU  79  17.741 -19.333 -12.998
  553    HA   LEU  79           HA       LEU  79  16.752 -21.971 -12.907
  554    HB2  LEU  79           2HB      LEU  79  14.472 -21.550 -13.794
  555    HB3  LEU  79           1HB      LEU  79  14.686 -21.044 -12.131
  556    HG   LEU  79           HG       LEU  79  15.023 -19.015 -14.295
  557   HD11  LEU  79          1HD1      LEU  79  12.480 -20.345 -13.515
  558   HD12  LEU  79          2HD1      LEU  79  12.990 -19.705 -15.077
  559   HD13  LEU  79          3HD1      LEU  79  12.470 -18.604 -13.801
  560   HD21  LEU  79          3HD2      LEU  79  13.751 -17.742 -12.385
  561   HD22  LEU  79          1HD2      LEU  79  15.482 -18.056 -12.270
  562   HD23  LEU  79          2HD2      LEU  79  14.342 -19.080 -11.398
  563    H    VAL  80           H        VAL  80  17.233 -22.909 -14.782
  564    HA   VAL  80           HA       VAL  80  17.726 -21.182 -17.117
  565    HB   VAL  80           HB       VAL  80  18.781 -23.986 -16.726
  566   HG11  VAL  80          1HG1      VAL  80  20.547 -22.742 -18.328
  567   HG12  VAL  80          2HG1      VAL  80  19.074 -21.875 -18.768
  568   HG13  VAL  80          3HG1      VAL  80  19.146 -23.631 -18.926
  569   HG21  VAL  80          3HG2      VAL  80  20.413 -23.277 -15.387
  570   HG22  VAL  80          1HG2      VAL  80  19.514 -21.770 -15.205
  571   HG23  VAL  80          2HG2      VAL  80  20.767 -21.906 -16.437
  572    H    LYS  81           H        LYS  81  15.079 -21.998 -16.482
  573    HA   LYS  81           HA       LYS  81  14.469 -24.173 -18.331
  574    HB2  LYS  81           2HB      LYS  81  13.395 -23.994 -16.047
  575    HB3  LYS  81           1HB      LYS  81  12.532 -22.585 -16.644
  576    HG2  LYS  81           2HG      LYS  81  11.118 -23.811 -17.909
  577    HG3  LYS  81           1HG      LYS  81  12.331 -25.038 -18.278
  578    HD2  LYS  81           2HD      LYS  81  11.276 -24.792 -15.493
  579    HD3  LYS  81           1HD      LYS  81  10.312 -25.611 -16.723
  580    HE2  LYS  81           2HE      LYS  81  12.682 -26.793 -17.152
  581    HE3  LYS  81           1HE      LYS  81  12.851 -26.423 -15.437
  582    HZ1  LYS  81           3HZ      LYS  81  11.180 -27.842 -14.870
  583    HZ2  LYS  81           1HZ      LYS  81  11.755 -28.644 -16.245
  584    HZ3  LYS  81           2HZ      LYS  81  10.364 -27.686 -16.344
  585    H    LEU  82           H        LEU  82  14.397 -23.583 -20.411
  586    HA   LEU  82           HA       LEU  82  12.892 -21.143 -21.108
  587    HB2  LEU  82           2HB      LEU  82  15.536 -21.378 -21.483
  588    HB3  LEU  82           1HB      LEU  82  14.986 -22.141 -22.963
  589    HG   LEU  82           HG       LEU  82  13.507 -19.942 -23.131
  590   HD11  LEU  82          1HD1      LEU  82  14.109 -18.903 -21.089
  591   HD12  LEU  82          2HD1      LEU  82  14.924 -18.008 -22.371
  592   HD13  LEU  82          3HD1      LEU  82  15.830 -19.157 -21.386
  593   HD21  LEU  82          3HD2      LEU  82  16.272 -20.578 -23.982
  594   HD22  LEU  82          1HD2      LEU  82  15.714 -18.921 -24.215
  595   HD23  LEU  82          2HD2      LEU  82  14.831 -20.259 -24.946
  596    H    GLU  83           H        GLU  83  11.894 -23.873 -20.854
  597    HA   GLU  83           HA       GLU  83  10.907 -24.213 -23.596
  598    HB2  GLU  83           2HB      GLU  83  12.220 -26.250 -21.851
  599    HB3  GLU  83           1HB      GLU  83  10.885 -26.770 -22.871
  600    HG2  GLU  83           2HG      GLU  83  12.370 -25.376 -24.652
  601    HG3  GLU  83           1HG      GLU  83  13.625 -25.999 -23.584
  602    H    HIS  84           H        HIS  84   9.065 -23.049 -22.815
  603    HA   HIS  84           HA       HIS  84   6.947 -22.853 -22.020
  604    HB2  HIS  84           2HB      HIS  84   7.040 -25.299 -23.139
  605    HB3  HIS  84           1HB      HIS  84   6.659 -25.759 -21.482
  606    HD1  HIS  84           1HD      HIS  84   5.326 -23.296 -24.071
  607    HD2  HIS  84           2HD      HIS  84   4.000 -25.767 -21.003
  608    HE1  HIS  84           1HE      HIS  84   2.819 -23.095 -24.080
  609    HE2  HIS  84           2HE      HIS  84   2.043 -24.553 -22.177
  Start of MODEL   18
    1    H1   MET   1           1HT      MET   1  17.434   6.188   4.705
    2    H2   MET   1           2HT      MET   1  16.490   6.364   3.284
    3    H3   MET   1           3HT      MET   1  17.127   4.829   3.707
    4    HA   MET   1           HA       MET   1  15.004   6.366   5.033
    5    HB2  MET   1           2HB      MET   1  15.241   3.851   3.436
    6    HB3  MET   1           1HB      MET   1  14.020   3.918   4.699
    7    HG2  MET   1           2HG      MET   1  12.721   5.353   3.556
    8    HG3  MET   1           1HG      MET   1  14.094   6.229   2.880
    9    HE1  MET   1           2HE      MET   1  11.760   4.822  -0.095
   10    HE2  MET   1           3HE      MET   1  12.343   6.307   0.657
   11    HE3  MET   1           1HE      MET   1  11.242   5.247   1.537
   12    H    ALA   2           H        ALA   2  15.227   6.407   7.174
   13    HA   ALA   2           HA       ALA   2  15.843   3.931   8.590
   14    HB1  ALA   2           1HB      ALA   2  17.905   5.584   8.186
   15    HB2  ALA   2           2HB      ALA   2  17.723   4.622   9.652
   16    HB3  ALA   2           3HB      ALA   2  17.239   6.318   9.645
   17    H    VAL   3           H        VAL   3  14.903   3.778  10.607
   18    HA   VAL   3           HA       VAL   3  13.389   4.158  12.258
   19    HB   VAL   3           HB       VAL   3  13.961   7.100  11.874
   20   HG11  VAL   3          1HG1      VAL   3  12.074   5.982  13.435
   21   HG12  VAL   3          2HG1      VAL   3  12.916   7.477  13.840
   22   HG13  VAL   3          3HG1      VAL   3  13.446   5.949  14.543
   23   HG21  VAL   3          3HG2      VAL   3  16.016   5.630  12.157
   24   HG22  VAL   3          1HG2      VAL   3  15.412   5.271  13.774
   25   HG23  VAL   3          2HG2      VAL   3  15.810   6.930  13.330
   26    H    PHE   4           H        PHE   4  11.706   3.403  10.872
   27    HA   PHE   4           HA       PHE   4  10.178   5.073   9.181
   28    HB2  PHE   4           2HB      PHE   4   9.808   2.370  10.395
   29    HB3  PHE   4           1HB      PHE   4   8.406   3.165   9.691
   30    HD1  PHE   4           2HD      PHE   4  11.980   3.044   8.605
   31    HD2  PHE   4           1HD      PHE   4   7.923   2.118   7.716
   32    HE1  PHE   4           2HE      PHE   4  12.652   2.250   6.375
   33    HE2  PHE   4           1HE      PHE   4   8.587   1.319   5.489
   34    HZ   PHE   4           HZ       PHE   4  10.955   1.385   4.815
   35    H    HIS   5           H        HIS   5   7.885   5.649   9.484
   36    HA   HIS   5           HA       HIS   5   7.513   6.938  12.049
   37    HB2  HIS   5           2HB      HIS   5   6.931   7.846   9.647
   38    HB3  HIS   5           1HB      HIS   5   5.426   6.968   9.898
   39    HD1  HIS   5           1HD      HIS   5   3.698   8.033  11.403
   40    HD2  HIS   5           2HD      HIS   5   7.366   9.986  11.512
   41    HE1  HIS   5           1HE      HIS   5   3.291  10.159  12.685
   42    HE2  HIS   5           2HE      HIS   5   5.520  11.336  12.718
   43    H    ASP   6           H        ASP   6   5.494   4.761  10.046
   44    HA   ASP   6           HA       ASP   6   4.747   3.215  12.362
   45    HB2  ASP   6           2HB      ASP   6   2.876   5.187  11.123
   46    HB3  ASP   6           1HB      ASP   6   2.221   3.644  11.660
   47    H    GLU   7           H        GLU   7   3.308   1.382  11.785
   48    HA   GLU   7           HA       GLU   7   3.746   0.554   8.990
   49    HB2  GLU   7           2HB      GLU   7   3.213  -1.309  11.301
   50    HB3  GLU   7           1HB      GLU   7   3.836  -1.711   9.708
   51    HG2  GLU   7           2HG      GLU   7   5.787  -0.091  10.468
   52    HG3  GLU   7           1HG      GLU   7   5.229  -0.577  12.067
   53    H    VAL   8           H        VAL   8   2.039  -0.035   7.749
   54    HA   VAL   8           HA       VAL   8  -0.583  -0.366   9.041
   55    HB   VAL   8           HB       VAL   8  -0.188   1.253   6.522
   56   HG11  VAL   8          1HG1      VAL   8  -2.427  -0.022   7.364
   57   HG12  VAL   8          2HG1      VAL   8  -2.425   1.448   6.393
   58   HG13  VAL   8          3HG1      VAL   8  -2.624   1.547   8.141
   59   HG21  VAL   8          3HG2      VAL   8   0.632   2.804   7.946
   60   HG22  VAL   8          1HG2      VAL   8  -0.092   2.044   9.362
   61   HG23  VAL   8          2HG2      VAL   8  -1.074   3.058   8.309
   62    H    GLU   9           H        GLU   9  -1.923  -1.860   8.122
   63    HA   GLU   9           HA       GLU   9  -0.772  -3.840   6.453
   64    HB2  GLU   9           2HB      GLU   9  -3.554  -3.373   7.498
   65    HB3  GLU   9           1HB      GLU   9  -3.217  -4.674   6.366
   66    HG2  GLU   9           2HG      GLU   9  -1.873  -5.814   7.883
   67    HG3  GLU   9           1HG      GLU   9  -1.647  -4.390   8.897
   68    H    ILE  10           H        ILE  10  -1.027  -4.293   4.327
   69    HA   ILE  10           HA       ILE  10  -1.451  -2.235   2.499
   70    HB   ILE  10           HB       ILE  10  -0.173  -4.297   2.010
   71   HG12  ILE  10          2HG1      ILE  10  -1.552  -4.660  -0.305
   72   HG13  ILE  10          1HG1      ILE  10  -2.217  -3.122   0.234
   73   HG21  ILE  10          1HG2      ILE  10  -1.243  -6.353   1.430
   74   HG22  ILE  10          2HG2      ILE  10  -2.843  -5.633   1.604
   75   HG23  ILE  10          3HG2      ILE  10  -1.824  -5.869   3.024
   76   HD11  ILE  10          3HD1      ILE  10  -0.153  -3.145  -1.304
   77   HD12  ILE  10          1HD1      ILE  10   0.735  -3.538   0.167
   78   HD13  ILE  10          2HD1      ILE  10  -0.189  -2.040   0.069
   79    H    GLU  11           H        GLU  11  -3.723  -4.503   3.905
   80    HA   GLU  11           HA       GLU  11  -5.830  -4.256   2.071
   81    HB2  GLU  11           2HB      GLU  11  -6.060  -4.646   5.063
   82    HB3  GLU  11           1HB      GLU  11  -7.274  -5.054   3.857
   83    HG2  GLU  11           2HG      GLU  11  -5.796  -6.745   2.918
   84    HG3  GLU  11           1HG      GLU  11  -4.550  -6.319   4.087
   85    H    ASP  12           H        ASP  12  -4.749  -2.175   4.677
   86    HA   ASP  12           HA       ASP  12  -7.057  -0.504   4.766
   87    HB2  ASP  12           2HB      ASP  12  -4.212  -0.023   5.682
   88    HB3  ASP  12           1HB      ASP  12  -5.550   1.074   5.997
   89    H    PHE  13           H        PHE  13  -4.150  -0.571   2.821
   90    HA   PHE  13           HA       PHE  13  -4.230   2.070   1.827
   91    HB2  PHE  13           2HB      PHE  13  -2.994  -0.491   0.856
   92    HB3  PHE  13           1HB      PHE  13  -2.954   0.949  -0.151
   93    HD1  PHE  13           1HD      PHE  13  -2.305   0.119   3.446
   94    HD2  PHE  13           2HD      PHE  13  -1.003   2.112  -0.082
   95    HE1  PHE  13           1HE      PHE  13  -0.293   0.896   4.630
   96    HE2  PHE  13           2HE      PHE  13   1.007   2.892   1.094
   97    HZ   PHE  13           HZ       PHE  13   1.365   2.285   3.453
   98    H    GLN  14           H        GLN  14  -4.538   2.496  -0.600
   99    HA   GLN  14           HA       GLN  14  -7.137   1.377  -1.406
  100    HB2  GLN  14           2HB      GLN  14  -6.503   3.981  -1.036
  101    HB3  GLN  14           1HB      GLN  14  -6.105   3.813  -2.740
  102    HG2  GLN  14           2HG      GLN  14  -8.692   2.663  -2.015
  103    HG3  GLN  14           1HG      GLN  14  -8.571   4.398  -1.730
  104   HE21  GLN  14          1HE2      GLN  14  -7.997   5.761  -3.524
  105   HE22  GLN  14          2HE2      GLN  14  -8.369   5.266  -5.137
  106    H    TYR  15           H        TYR  15  -6.895  -0.220  -2.853
  107    HA   TYR  15           HA       TYR  15  -4.624  -0.524  -4.515
  108    HB2  TYR  15           2HB      TYR  15  -6.014  -2.437  -3.843
  109    HB3  TYR  15           1HB      TYR  15  -7.363  -1.790  -4.771
  110    HD1  TYR  15           1HD      TYR  15  -3.845  -2.961  -5.166
  111    HD2  TYR  15           2HD      TYR  15  -7.652  -2.436  -6.988
  112    HE1  TYR  15           1HE      TYR  15  -3.056  -4.184  -7.147
  113    HE2  TYR  15           2HE      TYR  15  -6.877  -3.658  -8.975
  114    HH   TYR  15           HH       TYR  15  -5.033  -5.453  -9.431
  115    H    ASP  16           H        ASP  16  -4.111   0.597  -6.261
  116    HA   ASP  16           HA       ASP  16  -6.220   2.016  -7.724
  117    HB2  ASP  16           2HB      ASP  16  -3.325   2.505  -7.230
  118    HB3  ASP  16           1HB      ASP  16  -3.978   3.051  -8.768
  119    H    GLU  17           H        GLU  17  -6.998   0.376  -9.025
  120    HA   GLU  17           HA       GLU  17  -5.536  -1.492 -10.476
  121    HB2  GLU  17           2HB      GLU  17  -7.556  -1.557 -11.994
  122    HB3  GLU  17           1HB      GLU  17  -7.869  -1.825 -10.287
  123    HG2  GLU  17           2HG      GLU  17  -8.813   0.318 -10.021
  124    HG3  GLU  17           1HG      GLU  17  -8.199   0.867 -11.579
  125    H    ASP  18           H        ASP  18  -6.146   1.875 -11.198
  126    HA   ASP  18           HA       ASP  18  -5.776   2.041 -13.904
  127    HB2  ASP  18           2HB      ASP  18  -4.857   4.313 -13.506
  128    HB3  ASP  18           1HB      ASP  18  -6.314   3.983 -12.574
  129    H    SER  19           H        SER  19  -3.276   1.615 -11.436
  130    HA   SER  19           HA       SER  19  -1.441   0.688 -13.487
  131    HB2  SER  19           2HB      SER  19  -1.129   3.210 -13.234
  132    HB3  SER  19           1HB      SER  19  -0.502   2.868 -11.622
  133    HG   SER  19           HG       SER  19   1.322   2.446 -12.554
  134    H    GLU  20           H        GLU  20  -2.846  -0.463 -11.132
  135    HA   GLU  20           HA       GLU  20  -2.472  -1.776  -9.296
  136    HB2  GLU  20           2HB      GLU  20   0.107  -2.384 -10.741
  137    HB3  GLU  20           1HB      GLU  20  -0.736  -3.427  -9.603
  138    HG2  GLU  20           2HG      GLU  20  -2.316  -4.049 -11.132
  139    HG3  GLU  20           1HG      GLU  20  -2.186  -2.546 -12.043
  140    H    THR  21           H        THR  21  -2.156   0.366  -8.110
  141    HA   THR  21           HA       THR  21   0.407   0.241  -6.683
  142    HB   THR  21           HB       THR  21  -0.886   2.821  -7.607
  143    HG1  THR  21           1HG      THR  21   0.097   2.030  -9.373
  144   HG21  THR  21          3HG2      THR  21   1.133   3.916  -6.848
  145   HG22  THR  21          1HG2      THR  21   1.768   2.379  -6.263
  146   HG23  THR  21          2HG2      THR  21   0.339   3.086  -5.510
  147    H    TYR  22           H        TYR  22   0.334   1.110  -4.510
  148    HA   TYR  22           HA       TYR  22  -2.407   1.240  -3.420
  149    HB2  TYR  22           2HB      TYR  22   0.081   0.167  -2.068
  150    HB3  TYR  22           1HB      TYR  22  -1.517   0.270  -1.338
  151    HD1  TYR  22           1HD      TYR  22   0.314  -1.285  -4.183
  152    HD2  TYR  22           2HD      TYR  22  -3.017  -1.504  -1.546
  153    HE1  TYR  22           1HE      TYR  22  -0.222  -3.518  -5.054
  154    HE2  TYR  22           2HE      TYR  22  -3.561  -3.738  -2.410
  155    HH   TYR  22           HH       TYR  22  -1.850  -5.675  -3.684
  156    H    PHE  23           H        PHE  23  -2.917   2.870  -2.010
  157    HA   PHE  23           HA       PHE  23  -0.775   4.760  -1.290
  158    HB2  PHE  23           2HB      PHE  23  -3.533   5.558  -2.251
  159    HB3  PHE  23           1HB      PHE  23  -2.234   6.649  -1.788
  160    HD1  PHE  23           1HD      PHE  23  -2.991   3.911  -4.195
  161    HD2  PHE  23           2HD      PHE  23  -0.841   7.505  -3.429
  162    HE1  PHE  23           1HE      PHE  23  -2.176   3.915  -6.511
  163    HE2  PHE  23           2HE      PHE  23  -0.026   7.513  -5.749
  164    HZ   PHE  23           HZ       PHE  23  -0.691   5.715  -7.294
  165    H    TYR  24           H        TYR  24  -1.146   6.030   0.605
  166    HA   TYR  24           HA       TYR  24  -3.345   5.102   2.325
  167    HB2  TYR  24           2HB      TYR  24  -1.099   3.984   2.837
  168    HB3  TYR  24           1HB      TYR  24  -0.566   5.565   3.397
  169    HD1  TYR  24           2HD      TYR  24  -3.561   3.363   3.852
  170    HD2  TYR  24           1HD      TYR  24  -0.649   5.870   5.680
  171    HE1  TYR  24           2HE      TYR  24  -4.563   2.914   6.050
  172    HE2  TYR  24           1HE      TYR  24  -1.644   5.425   7.884
  173    HH   TYR  24           HH       TYR  24  -4.661   4.089   8.309
  174    HA   PRO  25           HA       PRO  25  -4.094   9.448   2.840
  175    HB2  PRO  25           2HB      PRO  25  -5.224   8.642   5.463
  176    HB3  PRO  25           1HB      PRO  25  -5.973   9.546   4.142
  177    HG2  PRO  25           2HG      PRO  25  -6.641   7.008   4.610
  178    HG3  PRO  25           1HG      PRO  25  -6.505   7.630   2.954
  179    HD2  PRO  25           2HD      PRO  25  -4.594   5.923   4.501
  180    HD3  PRO  25           1HD      PRO  25  -5.050   5.839   2.787
  181    H    CYS  26           H        CYS  26  -2.626  10.902   3.432
  182    HA   CYS  26           HA       CYS  26  -0.950  10.384   5.779
  183    HB2  CYS  26           2HB      CYS  26  -0.328  11.275   3.223
  184    HB3  CYS  26           1HB      CYS  26  -0.262  12.740   4.199
  185    HA   PRO  27           HA       PRO  27  -3.041  13.465   8.177
  186    HB2  PRO  27           2HB      PRO  27  -1.036  14.157   9.880
  187    HB3  PRO  27           1HB      PRO  27  -1.940  12.645  10.012
  188    HG2  PRO  27           2HG      PRO  27   0.751  13.144   8.801
  189    HG3  PRO  27           1HG      PRO  27   0.220  11.807   9.835
  190    HD2  PRO  27           2HD      PRO  27   0.445  11.565   7.152
  191    HD3  PRO  27           1HD      PRO  27  -0.784  10.687   8.087
  192    H    CYS  28           H        CYS  28  -0.195  14.192   6.331
  193    HA   CYS  28           HA       CYS  28  -0.144  16.997   6.941
  194    HB2  CYS  28           2HB      CYS  28   1.532  17.151   5.164
  195    HB3  CYS  28           1HB      CYS  28   1.894  15.813   6.249
  196    H    GLY  29           H        GLY  29  -1.627  14.975   4.476
  197    HA2  GLY  29           2HA      GLY  29  -3.761  16.373   3.768
  198    HA3  GLY  29           1HA      GLY  29  -2.516  17.304   2.951
  199    H    ASP  30           H        ASP  30  -0.825  15.374   2.040
  200    HA   ASP  30           HA       ASP  30  -2.316  14.288  -0.177
  201    HB2  ASP  30           2HB      ASP  30   0.226  15.247   0.109
  202    HB3  ASP  30           1HB      ASP  30   0.517  13.512   0.148
  203    H    ASN  31           H        ASN  31  -1.039  11.932  -0.776
  204    HA   ASN  31           HA       ASN  31  -1.468  10.178   1.537
  205    HB2  ASN  31           2HB      ASN  31  -2.552   9.551  -1.216
  206    HB3  ASN  31           1HB      ASN  31  -2.800   8.630   0.262
  207   HD21  ASN  31          1HD2      ASN  31  -4.494  10.279  -1.780
  208   HD22  ASN  31          2HD2      ASN  31  -5.577  11.143  -0.746
  209    H    PHE  32           H        PHE  32  -0.178   8.380   1.620
  210    HA   PHE  32           HA       PHE  32   2.288   8.434   0.258
  211    HB2  PHE  32           2HB      PHE  32   0.913   6.442   2.029
  212    HB3  PHE  32           1HB      PHE  32   2.401   5.993   1.205
  213    HD1  PHE  32           2HD      PHE  32   4.428   7.540   1.544
  214    HD2  PHE  32           1HD      PHE  32   0.998   7.562   4.065
  215    HE1  PHE  32           2HE      PHE  32   5.751   8.598   3.328
  216    HE2  PHE  32           1HE      PHE  32   2.317   8.621   5.852
  217    HZ   PHE  32           HZ       PHE  32   4.697   9.139   5.485
  218    H    SER  33           H        SER  33   3.158   6.460  -0.973
  219    HA   SER  33           HA       SER  33   1.178   5.105  -2.618
  220    HB2  SER  33           2HB      SER  33   2.214   5.862  -4.736
  221    HB3  SER  33           1HB      SER  33   1.508   7.199  -3.829
  222    HG   SER  33           HG       SER  33   3.573   7.775  -3.143
  223    H    ILE  34           H        ILE  34   1.853   3.170  -3.394
  224    HA   ILE  34           HA       ILE  34   4.663   2.477  -3.500
  225    HB   ILE  34           HB       ILE  34   4.164   1.997  -1.157
  226   HG12  ILE  34          2HG1      ILE  34   4.236  -0.691  -2.486
  227   HG13  ILE  34          1HG1      ILE  34   5.564   0.441  -2.726
  228   HG21  ILE  34          1HG2      ILE  34   2.337   0.909  -0.394
  229   HG22  ILE  34          2HG2      ILE  34   2.290  -0.199  -1.765
  230   HG23  ILE  34          3HG2      ILE  34   1.648   1.435  -1.930
  231   HD11  ILE  34          3HD1      ILE  34   6.368   0.120  -0.668
  232   HD12  ILE  34          1HD1      ILE  34   5.420  -1.365  -0.726
  233   HD13  ILE  34          2HD1      ILE  34   4.763   0.067   0.064
  234    H    THR  35           H        THR  35   4.976   1.276  -5.269
  235    HA   THR  35           HA       THR  35   2.778   0.316  -6.817
  236    HB   THR  35           HB       THR  35   4.744  -0.747  -8.167
  237    HG1  THR  35           1HG      THR  35   6.739   0.064  -7.685
  238   HG21  THR  35          3HG2      THR  35   4.388   1.009  -9.452
  239   HG22  THR  35          1HG2      THR  35   5.434   1.975  -8.413
  240   HG23  THR  35          2HG2      THR  35   3.702   1.896  -8.090
  241    H    LYS  36           H        LYS  36   2.240  -1.816  -7.376
  242    HA   LYS  36           HA       LYS  36   2.258  -3.704  -5.301
  243    HB2  LYS  36           2HB      LYS  36   0.567  -3.695  -7.078
  244    HB3  LYS  36           1HB      LYS  36   1.789  -4.145  -8.258
  245    HG2  LYS  36           2HG      LYS  36   1.010  -6.217  -7.884
  246    HG3  LYS  36           1HG      LYS  36   2.084  -6.155  -6.486
  247    HD2  LYS  36           2HD      LYS  36   0.312  -5.639  -5.019
  248    HD3  LYS  36           1HD      LYS  36  -0.777  -5.246  -6.350
  249    HE2  LYS  36           2HE      LYS  36  -0.314  -7.755  -7.017
  250    HE3  LYS  36           1HE      LYS  36   0.074  -7.903  -5.304
  251    HZ1  LYS  36           3HZ      LYS  36  -2.391  -6.498  -5.828
  252    HZ2  LYS  36           1HZ      LYS  36  -2.067  -7.749  -4.735
  253    HZ3  LYS  36           2HZ      LYS  36  -2.401  -8.106  -6.352
  254    H    GLU  37           H        GLU  37   4.362  -3.330  -8.116
  255    HA   GLU  37           HA       GLU  37   5.725  -5.774  -7.945
  256    HB2  GLU  37           2HB      GLU  37   5.784  -3.955  -9.793
  257    HB3  GLU  37           1HB      GLU  37   7.067  -3.235  -8.829
  258    HG2  GLU  37           2HG      GLU  37   8.245  -5.457  -8.947
  259    HG3  GLU  37           1HG      GLU  37   7.042  -5.935 -10.142
  260    H    ASP  38           H        ASP  38   6.275  -2.676  -6.324
  261    HA   ASP  38           HA       ASP  38   8.776  -3.179  -5.189
  262    HB2  ASP  38           2HB      ASP  38   6.492  -1.385  -4.543
  263    HB3  ASP  38           1HB      ASP  38   7.657  -1.670  -3.258
  264    H    LEU  39           H        LEU  39   5.533  -3.846  -3.911
  265    HA   LEU  39           HA       LEU  39   6.315  -4.939  -1.452
  266    HB2  LEU  39           2HB      LEU  39   3.909  -5.756  -3.075
  267    HB3  LEU  39           1HB      LEU  39   4.109  -5.903  -1.340
  268    HG   LEU  39           HG       LEU  39   4.159  -3.208  -2.661
  269   HD11  LEU  39          1HD1      LEU  39   2.119  -4.371  -3.396
  270   HD12  LEU  39          2HD1      LEU  39   1.778  -3.007  -2.331
  271   HD13  LEU  39          3HD1      LEU  39   1.694  -4.655  -1.708
  272   HD21  LEU  39          3HD2      LEU  39   3.640  -2.385  -0.523
  273   HD22  LEU  39          1HD2      LEU  39   4.863  -3.627  -0.249
  274   HD23  LEU  39          2HD2      LEU  39   3.164  -3.976   0.069
  275    H    GLU  40           H        GLU  40   5.684  -6.537  -4.582
  276    HA   GLU  40           HA       GLU  40   6.119  -9.171  -3.722
  277    HB2  GLU  40           2HB      GLU  40   6.502  -7.901  -6.430
  278    HB3  GLU  40           1HB      GLU  40   6.647  -9.629  -6.142
  279    HG2  GLU  40           2HG      GLU  40   4.291  -9.509  -5.198
  280    HG3  GLU  40           1HG      GLU  40   4.209  -7.902  -5.919
  281    H    ASN  41           H        ASN  41   8.390  -6.632  -4.502
  282    HA   ASN  41           HA       ASN  41  10.646  -8.458  -4.635
  283    HB2  ASN  41           2HB      ASN  41  10.217  -5.555  -5.118
  284    HB3  ASN  41           1HB      ASN  41  11.833  -6.065  -4.643
  285   HD21  ASN  41          1HD2      ASN  41   9.466  -6.030  -7.121
  286   HD22  ASN  41          2HD2      ASN  41  10.419  -6.785  -8.346
  287    H    GLY  42           H        GLY  42   9.302  -6.066  -2.411
  288    HA2  GLY  42           2HA      GLY  42   9.770  -6.864  -0.013
  289    HA3  GLY  42           1HA      GLY  42  11.450  -6.661  -0.485
  290    H    GLU  43           H        GLU  43   9.938  -4.277  -2.134
  291    HA   GLU  43           HA       GLU  43  10.791  -2.231  -0.318
  292    HB2  GLU  43           2HB      GLU  43   9.549  -2.270  -3.051
  293    HB3  GLU  43           1HB      GLU  43   9.586  -0.768  -2.137
  294    HG2  GLU  43           2HG      GLU  43  11.961  -2.432  -2.930
  295    HG3  GLU  43           1HG      GLU  43  11.466  -0.895  -3.642
  296    H    ASP  44           H        ASP  44   9.430  -2.850   1.462
  297    HA   ASP  44           HA       ASP  44   6.564  -2.345   1.226
  298    HB2  ASP  44           2HB      ASP  44   8.077  -3.102   3.731
  299    HB3  ASP  44           1HB      ASP  44   6.359  -3.283   3.415
  300    H    VAL  45           H        VAL  45   8.306  -0.096   0.830
  301    HA   VAL  45           HA       VAL  45   7.616   1.537   3.181
  302    HB   VAL  45           HB       VAL  45  10.043   1.227   3.090
  303   HG11  VAL  45          1HG1      VAL  45   9.930   2.568   0.389
  304   HG12  VAL  45          2HG1      VAL  45  10.255   0.857   0.664
  305   HG13  VAL  45          3HG1      VAL  45  11.385   2.075   1.254
  306   HG21  VAL  45          3HG2      VAL  45  10.705   3.612   3.083
  307   HG22  VAL  45          1HG2      VAL  45   9.221   3.313   3.989
  308   HG23  VAL  45          2HG2      VAL  45   9.142   4.016   2.374
  309    H    ALA  46           H        ALA  46   6.452   3.318   2.822
  310    HA   ALA  46           HA       ALA  46   6.060   4.168   0.026
  311    HB1  ALA  46           1HB      ALA  46   4.045   5.039   1.966
  312    HB2  ALA  46           2HB      ALA  46   4.137   3.291   1.749
  313    HB3  ALA  46           3HB      ALA  46   3.850   4.338   0.360
  314    H    THR  47           H        THR  47   6.546   6.212  -0.513
  315    HA   THR  47           HA       THR  47   7.249   8.061   1.670
  316    HB   THR  47           HB       THR  47   8.389   8.125  -1.127
  317    HG1  THR  47           1HG      THR  47   9.355   6.819   1.192
  318   HG21  THR  47          3HG2      THR  47   9.768   9.766  -0.471
  319   HG22  THR  47          1HG2      THR  47   9.939   9.119   1.160
  320   HG23  THR  47          2HG2      THR  47   8.518  10.070   0.734
  321    H    CYS  48           H        CYS  48   6.236   9.946   1.778
  322    HA   CYS  48           HA       CYS  48   4.228  10.574  -0.240
  323    HB2  CYS  48           2HB      CYS  48   3.616  10.554   2.173
  324    HB3  CYS  48           1HB      CYS  48   4.743  11.879   2.445
  325    HA   PRO  49           HA       PRO  49   7.104  13.429  -2.194
  326    HB2  PRO  49           2HB      PRO  49   4.557  14.440  -3.348
  327    HB3  PRO  49           1HB      PRO  49   6.050  13.962  -4.163
  328    HG2  PRO  49           2HG      PRO  49   3.912  12.384  -4.228
  329    HG3  PRO  49           1HG      PRO  49   5.538  11.699  -4.054
  330    HD2  PRO  49           2HD      PRO  49   3.412  12.094  -1.988
  331    HD3  PRO  49           1HD      PRO  49   4.558  10.751  -2.189
  332    H    SER  50           H        SER  50   4.337  14.273  -0.247
  333    HA   SER  50           HA       SER  50   4.867  17.109  -0.295
  334    HB2  SER  50           2HB      SER  50   2.926  15.388   1.251
  335    HB3  SER  50           1HB      SER  50   3.086  17.122   1.538
  336    HG   SER  50           HG       SER  50   2.145  15.768  -0.739
  337    H    CYS  51           H        CYS  51   4.559  14.976   2.562
  338    HA   CYS  51           HA       CYS  51   6.366  16.628   4.060
  339    HB2  CYS  51           2HB      CYS  51   6.033  14.929   5.860
  340    HB3  CYS  51           1HB      CYS  51   4.534  15.610   5.238
  341    H    SER  52           H        SER  52   6.683  13.734   2.164
  342    HA   SER  52           HA       SER  52   8.485  12.506   1.536
  343    HB2  SER  52           2HB      SER  52   9.503  15.004   1.766
  344    HB3  SER  52           1HB      SER  52  10.488  14.160   2.960
  345    HG   SER  52           HG       SER  52  10.134  13.370   0.253
  346    H    LEU  53           H        LEU  53   7.081  11.783   3.819
  347    HA   LEU  53           HA       LEU  53   9.080  10.948   5.779
  348    HB2  LEU  53           2HB      LEU  53   6.186  11.393   5.783
  349    HB3  LEU  53           1HB      LEU  53   6.658   9.917   6.602
  350    HG   LEU  53           HG       LEU  53   8.185  11.227   8.045
  351   HD11  LEU  53          1HD1      LEU  53   8.546  13.448   7.852
  352   HD12  LEU  53          2HD1      LEU  53   6.909  13.779   7.286
  353   HD13  LEU  53          3HD1      LEU  53   8.118  13.149   6.169
  354   HD21  LEU  53          3HD2      LEU  53   5.726  10.723   8.540
  355   HD22  LEU  53          1HD2      LEU  53   5.437  12.423   8.170
  356   HD23  LEU  53          2HD2      LEU  53   6.514  11.978   9.495
  357    H    ILE  54           H        ILE  54   8.364   8.608   6.709
  358    HA   ILE  54           HA       ILE  54   8.157   6.787   4.404
  359    HB   ILE  54           HB       ILE  54   9.755   5.265   5.653
  360   HG12  ILE  54          2HG1      ILE  54  10.408   7.835   7.118
  361   HG13  ILE  54          1HG1      ILE  54   9.628   6.429   7.833
  362   HG21  ILE  54          1HG2      ILE  54  10.714   6.128   3.766
  363   HG22  ILE  54          2HG2      ILE  54  11.776   6.821   4.990
  364   HG23  ILE  54          3HG2      ILE  54  10.493   7.800   4.280
  365   HD11  ILE  54          3HD1      ILE  54  11.811   6.162   8.490
  366   HD12  ILE  54          1HD1      ILE  54  12.456   6.792   6.976
  367   HD13  ILE  54          2HD1      ILE  54  11.754   5.176   7.030
  368    H    ILE  55           H        ILE  55   7.048   4.890   4.719
  369    HA   ILE  55           HA       ILE  55   6.022   4.261   7.383
  370    HB   ILE  55           HB       ILE  55   3.723   3.921   6.496
  371   HG12  ILE  55          2HG1      ILE  55   4.234   5.759   4.222
  372   HG13  ILE  55          1HG1      ILE  55   4.791   4.102   4.025
  373   HG21  ILE  55          1HG2      ILE  55   4.778   6.740   6.349
  374   HG22  ILE  55          2HG2      ILE  55   4.233   5.894   7.797
  375   HG23  ILE  55          3HG2      ILE  55   3.081   6.291   6.522
  376   HD11  ILE  55          3HD1      ILE  55   2.732   3.690   3.295
  377   HD12  ILE  55          1HD1      ILE  55   2.097   5.190   3.969
  378   HD13  ILE  55          2HD1      ILE  55   2.253   3.763   4.991
  379    H    LYS  56           H        LYS  56   5.473   2.087   7.679
  380    HA   LYS  56           HA       LYS  56   6.559   0.296   5.645
  381    HB2  LYS  56           2HB      LYS  56   7.293   0.076   8.015
  382    HB3  LYS  56           1HB      LYS  56   5.644  -0.351   8.452
  383    HG2  LYS  56           2HG      LYS  56   6.428  -2.446   8.225
  384    HG3  LYS  56           1HG      LYS  56   6.078  -2.163   6.520
  385    HD2  LYS  56           2HD      LYS  56   8.361  -1.594   6.077
  386    HD3  LYS  56           1HD      LYS  56   8.750  -1.614   7.798
  387    HE2  LYS  56           2HE      LYS  56   7.591  -4.089   6.664
  388    HE3  LYS  56           1HE      LYS  56   9.231  -3.681   6.159
  389    HZ1  LYS  56           3HZ      LYS  56   9.348  -5.055   8.088
  390    HZ2  LYS  56           1HZ      LYS  56   8.264  -4.073   8.940
  391    HZ3  LYS  56           2HZ      LYS  56   9.806  -3.493   8.550
  392    H    VAL  57           H        VAL  57   5.475  -1.162   4.536
  393    HA   VAL  57           HA       VAL  57   2.554  -1.172   4.850
  394    HB   VAL  57           HB       VAL  57   3.743  -2.216   2.339
  395   HG11  VAL  57          1HG1      VAL  57   1.827  -0.903   1.418
  396   HG12  VAL  57          2HG1      VAL  57   1.418  -0.458   3.074
  397   HG13  VAL  57          3HG1      VAL  57   1.369  -2.150   2.578
  398   HG21  VAL  57          3HG2      VAL  57   3.626   0.371   1.631
  399   HG22  VAL  57          1HG2      VAL  57   5.115  -0.417   2.148
  400   HG23  VAL  57          2HG2      VAL  57   4.189   0.555   3.291
  401    H    ILE  58           H        ILE  58   1.827  -2.915   5.854
  402    HA   ILE  58           HA       ILE  58   3.321  -5.415   5.751
  403    HB   ILE  58           HB       ILE  58   0.787  -4.860   7.298
  404   HG12  ILE  58          2HG1      ILE  58   2.545  -3.252   7.940
  405   HG13  ILE  58          1HG1      ILE  58   2.204  -4.392   9.236
  406   HG21  ILE  58          1HG2      ILE  58   2.088  -6.694   8.738
  407   HG22  ILE  58          2HG2      ILE  58   2.706  -7.107   7.139
  408   HG23  ILE  58          3HG2      ILE  58   0.969  -7.114   7.442
  409   HD11  ILE  58          3HD1      ILE  58   4.263  -5.597   7.864
  410   HD12  ILE  58          1HD1      ILE  58   4.403  -4.669   9.358
  411   HD13  ILE  58          2HD1      ILE  58   4.671  -3.883   7.802
  412    H    TYR  59           H        TYR  59   2.690  -7.201   4.682
  413    HA   TYR  59           HA       TYR  59  -0.022  -7.493   3.690
  414    HB2  TYR  59           2HB      TYR  59   0.752  -7.808   1.333
  415    HB3  TYR  59           1HB      TYR  59   0.960  -6.157   1.913
  416    HD1  TYR  59           2HD      TYR  59   2.790  -9.354   1.441
  417    HD2  TYR  59           1HD      TYR  59   3.061  -5.123   1.790
  418    HE1  TYR  59           2HE      TYR  59   5.177  -9.470   0.890
  419    HE2  TYR  59           1HE      TYR  59   5.455  -5.221   1.239
  420    HH   TYR  59           HH       TYR  59   7.292  -6.838   1.297
  421    H    ASP  60           H        ASP  60   0.081  -9.596   2.108
  422    HA   ASP  60           HA       ASP  60   1.242 -11.670   3.789
  423    HB2  ASP  60           2HB      ASP  60  -1.179 -11.553   2.614
  424    HB3  ASP  60           1HB      ASP  60  -0.294 -12.410   1.356
  425    H    LYS  61           H        LYS  61   3.369 -11.924   3.375
  426    HA   LYS  61           HA       LYS  61   4.624 -11.600   0.885
  427    HB2  LYS  61           2HB      LYS  61   5.475 -13.216   3.292
  428    HB3  LYS  61           1HB      LYS  61   6.504 -12.909   1.900
  429    HG2  LYS  61           2HG      LYS  61   5.321 -10.508   3.096
  430    HG3  LYS  61           1HG      LYS  61   6.432 -11.392   4.143
  431    HD2  LYS  61           2HD      LYS  61   8.080 -11.364   2.240
  432    HD3  LYS  61           1HD      LYS  61   6.988 -10.257   1.406
  433    HE2  LYS  61           2HE      LYS  61   7.281  -8.576   3.017
  434    HE3  LYS  61           1HE      LYS  61   7.980  -9.699   4.183
  435    HZ1  LYS  61           3HZ      LYS  61   9.230  -8.357   1.915
  436    HZ2  LYS  61           1HZ      LYS  61   9.753  -9.931   2.253
  437    HZ3  LYS  61           2HZ      LYS  61   9.867  -8.729   3.437
  438    H    ASP  62           H        ASP  62   2.997 -14.356   2.316
  439    HA   ASP  62           HA       ASP  62   4.004 -16.355   0.590
  440    HB2  ASP  62           2HB      ASP  62   2.457 -16.419   2.797
  441    HB3  ASP  62           1HB      ASP  62   1.217 -16.633   1.565
  442    H    GLN  63           H        GLN  63   1.372 -14.042   0.277
  443    HA   GLN  63           HA       GLN  63   0.355 -15.257  -2.144
  444    HB2  GLN  63           2HB      GLN  63  -0.315 -12.722  -0.658
  445    HB3  GLN  63           1HB      GLN  63  -1.048 -13.127  -2.204
  446    HG2  GLN  63           2HG      GLN  63  -1.498 -15.409  -0.842
  447    HG3  GLN  63           1HG      GLN  63  -1.528 -14.237   0.473
  448   HE21  GLN  63          1HE2      GLN  63  -3.723 -15.798  -0.465
  449   HE22  GLN  63          2HE2      GLN  63  -4.925 -14.700  -1.046
  450    H    PHE  64           H        PHE  64   2.251 -12.389  -1.262
  451    HA   PHE  64           HA       PHE  64   2.453 -11.400  -3.932
  452    HB2  PHE  64           2HB      PHE  64   3.772 -10.729  -1.326
  453    HB3  PHE  64           1HB      PHE  64   4.454 -10.099  -2.821
  454    HD1  PHE  64           2HD      PHE  64   1.343 -10.208  -0.800
  455    HD2  PHE  64           1HD      PHE  64   3.536  -8.216  -3.856
  456    HE1  PHE  64           2HE      PHE  64  -0.290  -8.370  -0.770
  457    HE2  PHE  64           1HE      PHE  64   1.908  -6.375  -3.828
  458    HZ   PHE  64           HZ       PHE  64  -0.009  -6.449  -2.285
  459    H    VAL  65           H        VAL  65   5.169 -12.453  -1.855
  460    HA   VAL  65           HA       VAL  65   6.369 -13.692  -4.242
  461    HB   VAL  65           HB       VAL  65   7.614 -11.733  -3.504
  462   HG11  VAL  65          1HG1      VAL  65   6.954 -12.463  -0.953
  463   HG12  VAL  65          2HG1      VAL  65   8.146 -11.239  -1.389
  464   HG13  VAL  65          3HG1      VAL  65   8.664 -12.887  -1.036
  465   HG21  VAL  65          3HG2      VAL  65   9.753 -13.304  -2.742
  466   HG22  VAL  65          1HG2      VAL  65   9.276 -12.922  -4.395
  467   HG23  VAL  65          2HG2      VAL  65   8.721 -14.414  -3.639
  468    H    SER  66           H        SER  66   5.631 -15.765  -3.958
  469    HA   SER  66           HA       SER  66   6.248 -17.127  -1.436
  470    HB2  SER  66           2HB      SER  66   3.960 -17.184  -2.870
  471    HB3  SER  66           1HB      SER  66   4.785 -18.575  -3.569
  472    HG   SER  66           HG       SER  66   4.463 -19.639  -1.786
  473    H    GLY  67           H        GLY  67   8.425 -16.493  -3.202
  474    HA2  GLY  67           2HA      GLY  67  10.336 -17.527  -3.966
  475    HA3  GLY  67           1HA      GLY  67   9.678 -19.044  -3.369
  476    H    GLU  68           H        GLU  68   8.153 -20.195  -4.732
  477    HA   GLU  68           HA       GLU  68   8.724 -19.778  -7.587
  478    HB2  GLU  68           2HB      GLU  68   8.096 -22.181  -5.923
  479    HB3  GLU  68           1HB      GLU  68   7.646 -22.197  -7.623
  480    HG2  GLU  68           2HG      GLU  68   9.869 -22.002  -8.330
  481    HG3  GLU  68           1HG      GLU  68  10.424 -21.524  -6.726
  482    H    THR  69           H        THR  69   6.773 -18.152  -6.266
  483    HA   THR  69           HA       THR  69   4.145 -19.122  -6.656
  484    HB   THR  69           HB       THR  69   4.671 -17.255  -5.144
  485    HG1  THR  69           1HG      THR  69   2.809 -16.262  -5.528
  486   HG21  THR  69          3HG2      THR  69   6.330 -16.130  -6.710
  487   HG22  THR  69          1HG2      THR  69   5.220 -15.088  -5.822
  488   HG23  THR  69          2HG2      THR  69   4.923 -15.446  -7.522
  489    H    VAL  70           H        VAL  70   3.464 -19.793  -8.582
  490    HA   VAL  70           HA       VAL  70   3.489 -17.921 -10.819
  491    HB   VAL  70           HB       VAL  70   4.443 -20.761 -11.205
  492   HG11  VAL  70          1HG1      VAL  70   3.390 -19.775 -13.157
  493   HG12  VAL  70          2HG1      VAL  70   5.126 -19.943 -13.418
  494   HG13  VAL  70          3HG1      VAL  70   4.442 -18.364 -13.034
  495   HG21  VAL  70          3HG2      VAL  70   6.690 -19.774 -11.580
  496   HG22  VAL  70          1HG2      VAL  70   6.132 -19.632  -9.915
  497   HG23  VAL  70          2HG2      VAL  70   6.074 -18.233 -10.986
  498    HA   PRO  71           HA       PRO  71  -0.680 -19.376 -11.298
  499    HB2  PRO  71           2HB      PRO  71  -0.235 -18.904 -14.198
  500    HB3  PRO  71           1HB      PRO  71  -1.483 -18.251 -13.133
  501    HG2  PRO  71           2HG      PRO  71   0.537 -16.728 -13.959
  502    HG3  PRO  71           1HG      PRO  71  -0.088 -16.593 -12.303
  503    HD2  PRO  71           2HD      PRO  71   2.391 -17.945 -13.292
  504    HD3  PRO  71           1HD      PRO  71   2.140 -16.989 -11.817
  505    H    ALA  72           H        ALA  72  -1.968 -20.858 -12.831
  506    HA   ALA  72           HA       ALA  72  -0.813 -23.427 -12.791
  507    HB1  ALA  72           1HB      ALA  72  -2.905 -23.850 -14.383
  508    HB2  ALA  72           2HB      ALA  72  -3.364 -22.266 -13.753
  509    HB3  ALA  72           3HB      ALA  72  -3.069 -23.606 -12.644
  510    HA   PRO  73           HA       PRO  73   1.292 -23.839 -16.643
  511    HB2  PRO  73           2HB      PRO  73   0.698 -26.391 -17.368
  512    HB3  PRO  73           1HB      PRO  73   1.808 -25.997 -16.050
  513    HG2  PRO  73           2HG      PRO  73  -1.077 -26.787 -15.927
  514    HG3  PRO  73           1HG      PRO  73   0.275 -27.327 -14.914
  515    HD2  PRO  73           2HD      PRO  73  -1.483 -25.449 -14.091
  516    HD3  PRO  73           1HD      PRO  73   0.225 -25.421 -13.612
  517    H    SER  74           H        SER  74   0.874 -23.124 -18.635
  518    HA   SER  74           HA       SER  74  -1.264 -24.154 -20.233
  519    HB2  SER  74           2HB      SER  74  -2.115 -22.181 -18.588
  520    HB3  SER  74           1HB      SER  74  -1.562 -21.219 -19.958
  521    HG   SER  74           HG       SER  74  -3.645 -21.733 -20.409
  522    H    ALA  75           H        ALA  75   1.543 -24.037 -20.549
  523    HA   ALA  75           HA       ALA  75   1.718 -22.335 -22.943
  524    HB1  ALA  75           1HB      ALA  75   3.081 -21.077 -21.601
  525    HB2  ALA  75           2HB      ALA  75   4.258 -22.214 -22.260
  526    HB3  ALA  75           3HB      ALA  75   3.602 -22.460 -20.640
  527    H    ASN  76           H        ASN  76   3.915 -24.646 -21.343
  528    HA   ASN  76           HA       ASN  76   4.934 -26.546 -22.044
  529    HB2  ASN  76           2HB      ASN  76   2.352 -27.004 -22.518
  530    HB3  ASN  76           1HB      ASN  76   2.920 -27.038 -24.183
  531   HD21  ASN  76          1HD2      ASN  76   1.863 -29.280 -23.365
  532   HD22  ASN  76          2HD2      ASN  76   3.055 -30.477 -23.007
  533    H    LYS  77           H        LYS  77   6.821 -26.025 -22.981
  534    HA   LYS  77           HA       LYS  77   6.795 -25.491 -25.879
  535    HB2  LYS  77           2HB      LYS  77   8.703 -24.264 -23.884
  536    HB3  LYS  77           1HB      LYS  77   8.656 -23.954 -25.613
  537    HG2  LYS  77           2HG      LYS  77   6.910 -22.533 -25.453
  538    HG3  LYS  77           1HG      LYS  77   6.159 -23.427 -24.131
  539    HD2  LYS  77           2HD      LYS  77   8.659 -21.782 -23.806
  540    HD3  LYS  77           1HD      LYS  77   7.038 -21.139 -23.540
  541    HE2  LYS  77           2HE      LYS  77   6.683 -22.985 -21.877
  542    HE3  LYS  77           1HE      LYS  77   8.390 -23.386 -22.054
  543    HZ1  LYS  77           3HZ      LYS  77   9.036 -21.552 -20.919
  544    HZ2  LYS  77           1HZ      LYS  77   7.518 -21.744 -20.198
  545    HZ3  LYS  77           2HZ      LYS  77   7.730 -20.609 -21.433
  546    H    GLU  78           H        GLU  78   8.353 -26.492 -27.105
  547    HA   GLU  78           HA       GLU  78  10.274 -28.224 -25.702
  548    HB2  GLU  78           2HB      GLU  78   9.884 -29.894 -27.595
  549    HB3  GLU  78           1HB      GLU  78   8.626 -29.766 -26.374
  550    HG2  GLU  78           2HG      GLU  78   8.284 -28.020 -28.714
  551    HG3  GLU  78           1HG      GLU  78   8.183 -29.749 -29.036
  552    H    LEU  79           H        LEU  79  12.286 -27.740 -26.265
  553    HA   LEU  79           HA       LEU  79  13.132 -27.503 -28.960
  554    HB2  LEU  79           2HB      LEU  79  13.923 -25.165 -28.879
  555    HB3  LEU  79           1HB      LEU  79  12.176 -25.300 -28.859
  556    HG   LEU  79           HG       LEU  79  13.450 -25.135 -26.204
  557   HD11  LEU  79          1HD1      LEU  79  13.195 -22.535 -27.598
  558   HD12  LEU  79          2HD1      LEU  79  14.623 -23.508 -27.946
  559   HD13  LEU  79          3HD1      LEU  79  14.269 -23.023 -26.289
  560   HD21  LEU  79          3HD2      LEU  79  11.337 -23.266 -27.034
  561   HD22  LEU  79          1HD2      LEU  79  11.455 -24.290 -25.604
  562   HD23  LEU  79          2HD2      LEU  79  10.915 -24.975 -27.137
  563    H    VAL  80           H        VAL  80  15.161 -28.194 -29.045
  564    HA   VAL  80           HA       VAL  80  16.789 -28.079 -26.590
  565    HB   VAL  80           HB       VAL  80  17.144 -30.011 -28.886
  566   HG11  VAL  80          1HG1      VAL  80  19.089 -29.474 -27.349
  567   HG12  VAL  80          2HG1      VAL  80  18.646 -31.174 -27.490
  568   HG13  VAL  80          3HG1      VAL  80  18.162 -30.253 -26.066
  569   HG21  VAL  80          3HG2      VAL  80  15.144 -30.787 -28.105
  570   HG22  VAL  80          1HG2      VAL  80  15.395 -30.137 -26.485
  571   HG23  VAL  80          2HG2      VAL  80  16.228 -31.610 -26.985
  572    H    LYS  81           H        LYS  81  18.214 -26.463 -26.696
  573    HA   LYS  81           HA       LYS  81  19.390 -25.720 -29.269
  574    HB2  LYS  81           2HB      LYS  81  19.046 -24.365 -26.639
  575    HB3  LYS  81           1HB      LYS  81  20.428 -23.898 -27.620
  576    HG2  LYS  81           2HG      LYS  81  18.494 -23.784 -29.479
  577    HG3  LYS  81           1HG      LYS  81  17.554 -23.406 -28.034
  578    HD2  LYS  81           2HD      LYS  81  18.741 -21.471 -27.607
  579    HD3  LYS  81           1HD      LYS  81  20.159 -22.020 -28.501
  580    HE2  LYS  81           2HE      LYS  81  19.306 -20.445 -29.942
  581    HE3  LYS  81           1HE      LYS  81  18.556 -21.917 -30.555
  582    HZ1  LYS  81           3HZ      LYS  81  16.721 -20.623 -30.414
  583    HZ2  LYS  81           1HZ      LYS  81  17.345 -19.649 -29.180
  584    HZ3  LYS  81           2HZ      LYS  81  16.713 -21.175 -28.815
  585    H    LEU  82           H        LEU  82  21.210 -26.697 -29.844
  586    HA   LEU  82           HA       LEU  82  23.132 -27.465 -27.746
  587    HB2  LEU  82           2HB      LEU  82  22.400 -28.718 -30.365
  588    HB3  LEU  82           1HB      LEU  82  23.998 -28.982 -29.692
  589    HG   LEU  82           HG       LEU  82  21.468 -29.594 -28.173
  590   HD11  LEU  82          1HD1      LEU  82  22.909 -31.158 -30.239
  591   HD12  LEU  82          2HD1      LEU  82  21.197 -31.138 -29.818
  592   HD13  LEU  82          3HD1      LEU  82  22.344 -32.020 -28.808
  593   HD21  LEU  82          3HD2      LEU  82  23.295 -31.224 -27.150
  594   HD22  LEU  82          1HD2      LEU  82  23.091 -29.568 -26.575
  595   HD23  LEU  82          2HD2      LEU  82  24.379 -29.953 -27.716
  596    H    GLU  83           H        GLU  83  24.976 -26.378 -27.681
  597    HA   GLU  83           HA       GLU  83  26.103 -25.289 -30.159
  598    HB2  GLU  83           2HB      GLU  83  25.381 -23.759 -27.686
  599    HB3  GLU  83           1HB      GLU  83  26.759 -23.248 -28.650
  600    HG2  GLU  83           2HG      GLU  83  25.473 -22.431 -30.292
  601    HG3  GLU  83           1HG      GLU  83  24.315 -23.756 -30.185
  602    H    HIS  84           H        HIS  84  27.858 -26.584 -30.264
  603    HA   HIS  84           HA       HIS  84  29.603 -26.740 -27.895
  604    HB2  HIS  84           2HB      HIS  84  28.568 -28.836 -29.223
  605    HB3  HIS  84           1HB      HIS  84  30.031 -28.596 -30.174
  606    HD1  HIS  84           1HD      HIS  84  32.320 -28.588 -28.680
  607    HD2  HIS  84           2HD      HIS  84  28.939 -30.284 -26.962
  608    HE1  HIS  84           1HE      HIS  84  33.171 -30.023 -26.799
  609    HE2  HIS  84           2HE      HIS  84  31.100 -30.960 -25.713
  Start of MODEL   19
    1    H1   MET   1           1HT      MET   1  12.428   7.942  19.758
    2    H2   MET   1           2HT      MET   1  11.027   8.591  19.011
    3    H3   MET   1           3HT      MET   1  12.173   9.636  19.743
    4    HA   MET   1           HA       MET   1  12.161   9.408  17.240
    5    HB2  MET   1           2HB      MET   1  14.451   9.337  19.160
    6    HB3  MET   1           1HB      MET   1  14.810   9.251  17.442
    7    HG2  MET   1           2HG      MET   1  14.866  11.482  17.608
    8    HG3  MET   1           1HG      MET   1  13.116  11.340  17.455
    9    HE1  MET   1           2HE      MET   1  11.837  13.276  19.850
   10    HE2  MET   1           3HE      MET   1  11.532  11.650  20.460
   11    HE3  MET   1           1HE      MET   1  11.587  11.944  18.722
   12    H    ALA   2           H        ALA   2  11.090   6.979  17.525
   13    HA   ALA   2           HA       ALA   2  12.933   4.830  17.147
   14    HB1  ALA   2           1HB      ALA   2  10.483   4.798  18.031
   15    HB2  ALA   2           2HB      ALA   2  11.096   3.441  17.088
   16    HB3  ALA   2           3HB      ALA   2  10.067   4.652  16.323
   17    H    VAL   3           H        VAL   3  12.347   3.314  15.122
   18    HA   VAL   3           HA       VAL   3  13.141   4.879  12.809
   19    HB   VAL   3           HB       VAL   3  13.402   2.636  11.697
   20   HG11  VAL   3          1HG1      VAL   3  14.902   3.334  14.201
   21   HG12  VAL   3          2HG1      VAL   3  15.366   3.605  12.522
   22   HG13  VAL   3          3HG1      VAL   3  15.369   1.970  13.185
   23   HG21  VAL   3          3HG2      VAL   3  13.352   1.262  14.308
   24   HG22  VAL   3          1HG2      VAL   3  12.909   0.675  12.704
   25   HG23  VAL   3          2HG2      VAL   3  11.779   1.670  13.621
   26    H    PHE   4           H        PHE   4  12.044   4.999  10.864
   27    HA   PHE   4           HA       PHE   4  10.283   5.143   9.449
   28    HB2  PHE   4           2HB      PHE   4  10.124   2.504  10.630
   29    HB3  PHE   4           1HB      PHE   4   8.528   3.105  10.210
   30    HD1  PHE   4           1HD      PHE   4  11.876   3.397   8.578
   31    HD2  PHE   4           2HD      PHE   4   7.821   2.142   8.253
   32    HE1  PHE   4           1HE      PHE   4  12.268   2.744   6.237
   33    HE2  PHE   4           2HE      PHE   4   8.208   1.490   5.913
   34    HZ   PHE   4           HZ       PHE   4  10.432   1.788   4.904
   35    H    HIS   5           H        HIS   5   7.752   5.248   9.419
   36    HA   HIS   5           HA       HIS   5   6.997   7.001  11.619
   37    HB2  HIS   5           2HB      HIS   5   6.599   7.691   9.259
   38    HB3  HIS   5           1HB      HIS   5   5.484   6.343   9.079
   39    HD1  HIS   5           1HD      HIS   5   3.140   6.605  10.059
   40    HD2  HIS   5           2HD      HIS   5   5.643   9.822  10.855
   41    HE1  HIS   5           1HE      HIS   5   1.643   8.413  10.963
   42    HE2  HIS   5           2HE      HIS   5   3.204  10.299  11.561
   43    H    ASP   6           H        ASP   6   5.379   4.345   9.856
   44    HA   ASP   6           HA       ASP   6   4.653   2.979  12.239
   45    HB2  ASP   6           2HB      ASP   6   2.854   5.047  11.295
   46    HB3  ASP   6           1HB      ASP   6   2.076   3.473  11.239
   47    H    GLU   7           H        GLU   7   3.280   1.081  11.799
   48    HA   GLU   7           HA       GLU   7   3.659   0.146   9.032
   49    HB2  GLU   7           2HB      GLU   7   3.259  -1.607  11.452
   50    HB3  GLU   7           1HB      GLU   7   3.839  -2.077   9.862
   51    HG2  GLU   7           2HG      GLU   7   5.791  -0.437  10.398
   52    HG3  GLU   7           1HG      GLU   7   5.273  -0.675  12.066
   53    H    VAL   8           H        VAL   8   1.883  -0.165   7.853
   54    HA   VAL   8           HA       VAL   8  -0.653  -0.733   9.237
   55    HB   VAL   8           HB       VAL   8  -0.426   1.016   6.786
   56   HG11  VAL   8          1HG1      VAL   8  -2.796   1.626   7.704
   57   HG12  VAL   8          2HG1      VAL   8  -2.673   0.060   8.504
   58   HG13  VAL   8          3HG1      VAL   8  -2.565   0.164   6.747
   59   HG21  VAL   8          3HG2      VAL   8  -0.938   1.906   9.624
   60   HG22  VAL   8          1HG2      VAL   8  -0.804   2.928   8.194
   61   HG23  VAL   8          2HG2      VAL   8   0.612   2.065   8.796
   62    H    GLU   9           H        GLU   9  -2.001  -2.201   8.279
   63    HA   GLU   9           HA       GLU   9  -0.860  -4.087   6.498
   64    HB2  GLU   9           2HB      GLU   9  -3.587  -3.709   7.688
   65    HB3  GLU   9           1HB      GLU   9  -3.336  -4.912   6.431
   66    HG2  GLU   9           2HG      GLU   9  -1.756  -6.091   7.775
   67    HG3  GLU   9           1HG      GLU   9  -1.748  -4.808   8.983
   68    H    ILE  10           H        ILE  10  -1.166  -4.464   4.363
   69    HA   ILE  10           HA       ILE  10  -1.650  -2.353   2.622
   70    HB   ILE  10           HB       ILE  10  -0.399  -4.408   2.037
   71   HG12  ILE  10          2HG1      ILE  10  -1.860  -4.671  -0.255
   72   HG13  ILE  10          1HG1      ILE  10  -2.450  -3.129   0.353
   73   HG21  ILE  10          1HG2      ILE  10  -3.101  -5.692   1.671
   74   HG22  ILE  10          2HG2      ILE  10  -2.020  -6.007   3.029
   75   HG23  ILE  10          3HG2      ILE  10  -1.522  -6.427   1.390
   76   HD11  ILE  10          3HD1      ILE  10  -0.468  -2.083   0.022
   77   HD12  ILE  10          1HD1      ILE  10  -0.354  -3.312  -1.236
   78   HD13  ILE  10          2HD1      ILE  10   0.479  -3.546   0.300
   79    H    GLU  11           H        GLU  11  -3.904  -4.640   4.028
   80    HA   GLU  11           HA       GLU  11  -6.057  -4.343   2.262
   81    HB2  GLU  11           2HB      GLU  11  -5.877  -5.006   5.188
   82    HB3  GLU  11           1HB      GLU  11  -7.438  -4.844   4.396
   83    HG2  GLU  11           2HG      GLU  11  -7.236  -6.792   3.296
   84    HG3  GLU  11           1HG      GLU  11  -5.509  -6.578   3.015
   85    H    ASP  12           H        ASP  12  -4.881  -2.277   4.837
   86    HA   ASP  12           HA       ASP  12  -7.194  -0.588   4.927
   87    HB2  ASP  12           2HB      ASP  12  -5.162  -0.977   6.643
   88    HB3  ASP  12           1HB      ASP  12  -4.561   0.460   5.820
   89    H    PHE  13           H        PHE  13  -4.243  -0.682   3.064
   90    HA   PHE  13           HA       PHE  13  -4.208   1.983   2.138
   91    HB2  PHE  13           2HB      PHE  13  -2.990  -0.595   1.252
   92    HB3  PHE  13           1HB      PHE  13  -2.996   0.747   0.116
   93    HD1  PHE  13           1HD      PHE  13  -2.253   0.248   3.751
   94    HD2  PHE  13           2HD      PHE  13  -1.066   1.953   0.036
   95    HE1  PHE  13           1HE      PHE  13  -0.225   1.150   4.815
   96    HE2  PHE  13           2HE      PHE  13   0.962   2.857   1.094
   97    HZ   PHE  13           HZ       PHE  13   1.385   2.454   3.485
   98    H    GLN  14           H        GLN  14  -4.415   2.433  -0.327
   99    HA   GLN  14           HA       GLN  14  -7.078   1.501  -1.164
  100    HB2  GLN  14           2HB      GLN  14  -6.680   3.969  -0.808
  101    HB3  GLN  14           1HB      GLN  14  -5.570   3.919  -2.170
  102    HG2  GLN  14           2HG      GLN  14  -7.381   4.522  -3.338
  103    HG3  GLN  14           1HG      GLN  14  -7.741   2.798  -3.297
  104   HE21  GLN  14          1HE2      GLN  14  -9.198   5.610  -3.085
  105   HE22  GLN  14          2HE2      GLN  14 -10.427   5.272  -1.918
  106    H    TYR  15           H        TYR  15  -6.890  -0.203  -2.509
  107    HA   TYR  15           HA       TYR  15  -4.648  -0.692  -4.162
  108    HB2  TYR  15           2HB      TYR  15  -6.123  -2.507  -3.425
  109    HB3  TYR  15           1HB      TYR  15  -7.452  -1.821  -4.354
  110    HD1  TYR  15           1HD      TYR  15  -3.937  -3.002  -4.870
  111    HD2  TYR  15           2HD      TYR  15  -7.878  -2.710  -6.443
  112    HE1  TYR  15           1HE      TYR  15  -3.247  -4.329  -6.818
  113    HE2  TYR  15           2HE      TYR  15  -7.201  -4.038  -8.398
  114    HH   TYR  15           HH       TYR  15  -5.400  -5.750  -8.933
  115    H    ASP  16           H        ASP  16  -4.159  -0.044  -6.166
  116    HA   ASP  16           HA       ASP  16  -6.157   1.559  -7.619
  117    HB2  ASP  16           2HB      ASP  16  -3.827   2.510  -6.727
  118    HB3  ASP  16           1HB      ASP  16  -3.249   1.813  -8.236
  119    H    GLU  17           H        GLU  17  -7.052  -0.160  -8.762
  120    HA   GLU  17           HA       GLU  17  -5.669  -2.166 -10.126
  121    HB2  GLU  17           2HB      GLU  17  -7.762  -2.195 -11.624
  122    HB3  GLU  17           1HB      GLU  17  -7.964  -2.537  -9.912
  123    HG2  GLU  17           2HG      GLU  17  -8.251   0.290 -10.610
  124    HG3  GLU  17           1HG      GLU  17  -9.446  -0.768 -11.359
  125    H    ASP  18           H        ASP  18  -6.189   1.167 -10.981
  126    HA   ASP  18           HA       ASP  18  -5.952   1.204 -13.711
  127    HB2  ASP  18           2HB      ASP  18  -6.052   3.131 -11.849
  128    HB3  ASP  18           1HB      ASP  18  -4.339   3.226 -12.246
  129    H    SER  19           H        SER  19  -3.235   1.213 -11.383
  130    HA   SER  19           HA       SER  19  -1.574  -0.053 -13.435
  131    HB2  SER  19           2HB      SER  19  -1.352   2.621 -13.104
  132    HB3  SER  19           1HB      SER  19  -0.206   2.071 -11.883
  133    HG   SER  19           HG       SER  19   0.717   2.381 -13.997
  134    H    GLU  20           H        GLU  20  -2.829  -0.948 -10.909
  135    HA   GLU  20           HA       GLU  20  -2.360  -2.118  -9.018
  136    HB2  GLU  20           2HB      GLU  20   0.101  -2.731 -10.656
  137    HB3  GLU  20           1HB      GLU  20  -0.345  -3.592  -9.189
  138    HG2  GLU  20           2HG      GLU  20  -2.030  -4.724 -10.195
  139    HG3  GLU  20           1HG      GLU  20  -2.398  -3.409 -11.311
  140    H    THR  21           H        THR  21  -2.160   0.069  -7.975
  141    HA   THR  21           HA       THR  21   0.422   0.223  -6.595
  142    HB   THR  21           HB       THR  21  -1.016   2.704  -7.554
  143    HG1  THR  21           1HG      THR  21   1.091   1.252  -8.761
  144   HG21  THR  21          3HG2      THR  21   0.479   3.041  -5.652
  145   HG22  THR  21          1HG2      THR  21   1.077   3.834  -7.109
  146   HG23  THR  21          2HG2      THR  21   1.801   2.319  -6.570
  147    H    TYR  22           H        TYR  22   0.309   1.193  -4.487
  148    HA   TYR  22           HA       TYR  22  -2.428   1.369  -3.408
  149    HB2  TYR  22           2HB      TYR  22  -0.001   0.305  -1.948
  150    HB3  TYR  22           1HB      TYR  22  -1.650   0.370  -1.333
  151    HD1  TYR  22           1HD      TYR  22   0.349  -1.095  -4.125
  152    HD2  TYR  22           2HD      TYR  22  -3.019  -1.498  -1.554
  153    HE1  TYR  22           1HE      TYR  22  -0.070  -3.335  -5.035
  154    HE2  TYR  22           2HE      TYR  22  -3.445  -3.743  -2.458
  155    HH   TYR  22           HH       TYR  22  -1.315  -5.525  -4.044
  156    H    PHE  23           H        PHE  23  -2.893   3.045  -2.034
  157    HA   PHE  23           HA       PHE  23  -0.694   4.901  -1.400
  158    HB2  PHE  23           2HB      PHE  23  -3.475   5.710  -2.282
  159    HB3  PHE  23           1HB      PHE  23  -2.145   6.796  -1.893
  160    HD1  PHE  23           1HD      PHE  23  -3.020   4.008  -4.209
  161    HD2  PHE  23           2HD      PHE  23  -0.806   7.591  -3.597
  162    HE1  PHE  23           1HE      PHE  23  -2.302   3.962  -6.560
  163    HE2  PHE  23           2HE      PHE  23  -0.084   7.551  -5.948
  164    HZ   PHE  23           HZ       PHE  23  -0.832   5.735  -7.434
  165    H    TYR  24           H        TYR  24  -0.952   6.188   0.484
  166    HA   TYR  24           HA       TYR  24  -3.077   5.305   2.322
  167    HB2  TYR  24           2HB      TYR  24  -0.700   4.332   2.721
  168    HB3  TYR  24           1HB      TYR  24  -0.315   5.944   3.320
  169    HD1  TYR  24           1HD      TYR  24  -2.670   3.105   3.806
  170    HD2  TYR  24           2HD      TYR  24  -0.834   6.536   5.525
  171    HE1  TYR  24           1HE      TYR  24  -3.614   2.506   5.994
  172    HE2  TYR  24           2HE      TYR  24  -1.771   5.944   7.720
  173    HH   TYR  24           HH       TYR  24  -4.054   4.389   8.390
  174    HA   PRO  25           HA       PRO  25  -3.800   9.662   2.768
  175    HB2  PRO  25           2HB      PRO  25  -5.226   9.606   5.089
  176    HB3  PRO  25           1HB      PRO  25  -5.900   9.152   3.520
  177    HG2  PRO  25           2HG      PRO  25  -4.847   7.402   5.709
  178    HG3  PRO  25           1HG      PRO  25  -6.298   7.196   4.711
  179    HD2  PRO  25           2HD      PRO  25  -4.014   5.842   4.229
  180    HD3  PRO  25           1HD      PRO  25  -5.105   6.353   2.924
  181    H    CYS  26           H        CYS  26  -2.362  11.127   3.421
  182    HA   CYS  26           HA       CYS  26  -0.840  10.639   5.879
  183    HB2  CYS  26           2HB      CYS  26  -0.054  11.464   3.335
  184    HB3  CYS  26           1HB      CYS  26   0.017  12.932   4.309
  185    HA   PRO  27           HA       PRO  27  -2.997  13.846   8.028
  186    HB2  PRO  27           2HB      PRO  27  -1.115  14.543   9.856
  187    HB3  PRO  27           1HB      PRO  27  -2.038  13.039   9.950
  188    HG2  PRO  27           2HG      PRO  27   0.737  13.499   8.926
  189    HG3  PRO  27           1HG      PRO  27   0.124  12.185   9.947
  190    HD2  PRO  27           2HD      PRO  27   0.533  11.897   7.285
  191    HD3  PRO  27           1HD      PRO  27  -0.747  11.029   8.157
  192    H    CYS  28           H        CYS  28  -0.029  14.455   6.350
  193    HA   CYS  28           HA       CYS  28   0.072  17.269   6.894
  194    HB2  CYS  28           2HB      CYS  28   1.827  17.324   5.172
  195    HB3  CYS  28           1HB      CYS  28   2.110  16.035   6.337
  196    H    GLY  29           H        GLY  29  -1.147  15.246   4.248
  197    HA2  GLY  29           2HA      GLY  29  -3.264  16.717   3.452
  198    HA3  GLY  29           1HA      GLY  29  -1.928  17.542   2.664
  199    H    ASP  30           H        ASP  30  -0.320  15.675   1.726
  200    HA   ASP  30           HA       ASP  30  -1.838  14.496  -0.407
  201    HB2  ASP  30           2HB      ASP  30   0.676  15.466  -0.249
  202    HB3  ASP  30           1HB      ASP  30   1.012  13.749  -0.044
  203    H    ASN  31           H        ASN  31  -0.770  12.109  -1.006
  204    HA   ASN  31           HA       ASN  31  -1.143  10.434   1.382
  205    HB2  ASN  31           2HB      ASN  31  -2.324   9.834  -1.340
  206    HB3  ASN  31           1HB      ASN  31  -2.515   8.875   0.124
  207   HD21  ASN  31          1HD2      ASN  31  -4.337  10.494  -1.754
  208   HD22  ASN  31          2HD2      ASN  31  -5.335  11.381  -0.658
  209    H    PHE  32           H        PHE  32   0.087   8.611   1.513
  210    HA   PHE  32           HA       PHE  32   2.534   8.512   0.130
  211    HB2  PHE  32           2HB      PHE  32   1.078   6.612   1.943
  212    HB3  PHE  32           1HB      PHE  32   2.551   6.096   1.134
  213    HD1  PHE  32           1HD      PHE  32   4.623   7.614   1.444
  214    HD2  PHE  32           2HD      PHE  32   1.202   7.719   3.975
  215    HE1  PHE  32           1HE      PHE  32   5.974   8.645   3.223
  216    HE2  PHE  32           2HE      PHE  32   2.549   8.754   5.757
  217    HZ   PHE  32           HZ       PHE  32   4.938   9.217   5.381
  218    H    SER  33           H        SER  33   3.326   6.577  -1.131
  219    HA   SER  33           HA       SER  33   1.273   5.214  -2.691
  220    HB2  SER  33           2HB      SER  33   2.780   5.896  -4.780
  221    HB3  SER  33           1HB      SER  33   1.449   6.912  -4.229
  222    HG   SER  33           HG       SER  33   4.195   7.224  -3.572
  223    H    ILE  34           H        ILE  34   1.872   3.239  -3.423
  224    HA   ILE  34           HA       ILE  34   4.662   2.459  -3.547
  225    HB   ILE  34           HB       ILE  34   4.161   2.066  -1.188
  226   HG12  ILE  34          2HG1      ILE  34   4.136  -0.692  -2.322
  227   HG13  ILE  34          1HG1      ILE  34   5.445   0.381  -2.803
  228   HG21  ILE  34          1HG2      ILE  34   2.230  -0.098  -1.717
  229   HG22  ILE  34          2HG2      ILE  34   1.631   1.546  -1.931
  230   HG23  ILE  34          3HG2      ILE  34   2.315   1.051  -0.383
  231   HD11  ILE  34          3HD1      ILE  34   6.452   0.230  -0.818
  232   HD12  ILE  34          1HD1      ILE  34   5.458  -1.212  -0.612
  233   HD13  ILE  34          2HD1      ILE  34   4.934   0.326   0.073
  234    H    THR  35           H        THR  35   4.916   1.194  -5.288
  235    HA   THR  35           HA       THR  35   2.663   0.269  -6.778
  236    HB   THR  35           HB       THR  35   4.304  -0.661  -8.335
  237    HG1  THR  35           1HG      THR  35   6.329   0.162  -6.539
  238   HG21  THR  35          3HG2      THR  35   5.556   1.911  -7.503
  239   HG22  THR  35          1HG2      THR  35   3.905   1.894  -8.119
  240   HG23  THR  35          2HG2      THR  35   5.224   1.286  -9.119
  241    H    LYS  36           H        LYS  36   2.059  -1.860  -7.283
  242    HA   LYS  36           HA       LYS  36   2.004  -3.665  -5.140
  243    HB2  LYS  36           2HB      LYS  36   0.462  -3.490  -7.221
  244    HB3  LYS  36           1HB      LYS  36   1.638  -4.544  -7.991
  245    HG2  LYS  36           2HG      LYS  36   0.536  -5.345  -5.349
  246    HG3  LYS  36           1HG      LYS  36  -0.483  -5.507  -6.780
  247    HD2  LYS  36           2HD      LYS  36   1.860  -6.579  -7.661
  248    HD3  LYS  36           1HD      LYS  36   1.884  -7.041  -5.958
  249    HE2  LYS  36           2HE      LYS  36   0.722  -8.810  -6.803
  250    HE3  LYS  36           1HE      LYS  36  -0.620  -7.715  -6.479
  251    HZ1  LYS  36           3HZ      LYS  36   0.607  -8.422  -9.062
  252    HZ2  LYS  36           1HZ      LYS  36  -0.213  -6.952  -8.893
  253    HZ3  LYS  36           2HZ      LYS  36  -1.027  -8.410  -8.625
  254    H    GLU  37           H        GLU  37   4.093  -3.499  -7.984
  255    HA   GLU  37           HA       GLU  37   5.376  -5.976  -7.683
  256    HB2  GLU  37           2HB      GLU  37   5.471  -4.219  -9.620
  257    HB3  GLU  37           1HB      GLU  37   6.837  -3.571  -8.721
  258    HG2  GLU  37           2HG      GLU  37   8.135  -5.441  -9.075
  259    HG3  GLU  37           1HG      GLU  37   6.744  -6.482  -9.371
  260    H    ASP  38           H        ASP  38   6.085  -2.795  -6.286
  261    HA   ASP  38           HA       ASP  38   8.567  -3.343  -5.142
  262    HB2  ASP  38           2HB      ASP  38   6.380  -1.404  -4.617
  263    HB3  ASP  38           1HB      ASP  38   7.509  -1.674  -3.291
  264    H    LEU  39           H        LEU  39   5.314  -3.781  -3.775
  265    HA   LEU  39           HA       LEU  39   6.148  -4.808  -1.287
  266    HB2  LEU  39           2HB      LEU  39   3.575  -5.439  -2.725
  267    HB3  LEU  39           1HB      LEU  39   3.869  -5.536  -0.999
  268    HG   LEU  39           HG       LEU  39   4.194  -2.900  -2.362
  269   HD11  LEU  39          1HD1      LEU  39   1.700  -2.589  -1.682
  270   HD12  LEU  39          2HD1      LEU  39   1.627  -4.339  -1.890
  271   HD13  LEU  39          3HD1      LEU  39   2.110  -3.310  -3.238
  272   HD21  LEU  39          3HD2      LEU  39   3.563  -2.036  -0.224
  273   HD22  LEU  39          1HD2      LEU  39   4.793  -3.274   0.027
  274   HD23  LEU  39          2HD2      LEU  39   3.098  -3.638   0.344
  275    H    GLU  40           H        GLU  40   5.361  -6.383  -4.365
  276    HA   GLU  40           HA       GLU  40   5.500  -9.046  -3.442
  277    HB2  GLU  40           2HB      GLU  40   6.057  -7.970  -6.209
  278    HB3  GLU  40           1HB      GLU  40   5.775  -9.658  -5.810
  279    HG2  GLU  40           2HG      GLU  40   3.560  -8.483  -4.763
  280    HG3  GLU  40           1HG      GLU  40   3.880  -7.459  -6.161
  281    H    ASN  41           H        ASN  41   7.983  -6.757  -4.321
  282    HA   ASN  41           HA       ASN  41  10.034  -8.820  -4.451
  283    HB2  ASN  41           2HB      ASN  41   9.876  -5.931  -5.123
  284    HB3  ASN  41           1HB      ASN  41  11.447  -6.536  -4.606
  285   HD21  ASN  41          1HD2      ASN  41  12.179  -6.035  -6.739
  286   HD22  ASN  41          2HD2      ASN  41  11.867  -7.126  -8.041
  287    H    GLY  42           H        GLY  42   9.017  -6.192  -2.319
  288    HA2  GLY  42           2HA      GLY  42   9.576  -7.042   0.100
  289    HA3  GLY  42           1HA      GLY  42  11.217  -6.778  -0.477
  290    H    GLU  43           H        GLU  43   9.993  -4.453  -2.139
  291    HA   GLU  43           HA       GLU  43  10.686  -2.387  -0.344
  292    HB2  GLU  43           2HB      GLU  43   9.401  -2.406  -3.068
  293    HB3  GLU  43           1HB      GLU  43   9.649  -0.908  -2.182
  294    HG2  GLU  43           2HG      GLU  43  11.773  -2.844  -3.074
  295    HG3  GLU  43           1HG      GLU  43  11.439  -1.250  -3.751
  296    H    ASP  44           H        ASP  44   9.295  -2.861   1.446
  297    HA   ASP  44           HA       ASP  44   6.458  -2.238   1.107
  298    HB2  ASP  44           2HB      ASP  44   6.342  -2.945   3.557
  299    HB3  ASP  44           1HB      ASP  44   6.733  -4.197   2.389
  300    H    VAL  45           H        VAL  45   8.235  -0.107   0.742
  301    HA   VAL  45           HA       VAL  45   7.604   1.548   3.092
  302    HB   VAL  45           HB       VAL  45  10.016   1.165   3.024
  303   HG11  VAL  45          1HG1      VAL  45  11.405   1.681   1.215
  304   HG12  VAL  45          2HG1      VAL  45  10.155   2.623   0.406
  305   HG13  VAL  45          3HG1      VAL  45  10.027   0.866   0.477
  306   HG21  VAL  45          3HG2      VAL  45   9.212   3.293   3.867
  307   HG22  VAL  45          1HG2      VAL  45   9.229   3.969   2.238
  308   HG23  VAL  45          2HG2      VAL  45  10.743   3.516   3.019
  309    H    ALA  46           H        ALA  46   6.474   3.334   2.710
  310    HA   ALA  46           HA       ALA  46   6.151   4.190  -0.089
  311    HB1  ALA  46           1HB      ALA  46   4.174   3.332   1.559
  312    HB2  ALA  46           2HB      ALA  46   3.935   4.442   0.209
  313    HB3  ALA  46           3HB      ALA  46   4.120   5.072   1.846
  314    H    THR  47           H        THR  47   6.665   6.232  -0.618
  315    HA   THR  47           HA       THR  47   7.425   8.044   1.574
  316    HB   THR  47           HB       THR  47   8.460   8.090  -1.269
  317    HG1  THR  47           1HG      THR  47  10.117   6.897  -0.606
  318   HG21  THR  47          3HG2      THR  47   9.457   9.993  -0.755
  319   HG22  THR  47          1HG2      THR  47  10.263   9.212   0.606
  320   HG23  THR  47          2HG2      THR  47   8.689   9.974   0.833
  321    H    CYS  48           H        CYS  48   6.447   9.959   1.745
  322    HA   CYS  48           HA       CYS  48   4.339  10.607  -0.162
  323    HB2  CYS  48           2HB      CYS  48   3.888  10.589   2.297
  324    HB3  CYS  48           1HB      CYS  48   4.997  11.945   2.471
  325    HA   PRO  49           HA       PRO  49   7.161  13.426  -2.255
  326    HB2  PRO  49           2HB      PRO  49   4.568  14.390  -3.353
  327    HB3  PRO  49           1HB      PRO  49   6.048  13.927  -4.201
  328    HG2  PRO  49           2HG      PRO  49   3.936  12.314  -4.193
  329    HG3  PRO  49           1HG      PRO  49   5.579  11.656  -4.048
  330    HD2  PRO  49           2HD      PRO  49   3.496  12.043  -1.939
  331    HD3  PRO  49           1HD      PRO  49   4.661  10.719  -2.146
  332    H    SER  50           H        SER  50   4.438  14.277  -0.250
  333    HA   SER  50           HA       SER  50   4.972  17.114  -0.337
  334    HB2  SER  50           2HB      SER  50   2.973  15.361   1.029
  335    HB3  SER  50           1HB      SER  50   3.256  16.979   1.670
  336    HG   SER  50           HG       SER  50   2.266  17.804   0.005
  337    H    CYS  51           H        CYS  51   4.667  15.026   2.550
  338    HA   CYS  51           HA       CYS  51   6.502  16.682   4.007
  339    HB2  CYS  51           2HB      CYS  51   6.140  15.109   5.860
  340    HB3  CYS  51           1HB      CYS  51   4.616  15.634   5.149
  341    H    SER  52           H        SER  52   6.770  13.719   2.198
  342    HA   SER  52           HA       SER  52   8.575  12.501   1.548
  343    HB2  SER  52           2HB      SER  52   9.629  14.996   1.834
  344    HB3  SER  52           1HB      SER  52  10.615  14.084   2.976
  345    HG   SER  52           HG       SER  52  10.393  13.819   0.198
  346    H    LEU  53           H        LEU  53   7.158  11.772   3.814
  347    HA   LEU  53           HA       LEU  53   9.135  10.918   5.789
  348    HB2  LEU  53           2HB      LEU  53   6.172  11.155   5.718
  349    HB3  LEU  53           1HB      LEU  53   6.850   9.909   6.747
  350    HG   LEU  53           HG       LEU  53   7.812  12.742   6.959
  351   HD11  LEU  53          1HD1      LEU  53   6.034  13.456   8.140
  352   HD12  LEU  53          2HD1      LEU  53   5.723  11.867   8.840
  353   HD13  LEU  53          3HD1      LEU  53   5.181  12.231   7.202
  354   HD21  LEU  53          3HD2      LEU  53   7.575  10.568   9.032
  355   HD22  LEU  53          1HD2      LEU  53   8.434  12.102   9.172
  356   HD23  LEU  53          2HD2      LEU  53   9.025  10.857   8.071
  357    H    ILE  54           H        ILE  54   8.459   8.576   6.687
  358    HA   ILE  54           HA       ILE  54   8.274   6.767   4.363
  359    HB   ILE  54           HB       ILE  54   9.815   5.228   5.662
  360   HG12  ILE  54          2HG1      ILE  54  10.359   7.784   7.198
  361   HG13  ILE  54          1HG1      ILE  54   9.635   6.317   7.852
  362   HG21  ILE  54          1HG2      ILE  54  11.604   5.992   4.495
  363   HG22  ILE  54          2HG2      ILE  54  11.386   7.659   5.030
  364   HG23  ILE  54          3HG2      ILE  54  10.364   7.001   3.752
  365   HD11  ILE  54          3HD1      ILE  54  11.806   6.130   8.560
  366   HD12  ILE  54          1HD1      ILE  54  12.462   6.865   7.099
  367   HD13  ILE  54          2HD1      ILE  54  11.855   5.210   7.057
  368    H    ILE  55           H        ILE  55   7.116   4.866   4.648
  369    HA   ILE  55           HA       ILE  55   6.023   4.270   7.292
  370    HB   ILE  55           HB       ILE  55   3.733   3.957   6.346
  371   HG12  ILE  55          2HG1      ILE  55   4.338   5.840   4.131
  372   HG13  ILE  55          1HG1      ILE  55   4.849   4.170   3.905
  373   HG21  ILE  55          1HG2      ILE  55   3.163   6.380   6.348
  374   HG22  ILE  55          2HG2      ILE  55   4.891   6.737   6.354
  375   HG23  ILE  55          3HG2      ILE  55   4.164   5.871   7.708
  376   HD11  ILE  55          3HD1      ILE  55   2.251   3.970   4.850
  377   HD12  ILE  55          1HD1      ILE  55   2.798   3.757   3.186
  378   HD13  ILE  55          2HD1      ILE  55   2.219   5.332   3.730
  379    H    LYS  56           H        LYS  56   5.524   2.119   7.627
  380    HA   LYS  56           HA       LYS  56   6.558   0.283   5.610
  381    HB2  LYS  56           2HB      LYS  56   7.293   0.130   8.002
  382    HB3  LYS  56           1HB      LYS  56   5.652  -0.331   8.428
  383    HG2  LYS  56           2HG      LYS  56   6.607  -2.390   8.268
  384    HG3  LYS  56           1HG      LYS  56   6.060  -2.188   6.603
  385    HD2  LYS  56           2HD      LYS  56   8.182  -1.880   5.797
  386    HD3  LYS  56           1HD      LYS  56   8.777  -1.205   7.317
  387    HE2  LYS  56           2HE      LYS  56   9.640  -3.504   6.674
  388    HE3  LYS  56           1HE      LYS  56   8.984  -3.333   8.302
  389    HZ1  LYS  56           3HZ      LYS  56   8.296  -5.351   6.899
  390    HZ2  LYS  56           1HZ      LYS  56   7.271  -4.273   6.090
  391    HZ3  LYS  56           2HZ      LYS  56   7.094  -4.523   7.754
  392    H    VAL  57           H        VAL  57   5.440  -1.104   4.482
  393    HA   VAL  57           HA       VAL  57   2.529  -1.137   4.859
  394    HB   VAL  57           HB       VAL  57   3.667  -2.181   2.326
  395   HG11  VAL  57          1HG1      VAL  57   1.363  -0.415   3.113
  396   HG12  VAL  57          2HG1      VAL  57   1.298  -2.107   2.616
  397   HG13  VAL  57          3HG1      VAL  57   1.734  -0.859   1.447
  398   HG21  VAL  57          3HG2      VAL  57   5.041  -0.388   2.102
  399   HG22  VAL  57          1HG2      VAL  57   4.145   0.587   3.265
  400   HG23  VAL  57          2HG2      VAL  57   3.543   0.406   1.619
  401    H    ILE  58           H        ILE  58   1.807  -2.901   5.856
  402    HA   ILE  58           HA       ILE  58   3.329  -5.386   5.720
  403    HB   ILE  58           HB       ILE  58   0.803  -4.882   7.293
  404   HG12  ILE  58          2HG1      ILE  58   2.462  -3.230   7.968
  405   HG13  ILE  58          1HG1      ILE  58   2.292  -4.448   9.227
  406   HG21  ILE  58          1HG2      ILE  58   1.130  -6.887   8.290
  407   HG22  ILE  58          2HG2      ILE  58   2.887  -6.773   8.195
  408   HG23  ILE  58          3HG2      ILE  58   1.956  -7.241   6.773
  409   HD11  ILE  58          3HD1      ILE  58   4.353  -5.321   7.517
  410   HD12  ILE  58          1HD1      ILE  58   4.480  -4.748   9.179
  411   HD13  ILE  58          2HD1      ILE  58   4.632  -3.610   7.840
  412    H    TYR  59           H        TYR  59   2.703  -7.186   4.657
  413    HA   TYR  59           HA       TYR  59  -0.009  -7.518   3.690
  414    HB2  TYR  59           2HB      TYR  59   0.874  -7.859   1.304
  415    HB3  TYR  59           1HB      TYR  59   0.747  -6.198   1.874
  416    HD1  TYR  59           2HD      TYR  59   3.079  -8.918   1.042
  417    HD2  TYR  59           1HD      TYR  59   2.702  -4.860   2.256
  418    HE1  TYR  59           2HE      TYR  59   5.460  -8.557   0.552
  419    HE2  TYR  59           1HE      TYR  59   5.076  -4.486   1.772
  420    HH   TYR  59           HH       TYR  59   6.952  -6.572  -0.025
  421    H    ASP  60           H        ASP  60   0.049  -9.589   2.120
  422    HA   ASP  60           HA       ASP  60   1.256 -11.682   3.719
  423    HB2  ASP  60           2HB      ASP  60  -1.126 -11.687   2.674
  424    HB3  ASP  60           1HB      ASP  60  -0.302 -12.157   1.189
  425    H    LYS  61           H        LYS  61   3.413 -11.818   3.352
  426    HA   LYS  61           HA       LYS  61   4.695 -11.405   0.889
  427    HB2  LYS  61           2HB      LYS  61   5.521 -12.863   3.388
  428    HB3  LYS  61           1HB      LYS  61   6.572 -12.780   1.980
  429    HG2  LYS  61           2HG      LYS  61   5.972 -10.175   2.257
  430    HG3  LYS  61           1HG      LYS  61   5.852 -10.700   3.937
  431    HD2  LYS  61           2HD      LYS  61   8.121 -11.766   3.643
  432    HD3  LYS  61           1HD      LYS  61   8.225 -10.923   2.095
  433    HE2  LYS  61           2HE      LYS  61   8.556  -8.908   3.062
  434    HE3  LYS  61           1HE      LYS  61   7.473  -9.259   4.407
  435    HZ1  LYS  61           3HZ      LYS  61   9.139 -10.125   5.644
  436    HZ2  LYS  61           1HZ      LYS  61  10.082  -9.085   4.700
  437    HZ3  LYS  61           2HZ      LYS  61   9.993 -10.729   4.315
  438    H    ASP  62           H        ASP  62   3.131 -14.237   2.228
  439    HA   ASP  62           HA       ASP  62   4.292 -16.169   0.516
  440    HB2  ASP  62           2HB      ASP  62   1.859 -16.053   2.243
  441    HB3  ASP  62           1HB      ASP  62   1.959 -17.331   1.036
  442    H    GLN  63           H        GLN  63   1.594 -13.945   0.137
  443    HA   GLN  63           HA       GLN  63   0.864 -15.140  -2.426
  444    HB2  GLN  63           2HB      GLN  63  -0.371 -13.022  -0.688
  445    HB3  GLN  63           1HB      GLN  63  -0.882 -13.238  -2.355
  446    HG2  GLN  63           2HG      GLN  63  -0.828 -15.579  -0.507
  447    HG3  GLN  63           1HG      GLN  63  -2.157 -14.423  -0.428
  448   HE21  GLN  63          1HE2      GLN  63  -0.617 -16.904  -2.292
  449   HE22  GLN  63          2HE2      GLN  63  -1.863 -17.078  -3.477
  450    H    PHE  64           H        PHE  64   2.175 -12.117  -1.116
  451    HA   PHE  64           HA       PHE  64   2.326 -10.808  -3.657
  452    HB2  PHE  64           2HB      PHE  64   3.239 -10.209  -0.881
  453    HB3  PHE  64           1HB      PHE  64   4.031  -9.356  -2.201
  454    HD1  PHE  64           1HD      PHE  64   0.680 -10.091  -0.765
  455    HD2  PHE  64           2HD      PHE  64   3.050  -7.473  -3.143
  456    HE1  PHE  64           1HE      PHE  64  -1.179  -8.479  -0.840
  457    HE2  PHE  64           2HE      PHE  64   1.197  -5.859  -3.221
  458    HZ   PHE  64           HZ       PHE  64  -0.921  -6.360  -2.068
  459    H    VAL  65           H        VAL  65   4.872 -12.038  -1.468
  460    HA   VAL  65           HA       VAL  65   6.863 -11.871  -3.539
  461    HB   VAL  65           HB       VAL  65   7.138 -13.269  -0.877
  462   HG11  VAL  65          1HG1      VAL  65   8.843 -13.389  -2.919
  463   HG12  VAL  65          2HG1      VAL  65   9.378 -13.342  -1.241
  464   HG13  VAL  65          3HG1      VAL  65   9.385 -11.867  -2.209
  465   HG21  VAL  65          3HG2      VAL  65   8.173 -11.093  -0.132
  466   HG22  VAL  65          1HG2      VAL  65   6.422 -11.073  -0.337
  467   HG23  VAL  65          2HG2      VAL  65   7.462 -10.355  -1.566
  468    H    SER  66           H        SER  66   5.913 -13.239  -5.138
  469    HA   SER  66           HA       SER  66   5.749 -16.087  -4.518
  470    HB2  SER  66           2HB      SER  66   4.734 -16.322  -6.728
  471    HB3  SER  66           1HB      SER  66   3.930 -15.041  -5.828
  472    HG   SER  66           HG       SER  66   4.973 -13.526  -7.060
  473    H    GLY  67           H        GLY  67   7.900 -16.711  -4.288
  474    HA2  GLY  67           2HA      GLY  67   9.907 -16.034  -6.227
  475    HA3  GLY  67           1HA      GLY  67  10.070 -17.195  -4.917
  476    H    GLU  68           H        GLU  68   9.698 -19.356  -5.293
  477    HA   GLU  68           HA       GLU  68   9.499 -20.098  -8.122
  478    HB2  GLU  68           2HB      GLU  68  10.718 -21.368  -5.709
  479    HB3  GLU  68           1HB      GLU  68  10.193 -22.406  -7.028
  480    HG2  GLU  68           2HG      GLU  68  12.271 -22.051  -7.785
  481    HG3  GLU  68           1HG      GLU  68  11.571 -20.559  -8.411
  482    H    THR  69           H        THR  69   7.132 -19.333  -6.631
  483    HA   THR  69           HA       THR  69   5.585 -21.797  -6.975
  484    HB   THR  69           HB       THR  69   4.918 -19.973  -4.687
  485    HG1  THR  69           1HG      THR  69   6.835 -22.061  -4.643
  486   HG21  THR  69          3HG2      THR  69   3.409 -21.860  -5.464
  487   HG22  THR  69          1HG2      THR  69   3.825 -21.807  -3.751
  488   HG23  THR  69          2HG2      THR  69   4.637 -22.950  -4.820
  489    H    VAL  70           H        VAL  70   3.826 -21.482  -8.181
  490    HA   VAL  70           HA       VAL  70   3.049 -18.730  -8.830
  491    HB   VAL  70           HB       VAL  70   2.162 -21.263 -10.219
  492   HG11  VAL  70          1HG1      VAL  70   2.158 -18.382 -11.113
  493   HG12  VAL  70          2HG1      VAL  70   0.746 -19.316 -10.618
  494   HG13  VAL  70          3HG1      VAL  70   1.635 -19.764 -12.074
  495   HG21  VAL  70          3HG2      VAL  70   3.889 -20.374 -11.968
  496   HG22  VAL  70          1HG2      VAL  70   4.428 -21.368 -10.614
  497   HG23  VAL  70          2HG2      VAL  70   4.630 -19.616 -10.558
  498    HA   PRO  71           HA       PRO  71  -0.652 -18.883  -6.380
  499    HB2  PRO  71           2HB      PRO  71  -1.890 -17.317  -8.581
  500    HB3  PRO  71           1HB      PRO  71  -1.758 -16.932  -6.863
  501    HG2  PRO  71           2HG      PRO  71  -0.239 -15.688  -8.665
  502    HG3  PRO  71           1HG      PRO  71   0.407 -16.132  -7.074
  503    HD2  PRO  71           2HD      PRO  71   0.826 -17.444  -9.727
  504    HD3  PRO  71           1HD      PRO  71   1.982 -17.182  -8.406
  505    H    ALA  72           H        ALA  72  -3.092 -19.288  -6.696
  506    HA   ALA  72           HA       ALA  72  -3.672 -21.042  -8.962
  507    HB1  ALA  72           1HB      ALA  72  -4.220 -22.920  -7.705
  508    HB2  ALA  72           2HB      ALA  72  -4.304 -22.010  -6.197
  509    HB3  ALA  72           3HB      ALA  72  -2.740 -22.339  -6.944
  510    HA   PRO  73           HA       PRO  73  -7.677 -19.176  -8.772
  511    HB2  PRO  73           2HB      PRO  73  -9.203 -21.124  -9.886
  512    HB3  PRO  73           1HB      PRO  73  -8.080 -20.134 -10.826
  513    HG2  PRO  73           2HG      PRO  73  -7.715 -22.902  -9.742
  514    HG3  PRO  73           1HG      PRO  73  -7.283 -22.260 -11.339
  515    HD2  PRO  73           2HD      PRO  73  -5.466 -22.582  -9.360
  516    HD3  PRO  73           1HD      PRO  73  -5.349 -21.279 -10.561
  517    H    SER  74           H        SER  74  -9.593 -19.148  -7.588
  518    HA   SER  74           HA       SER  74 -10.320 -21.438  -5.960
  519    HB2  SER  74           2HB      SER  74  -9.350 -18.839  -4.761
  520    HB3  SER  74           1HB      SER  74 -10.323 -20.004  -3.864
  521    HG   SER  74           HG       SER  74  -8.595 -21.556  -4.545
  522    H    ALA  75           H        ALA  75 -12.380 -21.174  -4.866
  523    HA   ALA  75           HA       ALA  75 -14.111 -19.251  -6.271
  524    HB1  ALA  75           1HB      ALA  75 -15.952 -20.835  -5.469
  525    HB2  ALA  75           2HB      ALA  75 -14.647 -21.958  -5.086
  526    HB3  ALA  75           3HB      ALA  75 -14.882 -21.410  -6.747
  527    H    ASN  76           H        ASN  76 -15.591 -17.993  -5.148
  528    HA   ASN  76           HA       ASN  76 -15.352 -18.003  -2.213
  529    HB2  ASN  76           2HB      ASN  76 -15.095 -15.720  -4.136
  530    HB3  ASN  76           1HB      ASN  76 -15.764 -15.420  -2.534
  531   HD21  ASN  76          1HD2      ASN  76 -14.370 -14.965  -0.981
  532   HD22  ASN  76          2HD2      ASN  76 -12.679 -15.318  -1.003
  533    H    LYS  77           H        LYS  77 -17.370 -19.310  -3.746
  534    HA   LYS  77           HA       LYS  77 -19.719 -17.707  -2.980
  535    HB2  LYS  77           2HB      LYS  77 -20.971 -18.764  -4.824
  536    HB3  LYS  77           1HB      LYS  77 -19.610 -17.819  -5.406
  537    HG2  LYS  77           2HG      LYS  77 -19.235 -19.626  -6.678
  538    HG3  LYS  77           1HG      LYS  77 -18.455 -20.247  -5.224
  539    HD2  LYS  77           2HD      LYS  77 -20.138 -21.714  -4.781
  540    HD3  LYS  77           1HD      LYS  77 -21.378 -20.667  -5.470
  541    HE2  LYS  77           2HE      LYS  77 -21.126 -21.515  -7.556
  542    HE3  LYS  77           1HE      LYS  77 -19.391 -21.761  -7.361
  543    HZ1  LYS  77           3HZ      LYS  77 -20.913 -23.802  -7.510
  544    HZ2  LYS  77           1HZ      LYS  77 -21.319 -23.454  -5.904
  545    HZ3  LYS  77           2HZ      LYS  77 -19.713 -23.788  -6.319
  546    H    GLU  78           H        GLU  78 -18.364 -19.512  -1.262
  547    HA   GLU  78           HA       GLU  78 -19.937 -21.953  -1.233
  548    HB2  GLU  78           2HB      GLU  78 -17.392 -21.550  -0.543
  549    HB3  GLU  78           1HB      GLU  78 -18.130 -21.255   1.025
  550    HG2  GLU  78           2HG      GLU  78 -18.676 -23.413   1.329
  551    HG3  GLU  78           1HG      GLU  78 -19.050 -23.673  -0.374
  552    H    LEU  79           H        LEU  79 -22.019 -21.410  -0.723
  553    HA   LEU  79           HA       LEU  79 -22.426 -20.343   1.989
  554    HB2  LEU  79           2HB      LEU  79 -24.581 -19.333   1.060
  555    HB3  LEU  79           1HB      LEU  79 -23.073 -18.521   0.685
  556    HG   LEU  79           HG       LEU  79 -24.048 -20.496  -1.304
  557   HD11  LEU  79          1HD1      LEU  79 -26.128 -19.583  -1.181
  558   HD12  LEU  79          2HD1      LEU  79 -25.369 -18.390  -2.235
  559   HD13  LEU  79          3HD1      LEU  79 -25.542 -18.060  -0.511
  560   HD21  LEU  79          3HD2      LEU  79 -21.961 -18.912  -1.332
  561   HD22  LEU  79          1HD2      LEU  79 -23.138 -17.713  -1.869
  562   HD23  LEU  79          2HD2      LEU  79 -22.895 -19.190  -2.801
  563    H    VAL  80           H        VAL  80 -22.282 -23.084   1.220
  564    HA   VAL  80           HA       VAL  80 -25.037 -24.037   1.179
  565    HB   VAL  80           HB       VAL  80 -22.508 -25.689   1.262
  566   HG11  VAL  80          1HG1      VAL  80 -24.138 -27.201   1.757
  567   HG12  VAL  80          2HG1      VAL  80 -24.246 -27.239  -0.002
  568   HG13  VAL  80          3HG1      VAL  80 -25.399 -26.284   0.932
  569   HG21  VAL  80          3HG2      VAL  80 -23.834 -24.273  -0.973
  570   HG22  VAL  80          1HG2      VAL  80 -23.302 -25.926  -1.282
  571   HG23  VAL  80          2HG2      VAL  80 -22.140 -24.711  -0.749
  572    H    LYS  81           H        LYS  81 -26.043 -23.989   3.095
  573    HA   LYS  81           HA       LYS  81 -26.568 -24.388   5.268
  574    HB2  LYS  81           2HB      LYS  81 -25.734 -26.698   4.570
  575    HB3  LYS  81           1HB      LYS  81 -24.226 -26.285   5.372
  576    HG2  LYS  81           2HG      LYS  81 -25.283 -26.144   7.488
  577    HG3  LYS  81           1HG      LYS  81 -26.890 -26.207   6.763
  578    HD2  LYS  81           2HD      LYS  81 -26.699 -28.479   6.250
  579    HD3  LYS  81           1HD      LYS  81 -24.941 -28.461   6.408
  580    HE2  LYS  81           2HE      LYS  81 -25.595 -29.521   8.357
  581    HE3  LYS  81           1HE      LYS  81 -25.423 -27.847   8.883
  582    HZ1  LYS  81           3HZ      LYS  81 -27.638 -27.619   9.188
  583    HZ2  LYS  81           1HZ      LYS  81 -27.561 -29.293   9.414
  584    HZ3  LYS  81           2HZ      LYS  81 -28.056 -28.663   7.924
  585    H    LEU  82           H        LEU  82 -26.030 -22.296   5.964
  586    HA   LEU  82           HA       LEU  82 -23.345 -21.725   6.876
  587    HB2  LEU  82           2HB      LEU  82 -24.198 -19.531   7.470
  588    HB3  LEU  82           1HB      LEU  82 -24.676 -19.957   5.839
  589    HG   LEU  82           HG       LEU  82 -26.883 -20.761   7.111
  590   HD11  LEU  82          1HD1      LEU  82 -26.609 -20.261   9.307
  591   HD12  LEU  82          2HD1      LEU  82 -27.232 -18.704   8.762
  592   HD13  LEU  82          3HD1      LEU  82 -25.497 -18.932   8.984
  593   HD21  LEU  82          3HD2      LEU  82 -27.678 -18.305   6.752
  594   HD22  LEU  82          1HD2      LEU  82 -27.175 -19.279   5.369
  595   HD23  LEU  82          2HD2      LEU  82 -26.072 -18.087   6.056
  596    H    GLU  83           H        GLU  83 -22.670 -21.430   8.983
  597    HA   GLU  83           HA       GLU  83 -24.526 -21.976  11.163
  598    HB2  GLU  83           2HB      GLU  83 -22.299 -23.771  10.323
  599    HB3  GLU  83           1HB      GLU  83 -22.584 -23.564  12.045
  600    HG2  GLU  83           2HG      GLU  83 -25.103 -24.034  11.129
  601    HG3  GLU  83           1HG      GLU  83 -24.131 -25.022  10.039
  602    H    HIS  84           H        HIS  84 -23.338 -21.775  13.331
  603    HA   HIS  84           HA       HIS  84 -21.162 -19.805  13.162
  604    HB2  HIS  84           2HB      HIS  84 -22.235 -18.563  15.055
  605    HB3  HIS  84           1HB      HIS  84 -23.142 -18.496  13.549
  606    HD1  HIS  84           1HD      HIS  84 -25.420 -19.727  13.480
  607    HD2  HIS  84           2HD      HIS  84 -23.495 -19.910  17.159
  608    HE1  HIS  84           1HE      HIS  84 -27.148 -20.567  15.102
  609    HE2  HIS  84           2HE      HIS  84 -25.973 -20.631  17.330
  Start of MODEL   20
    1    H1   MET   1           1HT      MET   1   9.168   9.719  15.645
    2    H2   MET   1           2HT      MET   1   9.903  11.096  14.932
    3    H3   MET   1           3HT      MET   1   9.586  11.067  16.618
    4    HA   MET   1           HA       MET   1  11.897  10.717  16.113
    5    HB2  MET   1           2HB      MET   1  10.370   9.508  17.963
    6    HB3  MET   1           1HB      MET   1  10.942   8.080  17.114
    7    HG2  MET   1           2HG      MET   1  13.050  10.002  17.742
    8    HG3  MET   1           1HG      MET   1  12.235   9.346  19.158
    9    HE1  MET   1           2HE      MET   1  15.077   9.385  17.840
   10    HE2  MET   1           3HE      MET   1  15.238   8.225  16.522
   11    HE3  MET   1           1HE      MET   1  15.808   7.809  18.138
   12    H    ALA   2           H        ALA   2  13.454   8.858  15.617
   13    HA   ALA   2           HA       ALA   2  13.187   8.163  12.882
   14    HB1  ALA   2           1HB      ALA   2  15.168   6.805  14.654
   15    HB2  ALA   2           2HB      ALA   2  15.316   8.536  14.351
   16    HB3  ALA   2           3HB      ALA   2  15.354   7.398  13.004
   17    H    VAL   3           H        VAL   3  14.064   5.626  12.530
   18    HA   VAL   3           HA       VAL   3  13.456   3.432  12.441
   19    HB   VAL   3           HB       VAL   3  11.913   3.903  15.001
   20   HG11  VAL   3          1HG1      VAL   3  11.823   1.733  13.391
   21   HG12  VAL   3          2HG1      VAL   3  11.589   1.681  15.137
   22   HG13  VAL   3          3HG1      VAL   3  13.167   1.300  14.449
   23   HG21  VAL   3          3HG2      VAL   3  14.542   2.606  15.173
   24   HG22  VAL   3          1HG2      VAL   3  13.794   3.806  16.228
   25   HG23  VAL   3          2HG2      VAL   3  14.593   4.314  14.741
   26    H    PHE   4           H        PHE   4  12.165   4.855  10.721
   27    HA   PHE   4           HA       PHE   4  10.318   5.081   9.431
   28    HB2  PHE   4           2HB      PHE   4  10.103   2.471  10.721
   29    HB3  PHE   4           1HB      PHE   4   8.548   3.117  10.226
   30    HD1  PHE   4           1HD      PHE   4  11.989   3.011   8.761
   31    HD2  PHE   4           2HD      PHE   4   7.827   2.297   8.221
   32    HE1  PHE   4           1HE      PHE   4  12.421   2.245   6.462
   33    HE2  PHE   4           2HE      PHE   4   8.253   1.532   5.923
   34    HZ   PHE   4           HZ       PHE   4  10.551   1.504   5.041
   35    H    HIS   5           H        HIS   5   7.679   4.968   9.692
   36    HA   HIS   5           HA       HIS   5   7.139   6.799  11.924
   37    HB2  HIS   5           2HB      HIS   5   6.726   7.556   9.546
   38    HB3  HIS   5           1HB      HIS   5   5.438   6.361   9.462
   39    HD1  HIS   5           1HD      HIS   5   5.636   7.983  12.739
   40    HD2  HIS   5           2HD      HIS   5   3.777   8.716   9.094
   41    HE1  HIS   5           1HE      HIS   5   3.856   9.689  13.224
   42    HE2  HIS   5           2HE      HIS   5   2.794  10.173  10.990
   43    H    ASP   6           H        ASP   6   5.412   4.290  10.064
   44    HA   ASP   6           HA       ASP   6   4.638   2.849  12.392
   45    HB2  ASP   6           2HB      ASP   6   2.785   4.890  11.297
   46    HB3  ASP   6           1HB      ASP   6   2.077   3.317  11.647
   47    H    GLU   7           H        GLU   7   3.325   0.965  11.880
   48    HA   GLU   7           HA       GLU   7   3.739   0.100   9.107
   49    HB2  GLU   7           2HB      GLU   7   3.089  -1.549  11.558
   50    HB3  GLU   7           1HB      GLU   7   3.483  -2.176   9.963
   51    HG2  GLU   7           2HG      GLU   7   5.688  -1.886  10.248
   52    HG3  GLU   7           1HG      GLU   7   5.484  -0.367  11.118
   53    H    VAL   8           H        VAL   8   2.068  -0.428   7.783
   54    HA   VAL   8           HA       VAL   8  -0.630  -0.598   8.936
   55    HB   VAL   8           HB       VAL   8  -0.012   1.002   6.449
   56   HG11  VAL   8          1HG1      VAL   8  -2.301  -0.157   6.850
   57   HG12  VAL   8          2HG1      VAL   8  -2.261   1.529   6.340
   58   HG13  VAL   8          3HG1      VAL   8  -2.545   1.129   8.033
   59   HG21  VAL   8          3HG2      VAL   8  -0.346   3.000   7.716
   60   HG22  VAL   8          1HG2      VAL   8   0.882   2.041   8.540
   61   HG23  VAL   8          2HG2      VAL   8  -0.769   2.080   9.159
   62    H    GLU   9           H        GLU   9  -1.984  -2.039   7.963
   63    HA   GLU   9           HA       GLU   9  -0.819  -4.018   6.263
   64    HB2  GLU   9           2HB      GLU   9  -3.601  -3.600   7.342
   65    HB3  GLU   9           1HB      GLU   9  -3.223  -4.910   6.234
   66    HG2  GLU   9           2HG      GLU   9  -1.487  -5.673   7.863
   67    HG3  GLU   9           1HG      GLU   9  -2.103  -4.465   8.989
   68    H    ILE  10           H        ILE  10  -1.131  -4.424   4.131
   69    HA   ILE  10           HA       ILE  10  -1.624  -2.320   2.375
   70    HB   ILE  10           HB       ILE  10  -0.332  -4.354   1.816
   71   HG12  ILE  10          2HG1      ILE  10  -1.788  -4.658  -0.481
   72   HG13  ILE  10          1HG1      ILE  10  -2.374  -3.107   0.110
   73   HG21  ILE  10          1HG2      ILE  10  -1.595  -6.341   0.988
   74   HG22  ILE  10          2HG2      ILE  10  -3.051  -5.642   1.695
   75   HG23  ILE  10          3HG2      ILE  10  -1.693  -6.086   2.729
   76   HD11  ILE  10          3HD1      ILE  10  -0.427  -2.067  -0.296
   77   HD12  ILE  10          1HD1      ILE  10  -0.228  -3.384  -1.450
   78   HD13  ILE  10          2HD1      ILE  10   0.543  -3.474   0.133
   79    H    GLU  11           H        GLU  11  -3.841  -4.641   3.775
   80    HA   GLU  11           HA       GLU  11  -5.991  -4.412   1.998
   81    HB2  GLU  11           2HB      GLU  11  -6.139  -4.801   4.993
   82    HB3  GLU  11           1HB      GLU  11  -7.387  -5.215   3.826
   83    HG2  GLU  11           2HG      GLU  11  -5.650  -6.768   2.782
   84    HG3  GLU  11           1HG      GLU  11  -4.727  -6.527   4.264
   85    H    ASP  12           H        ASP  12  -4.896  -2.301   4.577
   86    HA   ASP  12           HA       ASP  12  -7.244  -0.675   4.672
   87    HB2  ASP  12           2HB      ASP  12  -5.105  -0.969   6.309
   88    HB3  ASP  12           1HB      ASP  12  -4.662   0.520   5.482
   89    H    PHE  13           H        PHE  13  -4.303  -0.663   2.771
   90    HA   PHE  13           HA       PHE  13  -4.409   1.987   1.813
   91    HB2  PHE  13           2HB      PHE  13  -3.137  -0.542   0.797
   92    HB3  PHE  13           1HB      PHE  13  -3.089   0.931  -0.161
   93    HD1  PHE  13           1HD      PHE  13  -2.430  -0.131   3.364
   94    HD2  PHE  13           2HD      PHE  13  -1.217   2.227   0.034
   95    HE1  PHE  13           1HE      PHE  13  -0.451   0.617   4.618
   96    HE2  PHE  13           2HE      PHE  13   0.762   2.979   1.282
   97    HZ   PHE  13           HZ       PHE  13   1.149   2.174   3.578
   98    H    GLN  14           H        GLN  14  -4.971   2.720  -0.340
   99    HA   GLN  14           HA       GLN  14  -7.427   1.446  -1.297
  100    HB2  GLN  14           2HB      GLN  14  -7.374   3.899  -0.718
  101    HB3  GLN  14           1HB      GLN  14  -6.295   4.137  -2.084
  102    HG2  GLN  14           2HG      GLN  14  -7.958   4.052  -3.568
  103    HG3  GLN  14           1HG      GLN  14  -8.739   2.692  -2.764
  104   HE21  GLN  14          1HE2      GLN  14  -9.932   3.229  -0.748
  105   HE22  GLN  14          2HE2      GLN  14 -10.792   4.725  -0.696
  106    H    TYR  15           H        TYR  15  -6.516  -0.283  -2.458
  107    HA   TYR  15           HA       TYR  15  -4.489   0.029  -4.406
  108    HB2  TYR  15           2HB      TYR  15  -5.000  -2.156  -3.420
  109    HB3  TYR  15           1HB      TYR  15  -6.596  -2.133  -4.162
  110    HD1  TYR  15           2HD      TYR  15  -2.983  -1.922  -5.105
  111    HD2  TYR  15           1HD      TYR  15  -6.891  -3.201  -6.201
  112    HE1  TYR  15           2HE      TYR  15  -2.061  -2.995  -7.113
  113    HE2  TYR  15           1HE      TYR  15  -5.980  -4.277  -8.214
  114    HH   TYR  15           HH       TYR  15  -3.808  -5.187  -9.004
  115    H    ASP  16           H        ASP  16  -4.640  -0.056  -6.684
  116    HA   ASP  16           HA       ASP  16  -7.226   0.447  -7.910
  117    HB2  ASP  16           2HB      ASP  16  -5.794   2.632  -7.172
  118    HB3  ASP  16           1HB      ASP  16  -5.133   2.352  -8.779
  119    H    GLU  17           H        GLU  17  -7.151  -1.292  -9.241
  120    HA   GLU  17           HA       GLU  17  -4.931  -2.448 -10.418
  121    HB2  GLU  17           2HB      GLU  17  -6.591  -3.246 -12.212
  122    HB3  GLU  17           1HB      GLU  17  -6.901  -3.712 -10.546
  123    HG2  GLU  17           2HG      GLU  17  -8.718  -2.302 -10.352
  124    HG3  GLU  17           1HG      GLU  17  -8.181  -1.258 -11.668
  125    H    ASP  18           H        ASP  18  -6.707   0.395 -11.411
  126    HA   ASP  18           HA       ASP  18  -5.986   0.681 -14.056
  127    HB2  ASP  18           2HB      ASP  18  -7.470   2.190 -12.586
  128    HB3  ASP  18           1HB      ASP  18  -5.977   3.011 -12.144
  129    H    SER  19           H        SER  19  -4.154   1.719 -11.186
  130    HA   SER  19           HA       SER  19  -1.811   2.178 -12.911
  131    HB2  SER  19           2HB      SER  19  -2.504   3.251 -10.174
  132    HB3  SER  19           1HB      SER  19  -0.936   3.487 -10.947
  133    HG   SER  19           HG       SER  19  -1.981   5.216 -11.642
  134    H    GLU  20           H        GLU  20  -3.051   0.094 -10.473
  135    HA   GLU  20           HA       GLU  20  -2.198  -1.716  -9.402
  136    HB2  GLU  20           2HB      GLU  20   0.264  -1.444 -11.125
  137    HB3  GLU  20           1HB      GLU  20  -0.361  -2.897 -10.361
  138    HG2  GLU  20           2HG      GLU  20  -2.463  -2.261 -11.902
  139    HG3  GLU  20           1HG      GLU  20  -1.160  -1.576 -12.872
  140    H    THR  21           H        THR  21  -1.909   0.697  -8.143
  141    HA   THR  21           HA       THR  21   0.543   0.270  -6.598
  142    HB   THR  21           HB       THR  21  -0.366   3.014  -7.495
  143    HG1  THR  21           1HG      THR  21   1.214   2.945  -8.993
  144   HG21  THR  21          3HG2      THR  21   1.017   2.709  -5.330
  145   HG22  THR  21          1HG2      THR  21   1.511   3.918  -6.515
  146   HG23  THR  21          2HG2      THR  21   2.346   2.368  -6.436
  147    H    TYR  22           H        TYR  22   0.414   0.947  -4.413
  148    HA   TYR  22           HA       TYR  22  -2.343   1.340  -3.459
  149    HB2  TYR  22           2HB      TYR  22   0.077   0.303  -1.963
  150    HB3  TYR  22           1HB      TYR  22  -1.547   0.457  -1.304
  151    HD1  TYR  22           2HD      TYR  22   0.486  -1.341  -3.825
  152    HD2  TYR  22           1HD      TYR  22  -3.172  -1.226  -1.654
  153    HE1  TYR  22           2HE      TYR  22  -0.041  -3.611  -4.605
  154    HE2  TYR  22           1HE      TYR  22  -3.710  -3.496  -2.429
  155    HH   TYR  22           HH       TYR  22  -2.920  -4.919  -4.643
  156    H    PHE  23           H        PHE  23  -2.871   3.011  -2.083
  157    HA   PHE  23           HA       PHE  23  -0.727   4.920  -1.423
  158    HB2  PHE  23           2HB      PHE  23  -3.506   5.741  -2.278
  159    HB3  PHE  23           1HB      PHE  23  -2.111   6.783  -2.020
  160    HD1  PHE  23           2HD      PHE  23  -3.467   4.117  -4.201
  161    HD2  PHE  23           1HD      PHE  23  -0.602   7.234  -3.760
  162    HE1  PHE  23           2HE      PHE  23  -2.882   3.910  -6.580
  163    HE2  PHE  23           1HE      PHE  23  -0.012   7.034  -6.140
  164    HZ   PHE  23           HZ       PHE  23  -1.153   5.369  -7.555
  165    H    TYR  24           H        TYR  24  -1.184   6.345   0.386
  166    HA   TYR  24           HA       TYR  24  -3.324   5.451   2.180
  167    HB2  TYR  24           2HB      TYR  24  -0.915   4.417   2.599
  168    HB3  TYR  24           1HB      TYR  24  -0.643   5.967   3.390
  169    HD1  TYR  24           2HD      TYR  24  -3.367   3.399   3.279
  170    HD2  TYR  24           1HD      TYR  24  -0.943   5.949   5.673
  171    HE1  TYR  24           2HE      TYR  24  -4.487   2.561   5.296
  172    HE2  TYR  24           1HE      TYR  24  -2.057   5.116   7.699
  173    HH   TYR  24           HH       TYR  24  -4.316   2.438   7.596
  174    HA   PRO  25           HA       PRO  25  -3.853   9.826   2.685
  175    HB2  PRO  25           2HB      PRO  25  -5.250   9.810   5.030
  176    HB3  PRO  25           1HB      PRO  25  -5.964   9.422   3.461
  177    HG2  PRO  25           2HG      PRO  25  -4.980   7.577   5.604
  178    HG3  PRO  25           1HG      PRO  25  -6.452   7.466   4.619
  179    HD2  PRO  25           2HD      PRO  25  -4.256   6.000   4.079
  180    HD3  PRO  25           1HD      PRO  25  -5.317   6.614   2.793
  181    H    CYS  26           H        CYS  26  -2.344  11.220   3.326
  182    HA   CYS  26           HA       CYS  26  -0.780  10.636   5.730
  183    HB2  CYS  26           2HB      CYS  26  -0.049  11.525   3.202
  184    HB3  CYS  26           1HB      CYS  26   0.051  12.973   4.199
  185    HA   PRO  27           HA       PRO  27  -2.818  13.765   8.094
  186    HB2  PRO  27           2HB      PRO  27  -0.826  14.403   9.838
  187    HB3  PRO  27           1HB      PRO  27  -1.775  12.917   9.950
  188    HG2  PRO  27           2HG      PRO  27   0.951  13.339   8.791
  189    HG3  PRO  27           1HG      PRO  27   0.361  12.016   9.813
  190    HD2  PRO  27           2HD      PRO  27   0.630  11.766   7.137
  191    HD3  PRO  27           1HD      PRO  27  -0.646  10.930   8.047
  192    H    CYS  28           H        CYS  28   0.090  14.421   6.318
  193    HA   CYS  28           HA       CYS  28   0.201  17.223   6.925
  194    HB2  CYS  28           2HB      CYS  28   1.900  17.329   5.158
  195    HB3  CYS  28           1HB      CYS  28   2.219  15.997   6.264
  196    H    GLY  29           H        GLY  29  -1.158  15.251   4.321
  197    HA2  GLY  29           2HA      GLY  29  -3.290  16.709   3.613
  198    HA3  GLY  29           1HA      GLY  29  -1.996  17.598   2.821
  199    H    ASP  30           H        ASP  30  -0.355  15.651   1.895
  200    HA   ASP  30           HA       ASP  30  -1.865  14.605  -0.323
  201    HB2  ASP  30           2HB      ASP  30   0.701  15.484  -0.031
  202    HB3  ASP  30           1HB      ASP  30   0.943  13.742   0.020
  203    H    ASN  31           H        ASN  31  -0.732  12.210  -0.951
  204    HA   ASN  31           HA       ASN  31  -1.232  10.464   1.360
  205    HB2  ASN  31           2HB      ASN  31  -2.300   9.942  -1.424
  206    HB3  ASN  31           1HB      ASN  31  -2.561   8.951   0.007
  207   HD21  ASN  31          1HD2      ASN  31  -4.323  10.553  -1.898
  208   HD22  ASN  31          2HD2      ASN  31  -5.356  11.446  -0.839
  209    H    PHE  32           H        PHE  32  -0.007   8.621   1.474
  210    HA   PHE  32           HA       PHE  32   2.482   8.571   0.139
  211    HB2  PHE  32           2HB      PHE  32   1.017   6.688   1.953
  212    HB3  PHE  32           1HB      PHE  32   2.459   6.124   1.121
  213    HD1  PHE  32           2HD      PHE  32   4.585   7.576   1.394
  214    HD2  PHE  32           1HD      PHE  32   1.208   7.793   3.977
  215    HE1  PHE  32           2HE      PHE  32   5.995   8.568   3.149
  216    HE2  PHE  32           1HE      PHE  32   2.615   8.784   5.737
  217    HZ   PHE  32           HZ       PHE  32   5.011   9.173   5.323
  218    H    SER  33           H        SER  33   3.290   6.557  -1.048
  219    HA   SER  33           HA       SER  33   1.290   5.194  -2.650
  220    HB2  SER  33           2HB      SER  33   2.713   5.882  -4.755
  221    HB3  SER  33           1HB      SER  33   1.447   6.949  -4.152
  222    HG   SER  33           HG       SER  33   4.199   7.263  -4.132
  223    H    ILE  34           H        ILE  34   1.940   3.236  -3.391
  224    HA   ILE  34           HA       ILE  34   4.747   2.517  -3.482
  225    HB   ILE  34           HB       ILE  34   4.224   2.093  -1.131
  226   HG12  ILE  34          2HG1      ILE  34   4.268  -0.682  -2.128
  227   HG13  ILE  34          1HG1      ILE  34   5.469   0.384  -2.849
  228   HG21  ILE  34          1HG2      ILE  34   2.402   1.016  -0.354
  229   HG22  ILE  34          2HG2      ILE  34   2.355  -0.114  -1.707
  230   HG23  ILE  34          3HG2      ILE  34   1.716   1.519  -1.899
  231   HD11  ILE  34          3HD1      ILE  34   5.606  -0.948  -0.397
  232   HD12  ILE  34          1HD1      ILE  34   5.417   0.762  -0.014
  233   HD13  ILE  34          2HD1      ILE  34   6.741   0.232  -1.053
  234    H    THR  35           H        THR  35   5.048   1.295  -5.235
  235    HA   THR  35           HA       THR  35   2.845   0.343  -6.775
  236    HB   THR  35           HB       THR  35   4.792  -0.745  -8.122
  237    HG1  THR  35           1HG      THR  35   6.439  -0.664  -6.676
  238   HG21  THR  35          3HG2      THR  35   3.610   1.435  -8.653
  239   HG22  THR  35          1HG2      THR  35   5.246   1.237  -9.281
  240   HG23  THR  35          2HG2      THR  35   4.965   2.236  -7.855
  241    H    LYS  36           H        LYS  36   2.276  -1.779  -7.319
  242    HA   LYS  36           HA       LYS  36   2.236  -3.632  -5.219
  243    HB2  LYS  36           2HB      LYS  36   0.549  -3.626  -6.981
  244    HB3  LYS  36           1HB      LYS  36   1.757  -4.079  -8.173
  245    HG2  LYS  36           2HG      LYS  36   0.968  -6.148  -7.808
  246    HG3  LYS  36           1HG      LYS  36   2.040  -6.102  -6.408
  247    HD2  LYS  36           2HD      LYS  36   0.271  -5.589  -4.941
  248    HD3  LYS  36           1HD      LYS  36  -0.810  -5.160  -6.267
  249    HE2  LYS  36           2HE      LYS  36  -0.669  -7.561  -7.012
  250    HE3  LYS  36           1HE      LYS  36   0.172  -7.903  -5.500
  251    HZ1  LYS  36           3HZ      LYS  36  -2.064  -8.388  -5.094
  252    HZ2  LYS  36           1HZ      LYS  36  -2.618  -6.994  -5.877
  253    HZ3  LYS  36           2HZ      LYS  36  -1.837  -6.871  -4.381
  254    H    GLU  37           H        GLU  37   4.352  -3.379  -8.037
  255    HA   GLU  37           HA       GLU  37   5.670  -5.843  -7.784
  256    HB2  GLU  37           2HB      GLU  37   5.750  -4.054  -9.679
  257    HB3  GLU  37           1HB      GLU  37   7.080  -3.374  -8.750
  258    HG2  GLU  37           2HG      GLU  37   7.805  -5.985  -8.859
  259    HG3  GLU  37           1HG      GLU  37   6.968  -5.797 -10.398
  260    H    ASP  38           H        ASP  38   6.262  -2.713  -6.254
  261    HA   ASP  38           HA       ASP  38   8.764  -3.234  -5.120
  262    HB2  ASP  38           2HB      ASP  38   6.530  -1.358  -4.540
  263    HB3  ASP  38           1HB      ASP  38   7.698  -1.617  -3.250
  264    H    LEU  39           H        LEU  39   5.507  -3.767  -3.793
  265    HA   LEU  39           HA       LEU  39   6.321  -4.810  -1.312
  266    HB2  LEU  39           2HB      LEU  39   3.815  -5.534  -2.822
  267    HB3  LEU  39           1HB      LEU  39   4.072  -5.651  -1.092
  268    HG   LEU  39           HG       LEU  39   4.261  -2.986  -2.447
  269   HD11  LEU  39          1HD1      LEU  39   1.834  -2.695  -1.884
  270   HD12  LEU  39          2HD1      LEU  39   1.747  -4.446  -1.683
  271   HD13  LEU  39          3HD1      LEU  39   2.172  -3.758  -3.249
  272   HD21  LEU  39          3HD2      LEU  39   4.923  -3.437  -0.031
  273   HD22  LEU  39          1HD2      LEU  39   3.204  -3.678   0.279
  274   HD23  LEU  39          2HD2      LEU  39   3.784  -2.122  -0.315
  275    H    GLU  40           H        GLU  40   5.582  -6.419  -4.396
  276    HA   GLU  40           HA       GLU  40   5.882  -9.067  -3.488
  277    HB2  GLU  40           2HB      GLU  40   5.951  -7.729  -6.152
  278    HB3  GLU  40           1HB      GLU  40   6.549  -9.378  -6.036
  279    HG2  GLU  40           2HG      GLU  40   4.339  -9.935  -4.916
  280    HG3  GLU  40           1HG      GLU  40   3.790  -8.353  -5.470
  281    H    ASN  41           H        ASN  41   8.232  -6.670  -4.518
  282    HA   ASN  41           HA       ASN  41  10.403  -8.575  -4.635
  283    HB2  ASN  41           2HB      ASN  41  10.075  -5.665  -5.153
  284    HB3  ASN  41           1HB      ASN  41  11.682  -6.222  -4.704
  285   HD21  ASN  41          1HD2      ASN  41  12.627  -5.889  -6.667
  286   HD22  ASN  41          2HD2      ASN  41  12.224  -6.792  -8.083
  287    H    GLY  42           H        GLY  42   9.254  -6.084  -2.389
  288    HA2  GLY  42           2HA      GLY  42   9.831  -6.985  -0.006
  289    HA3  GLY  42           1HA      GLY  42  11.469  -6.679  -0.565
  290    H    GLU  43           H        GLU  43  10.143  -4.324  -2.152
  291    HA   GLU  43           HA       GLU  43  10.828  -2.303  -0.291
  292    HB2  GLU  43           2HB      GLU  43   9.559  -2.266  -3.022
  293    HB3  GLU  43           1HB      GLU  43   9.752  -0.790  -2.086
  294    HG2  GLU  43           2HG      GLU  43  11.956  -2.632  -2.985
  295    HG3  GLU  43           1HG      GLU  43  11.565  -1.054  -3.667
  296    H    ASP  44           H        ASP  44   9.457  -2.825   1.480
  297    HA   ASP  44           HA       ASP  44   6.605  -2.258   1.156
  298    HB2  ASP  44           2HB      ASP  44   6.488  -3.042   3.571
  299    HB3  ASP  44           1HB      ASP  44   6.957  -4.251   2.386
  300    H    VAL  45           H        VAL  45   8.296  -0.081   0.822
  301    HA   VAL  45           HA       VAL  45   7.643   1.517   3.203
  302    HB   VAL  45           HB       VAL  45  10.065   1.166   3.139
  303   HG11  VAL  45          1HG1      VAL  45  10.299   2.755   0.625
  304   HG12  VAL  45          2HG1      VAL  45   9.996   1.021   0.524
  305   HG13  VAL  45          3HG1      VAL  45  11.437   1.616   1.347
  306   HG21  VAL  45          3HG2      VAL  45  10.753   3.534   3.187
  307   HG22  VAL  45          1HG2      VAL  45   9.240   3.250   4.046
  308   HG23  VAL  45          2HG2      VAL  45   9.218   3.975   2.439
  309    H    ALA  46           H        ALA  46   6.540   3.337   2.848
  310    HA   ALA  46           HA       ALA  46   6.191   4.200   0.055
  311    HB1  ALA  46           1HB      ALA  46   4.232   3.379   1.778
  312    HB2  ALA  46           2HB      ALA  46   3.983   4.413   0.372
  313    HB3  ALA  46           3HB      ALA  46   4.182   5.132   1.970
  314    H    THR  47           H        THR  47   6.653   6.260  -0.477
  315    HA   THR  47           HA       THR  47   7.442   8.071   1.710
  316    HB   THR  47           HB       THR  47   8.573   8.061  -1.096
  317    HG1  THR  47           1HG      THR  47   9.441   6.274  -0.294
  318   HG21  THR  47          3HG2      THR  47   9.967   9.719  -0.505
  319   HG22  THR  47          1HG2      THR  47  10.098   9.163   1.164
  320   HG23  THR  47          2HG2      THR  47   8.690  10.095   0.653
  321    H    CYS  48           H        CYS  48   6.508  10.019   1.805
  322    HA   CYS  48           HA       CYS  48   4.441  10.647  -0.136
  323    HB2  CYS  48           2HB      CYS  48   4.087  10.811   2.362
  324    HB3  CYS  48           1HB      CYS  48   5.172  12.198   2.353
  325    HA   PRO  49           HA       PRO  49   7.064  13.499  -2.324
  326    HB2  PRO  49           2HB      PRO  49   5.152  14.758  -3.773
  327    HB3  PRO  49           1HB      PRO  49   5.716  13.124  -4.141
  328    HG2  PRO  49           2HG      PRO  49   3.256  13.994  -2.675
  329    HG3  PRO  49           1HG      PRO  49   3.442  12.714  -3.887
  330    HD2  PRO  49           2HD      PRO  49   3.329  12.216  -1.223
  331    HD3  PRO  49           1HD      PRO  49   4.256  11.207  -2.353
  332    H    SER  50           H        SER  50   4.729  14.399   0.001
  333    HA   SER  50           HA       SER  50   5.343  17.248  -0.259
  334    HB2  SER  50           2HB      SER  50   3.235  15.755   1.304
  335    HB3  SER  50           1HB      SER  50   3.543  17.479   1.522
  336    HG   SER  50           HG       SER  50   2.033  17.466  -0.019
  337    H    CYS  51           H        CYS  51   4.838  15.144   2.595
  338    HA   CYS  51           HA       CYS  51   6.692  16.684   4.142
  339    HB2  CYS  51           2HB      CYS  51   6.259  15.028   5.923
  340    HB3  CYS  51           1HB      CYS  51   4.773  15.673   5.232
  341    H    SER  52           H        SER  52   6.908  13.756   2.261
  342    HA   SER  52           HA       SER  52   8.678  12.476   1.635
  343    HB2  SER  52           2HB      SER  52   9.772  14.953   1.855
  344    HB3  SER  52           1HB      SER  52  10.739  14.071   3.036
  345    HG   SER  52           HG       SER  52  10.475  13.624   0.267
  346    H    LEU  53           H        LEU  53   7.270  11.754   3.886
  347    HA   LEU  53           HA       LEU  53   9.235  10.928   5.886
  348    HB2  LEU  53           2HB      LEU  53   6.410  11.509   5.891
  349    HB3  LEU  53           1HB      LEU  53   6.694   9.907   6.540
  350    HG   LEU  53           HG       LEU  53   8.253  10.852   8.195
  351   HD11  LEU  53          1HD1      LEU  53   8.590  12.935   6.563
  352   HD12  LEU  53          2HD1      LEU  53   8.879  13.028   8.300
  353   HD13  LEU  53          3HD1      LEU  53   7.359  13.616   7.627
  354   HD21  LEU  53          3HD2      LEU  53   5.490  12.046   8.094
  355   HD22  LEU  53          1HD2      LEU  53   6.537  12.103   9.513
  356   HD23  LEU  53          2HD2      LEU  53   5.988  10.550   8.883
  357    H    ILE  54           H        ILE  54   8.388   8.578   6.813
  358    HA   ILE  54           HA       ILE  54   8.288   6.755   4.500
  359    HB   ILE  54           HB       ILE  54   9.835   5.229   5.782
  360   HG12  ILE  54          2HG1      ILE  54  10.342   7.760   7.370
  361   HG13  ILE  54          1HG1      ILE  54   9.618   6.280   7.989
  362   HG21  ILE  54          1HG2      ILE  54  11.636   6.038   4.655
  363   HG22  ILE  54          2HG2      ILE  54  11.383   7.692   5.212
  364   HG23  ILE  54          3HG2      ILE  54  10.388   7.038   3.911
  365   HD11  ILE  54          3HD1      ILE  54  12.384   6.346   6.832
  366   HD12  ILE  54          1HD1      ILE  54  11.648   5.111   7.852
  367   HD13  ILE  54          2HD1      ILE  54  12.055   6.687   8.530
  368    H    ILE  55           H        ILE  55   7.147   4.858   4.779
  369    HA   ILE  55           HA       ILE  55   6.038   4.237   7.408
  370    HB   ILE  55           HB       ILE  55   3.750   3.949   6.469
  371   HG12  ILE  55          2HG1      ILE  55   4.381   5.803   4.231
  372   HG13  ILE  55          1HG1      ILE  55   4.845   4.119   4.026
  373   HG21  ILE  55          1HG2      ILE  55   4.313   5.902   7.807
  374   HG22  ILE  55          2HG2      ILE  55   3.146   6.315   6.551
  375   HG23  ILE  55          3HG2      ILE  55   4.842   6.756   6.357
  376   HD11  ILE  55          3HD1      ILE  55   2.245   4.002   4.978
  377   HD12  ILE  55          1HD1      ILE  55   2.779   3.756   3.315
  378   HD13  ILE  55          2HD1      ILE  55   2.247   5.352   3.843
  379    H    LYS  56           H        LYS  56   5.502   2.072   7.696
  380    HA   LYS  56           HA       LYS  56   6.582   0.275   5.667
  381    HB2  LYS  56           2HB      LYS  56   7.262   0.056   8.060
  382    HB3  LYS  56           1HB      LYS  56   5.604  -0.373   8.453
  383    HG2  LYS  56           2HG      LYS  56   6.405  -2.466   8.249
  384    HG3  LYS  56           1HG      LYS  56   6.083  -2.187   6.537
  385    HD2  LYS  56           2HD      LYS  56   8.354  -1.696   6.092
  386    HD3  LYS  56           1HD      LYS  56   8.734  -1.552   7.808
  387    HE2  LYS  56           2HE      LYS  56   7.676  -4.138   6.763
  388    HE3  LYS  56           1HE      LYS  56   9.363  -3.720   6.465
  389    HZ1  LYS  56           3HZ      LYS  56   9.335  -4.939   8.457
  390    HZ2  LYS  56           1HZ      LYS  56   8.009  -4.086   9.075
  391    HZ3  LYS  56           2HZ      LYS  56   9.515  -3.328   8.939
  392    H    VAL  57           H        VAL  57   5.499  -1.116   4.499
  393    HA   VAL  57           HA       VAL  57   2.575  -1.135   4.784
  394    HB   VAL  57           HB       VAL  57   3.786  -2.147   2.271
  395   HG11  VAL  57          1HG1      VAL  57   1.400  -2.070   2.523
  396   HG12  VAL  57          2HG1      VAL  57   1.879  -0.852   1.340
  397   HG13  VAL  57          3HG1      VAL  57   1.466  -0.370   2.985
  398   HG21  VAL  57          3HG2      VAL  57   3.724   0.813   2.876
  399   HG22  VAL  57          1HG2      VAL  57   4.152   0.061   1.341
  400   HG23  VAL  57          2HG2      VAL  57   5.185  -0.163   2.750
  401    H    ILE  58           H        ILE  58   1.827  -2.900   5.739
  402    HA   ILE  58           HA       ILE  58   3.329  -5.396   5.625
  403    HB   ILE  58           HB       ILE  58   0.758  -4.869   7.115
  404   HG12  ILE  58          2HG1      ILE  58   2.494  -3.270   7.824
  405   HG13  ILE  58          1HG1      ILE  58   2.133  -4.434   9.094
  406   HG21  ILE  58          1HG2      ILE  58   1.150  -7.197   6.905
  407   HG22  ILE  58          2HG2      ILE  58   1.636  -6.749   8.540
  408   HG23  ILE  58          3HG2      ILE  58   2.861  -7.015   7.298
  409   HD11  ILE  58          3HD1      ILE  58   4.435  -4.293   9.148
  410   HD12  ILE  58          1HD1      ILE  58   4.574  -4.191   7.393
  411   HD13  ILE  58          2HD1      ILE  58   4.161  -5.726   8.157
  412    H    TYR  59           H        TYR  59   2.699  -7.192   4.536
  413    HA   TYR  59           HA       TYR  59   0.016  -7.416   3.446
  414    HB2  TYR  59           2HB      TYR  59   0.992  -7.826   1.118
  415    HB3  TYR  59           1HB      TYR  59   0.948  -6.154   1.669
  416    HD1  TYR  59           1HD      TYR  59   3.137  -9.035   0.984
  417    HD2  TYR  59           2HD      TYR  59   2.963  -4.940   2.116
  418    HE1  TYR  59           1HE      TYR  59   5.556  -8.832   0.599
  419    HE2  TYR  59           2HE      TYR  59   5.372  -4.724   1.728
  420    HH   TYR  59           HH       TYR  59   7.141  -6.507  -0.002
  421    H    ASP  60           H        ASP  60   0.043  -9.504   1.907
  422    HA   ASP  60           HA       ASP  60   1.045 -11.646   3.578
  423    HB2  ASP  60           2HB      ASP  60  -1.287 -11.535   2.482
  424    HB3  ASP  60           1HB      ASP  60  -0.466 -11.978   0.989
  425    H    LYS  61           H        LYS  61   3.244 -11.799   3.278
  426    HA   LYS  61           HA       LYS  61   4.584 -11.553   0.827
  427    HB2  LYS  61           2HB      LYS  61   5.350 -12.986   3.366
  428    HB3  LYS  61           1HB      LYS  61   6.423 -12.867   1.978
  429    HG2  LYS  61           2HG      LYS  61   5.274 -10.330   2.947
  430    HG3  LYS  61           1HG      LYS  61   6.425 -11.129   4.017
  431    HD2  LYS  61           2HD      LYS  61   7.943 -11.307   1.966
  432    HD3  LYS  61           1HD      LYS  61   6.852 -10.143   1.210
  433    HE2  LYS  61           2HE      LYS  61   7.238  -8.741   3.339
  434    HE3  LYS  61           1HE      LYS  61   8.630  -9.790   3.596
  435    HZ1  LYS  61           3HZ      LYS  61   9.193  -9.142   1.175
  436    HZ2  LYS  61           1HZ      LYS  61   9.521  -8.041   2.420
  437    HZ3  LYS  61           2HZ      LYS  61   8.152  -7.834   1.447
  438    H    ASP  62           H        ASP  62   3.019 -14.322   2.336
  439    HA   ASP  62           HA       ASP  62   4.124 -16.304   0.645
  440    HB2  ASP  62           2HB      ASP  62   1.776 -16.161   2.475
  441    HB3  ASP  62           1HB      ASP  62   1.804 -17.455   1.281
  442    H    GLN  63           H        GLN  63   1.407 -14.096   0.291
  443    HA   GLN  63           HA       GLN  63   0.499 -15.405  -2.138
  444    HB2  GLN  63           2HB      GLN  63  -0.447 -13.135  -0.459
  445    HB3  GLN  63           1HB      GLN  63  -0.939 -13.174  -2.146
  446    HG2  GLN  63           2HG      GLN  63  -1.458 -15.730  -1.349
  447    HG3  GLN  63           1HG      GLN  63  -1.810 -14.808   0.112
  448   HE21  GLN  63          1HE2      GLN  63  -2.829 -12.491  -0.873
  449   HE22  GLN  63          2HE2      GLN  63  -4.297 -12.804  -1.729
  450    H    PHE  64           H        PHE  64   2.291 -12.516  -1.195
  451    HA   PHE  64           HA       PHE  64   2.391 -11.412  -3.832
  452    HB2  PHE  64           2HB      PHE  64   3.643 -10.770  -1.200
  453    HB3  PHE  64           1HB      PHE  64   4.404 -10.126  -2.651
  454    HD1  PHE  64           2HD      PHE  64   1.055 -10.367  -1.020
  455    HD2  PHE  64           1HD      PHE  64   3.683  -8.107  -3.491
  456    HE1  PHE  64           2HE      PHE  64  -0.571  -8.522  -1.058
  457    HE2  PHE  64           1HE      PHE  64   2.061  -6.259  -3.532
  458    HZ   PHE  64           HZ       PHE  64  -0.070  -6.464  -2.315
  459    H    VAL  65           H        VAL  65   5.075 -12.640  -1.796
  460    HA   VAL  65           HA       VAL  65   6.398 -13.523  -4.274
  461    HB   VAL  65           HB       VAL  65   7.637 -11.760  -3.145
  462   HG11  VAL  65          1HG1      VAL  65   8.493 -13.299  -0.830
  463   HG12  VAL  65          2HG1      VAL  65   6.777 -12.902  -0.797
  464   HG13  VAL  65          3HG1      VAL  65   7.975 -11.617  -0.946
  465   HG21  VAL  65          3HG2      VAL  65   9.007 -14.433  -2.860
  466   HG22  VAL  65          1HG2      VAL  65   9.804 -12.865  -2.982
  467   HG23  VAL  65          2HG2      VAL  65   8.882 -13.493  -4.347
  468    H    SER  66           H        SER  66   5.643 -15.592  -4.414
  469    HA   SER  66           HA       SER  66   6.165 -17.390  -2.142
  470    HB2  SER  66           2HB      SER  66   3.815 -17.158  -3.230
  471    HB3  SER  66           1HB      SER  66   4.497 -18.132  -4.534
  472    HG   SER  66           HG       SER  66   3.920 -19.721  -3.269
  473    H    GLY  67           H        GLY  67   8.270 -16.498  -3.927
  474    HA2  GLY  67           2HA      GLY  67   8.806 -18.688  -5.743
  475    HA3  GLY  67           1HA      GLY  67   9.853 -17.310  -5.427
  476    H    GLU  68           H        GLU  68  10.284 -17.431  -2.759
  477    HA   GLU  68           HA       GLU  68  11.711 -19.987  -2.471
  478    HB2  GLU  68           2HB      GLU  68  13.143 -18.750  -0.840
  479    HB3  GLU  68           1HB      GLU  68  13.220 -18.121  -2.480
  480    HG2  GLU  68           2HG      GLU  68  11.746 -16.295  -1.878
  481    HG3  GLU  68           1HG      GLU  68  11.577 -16.944  -0.247
  482    H    THR  69           H        THR  69   8.902 -19.694  -1.828
  483    HA   THR  69           HA       THR  69   9.029 -20.377   1.026
  484    HB   THR  69           HB       THR  69   6.689 -18.882  -0.145
  485    HG1  THR  69           1HG      THR  69   9.023 -17.814   1.055
  486   HG21  THR  69          3HG2      THR  69   6.138 -19.881   1.928
  487   HG22  THR  69          1HG2      THR  69   6.413 -18.166   2.231
  488   HG23  THR  69          2HG2      THR  69   7.651 -19.346   2.660
  489    H    VAL  70           H        VAL  70   7.698 -22.051   1.677
  490    HA   VAL  70           HA       VAL  70   6.718 -23.752  -0.450
  491    HB   VAL  70           HB       VAL  70   7.985 -24.763   1.388
  492   HG11  VAL  70          1HG1      VAL  70   6.657 -23.081   3.051
  493   HG12  VAL  70          2HG1      VAL  70   7.547 -24.509   3.578
  494   HG13  VAL  70          3HG1      VAL  70   5.801 -24.594   3.344
  495   HG21  VAL  70          3HG2      VAL  70   6.156 -25.990   0.135
  496   HG22  VAL  70          1HG2      VAL  70   5.147 -25.743   1.559
  497   HG23  VAL  70          2HG2      VAL  70   6.638 -26.675   1.687
  498    HA   PRO  71           HA       PRO  71   2.611 -21.927  -0.204
  499    HB2  PRO  71           2HB      PRO  71   1.984 -24.344  -1.818
  500    HB3  PRO  71           1HB      PRO  71   1.617 -22.647  -2.143
  501    HG2  PRO  71           2HG      PRO  71   3.551 -23.897  -3.481
  502    HG3  PRO  71           1HG      PRO  71   3.740 -22.208  -2.970
  503    HD2  PRO  71           2HD      PRO  71   4.913 -24.693  -1.789
  504    HD3  PRO  71           1HD      PRO  71   5.643 -23.087  -1.994
  505    H    ALA  72           H        ALA  72   1.234 -22.185   1.434
  506    HA   ALA  72           HA       ALA  72   0.611 -24.914   2.356
  507    HB1  ALA  72           1HB      ALA  72   1.980 -24.195   4.068
  508    HB2  ALA  72           2HB      ALA  72   0.384 -23.742   4.666
  509    HB3  ALA  72           3HB      ALA  72   1.435 -22.523   3.946
  510    HA   PRO  73           HA       PRO  73  -3.646 -23.766   1.983
  511    HB2  PRO  73           2HB      PRO  73  -4.775 -25.431   3.799
  512    HB3  PRO  73           1HB      PRO  73  -4.116 -26.004   2.262
  513    HG2  PRO  73           2HG      PRO  73  -2.870 -26.039   4.986
  514    HG3  PRO  73           1HG      PRO  73  -2.901 -27.315   3.755
  515    HD2  PRO  73           2HD      PRO  73  -0.751 -25.715   4.141
  516    HD3  PRO  73           1HD      PRO  73  -1.186 -26.362   2.544
  517    H    SER  74           H        SER  74  -5.545 -23.015   3.270
  518    HA   SER  74           HA       SER  74  -5.180 -22.134   5.961
  519    HB2  SER  74           2HB      SER  74  -3.898 -20.475   4.335
  520    HB3  SER  74           1HB      SER  74  -5.518 -19.818   4.100
  521    HG   SER  74           HG       SER  74  -5.643 -19.564   6.383
  522    H    ALA  75           H        ALA  75  -7.135 -22.706   6.664
  523    HA   ALA  75           HA       ALA  75  -9.488 -21.576   5.310
  524    HB1  ALA  75           1HB      ALA  75  -9.318 -24.404   6.357
  525    HB2  ALA  75           2HB      ALA  75  -9.275 -23.939   4.656
  526    HB3  ALA  75           3HB      ALA  75 -10.726 -23.644   5.614
  527    H    ASN  76           H        ASN  76 -10.269 -20.154   6.742
  528    HA   ASN  76           HA       ASN  76  -9.903 -20.401   9.558
  529    HB2  ASN  76           2HB      ASN  76 -11.486 -18.430   9.667
  530    HB3  ASN  76           1HB      ASN  76 -10.038 -18.185   8.701
  531   HD21  ASN  76          1HD2      ASN  76 -12.056 -16.488   8.334
  532   HD22  ASN  76          2HD2      ASN  76 -12.855 -16.779   6.830
  533    H    LYS  77           H        LYS  77 -10.971 -21.716  10.864
  534    HA   LYS  77           HA       LYS  77 -13.853 -22.076  10.510
  535    HB2  LYS  77           2HB      LYS  77 -12.133 -23.994   9.590
  536    HB3  LYS  77           1HB      LYS  77 -12.436 -24.557  11.227
  537    HG2  LYS  77           2HG      LYS  77 -14.506 -24.010   9.110
  538    HG3  LYS  77           1HG      LYS  77 -13.979 -25.591   9.691
  539    HD2  LYS  77           2HD      LYS  77 -14.697 -24.542  12.025
  540    HD3  LYS  77           1HD      LYS  77 -15.741 -23.577  10.979
  541    HE2  LYS  77           2HE      LYS  77 -16.883 -25.587  11.774
  542    HE3  LYS  77           1HE      LYS  77 -16.686 -25.607  10.022
  543    HZ1  LYS  77           3HZ      LYS  77 -14.656 -26.915  11.697
  544    HZ2  LYS  77           1HZ      LYS  77 -15.153 -27.284  10.121
  545    HZ3  LYS  77           2HZ      LYS  77 -16.130 -27.703  11.436
  546    H    GLU  78           H        GLU  78 -14.978 -22.257  12.386
  547    HA   GLU  78           HA       GLU  78 -15.472 -22.202  14.594
  548    HB2  GLU  78           2HB      GLU  78 -13.954 -24.368  14.373
  549    HB3  GLU  78           1HB      GLU  78 -12.862 -23.417  15.370
  550    HG2  GLU  78           2HG      GLU  78 -14.324 -23.375  17.166
  551    HG3  GLU  78           1HG      GLU  78 -15.725 -23.744  16.160
  552    H    LEU  79           H        LEU  79 -15.002 -19.841  14.068
  553    HA   LEU  79           HA       LEU  79 -13.551 -18.725  16.272
  554    HB2  LEU  79           2HB      LEU  79 -12.050 -17.310  14.851
  555    HB3  LEU  79           1HB      LEU  79 -11.633 -19.012  14.903
  556    HG   LEU  79           HG       LEU  79 -13.248 -18.887  12.684
  557   HD11  LEU  79          1HD1      LEU  79 -11.859 -16.273  13.045
  558   HD12  LEU  79          2HD1      LEU  79 -13.460 -16.620  12.390
  559   HD13  LEU  79          3HD1      LEU  79 -12.022 -16.957  11.428
  560   HD21  LEU  79          3HD2      LEU  79 -11.393 -20.135  12.353
  561   HD22  LEU  79          1HD2      LEU  79 -10.345 -19.013  13.219
  562   HD23  LEU  79          2HD2      LEU  79 -10.831 -18.665  11.560
  563    H    VAL  80           H        VAL  80 -16.262 -18.647  15.232
  564    HA   VAL  80           HA       VAL  80 -16.681 -16.110  13.980
  565    HB   VAL  80           HB       VAL  80 -18.256 -17.964  13.644
  566   HG11  VAL  80          1HG1      VAL  80 -19.763 -18.712  15.341
  567   HG12  VAL  80          2HG1      VAL  80 -19.156 -17.513  16.483
  568   HG13  VAL  80          3HG1      VAL  80 -18.124 -18.849  15.976
  569   HG21  VAL  80          3HG2      VAL  80 -19.707 -15.730  15.033
  570   HG22  VAL  80          1HG2      VAL  80 -20.209 -16.659  13.620
  571   HG23  VAL  80          2HG2      VAL  80 -18.886 -15.501  13.490
  572    H    LYS  81           H        LYS  81 -16.768 -14.180  14.889
  573    HA   LYS  81           HA       LYS  81 -17.307 -14.000  17.782
  574    HB2  LYS  81           2HB      LYS  81 -15.854 -11.898  17.683
  575    HB3  LYS  81           1HB      LYS  81 -15.030 -13.446  17.593
  576    HG2  LYS  81           2HG      LYS  81 -14.608 -13.208  15.291
  577    HG3  LYS  81           1HG      LYS  81 -15.757 -11.880  15.137
  578    HD2  LYS  81           2HD      LYS  81 -13.924 -10.583  15.271
  579    HD3  LYS  81           1HD      LYS  81 -14.062 -10.880  17.005
  580    HE2  LYS  81           2HE      LYS  81 -12.259 -12.248  17.050
  581    HE3  LYS  81           1HE      LYS  81 -12.601 -12.924  15.459
  582    HZ1  LYS  81           3HZ      LYS  81 -10.710 -11.721  15.057
  583    HZ2  LYS  81           1HZ      LYS  81 -11.099 -10.499  16.161
  584    HZ3  LYS  81           2HZ      LYS  81 -11.885 -10.569  14.666
  585    H    LEU  82           H        LEU  82 -19.300 -13.223  18.008
  586    HA   LEU  82           HA       LEU  82 -20.628 -11.623  16.078
  587    HB2  LEU  82           2HB      LEU  82 -21.255 -12.312  18.942
  588    HB3  LEU  82           1HB      LEU  82 -22.297 -11.281  17.982
  589    HG   LEU  82           HG       LEU  82 -22.214 -13.328  16.304
  590   HD11  LEU  82          1HD1      LEU  82 -20.782 -14.835  17.298
  591   HD12  LEU  82          2HD1      LEU  82 -22.353 -15.414  17.853
  592   HD13  LEU  82          3HD1      LEU  82 -21.338 -14.453  18.927
  593   HD21  LEU  82          3HD2      LEU  82 -24.334 -12.839  16.935
  594   HD22  LEU  82          1HD2      LEU  82 -23.920 -12.727  18.645
  595   HD23  LEU  82          2HD2      LEU  82 -24.132 -14.307  17.891
  596    H    GLU  83           H        GLU  83 -21.581  -9.460  16.549
  597    HA   GLU  83           HA       GLU  83 -20.103  -7.774  18.391
  598    HB2  GLU  83           2HB      GLU  83 -19.015  -8.001  15.942
  599    HB3  GLU  83           1HB      GLU  83 -20.172  -6.717  15.619
  600    HG2  GLU  83           2HG      GLU  83 -19.010  -5.200  16.789
  601    HG3  GLU  83           1HG      GLU  83 -18.579  -6.350  18.054
  602    H    HIS  84           H        HIS  84 -20.885  -5.389  18.072
  603    HA   HIS  84           HA       HIS  84 -23.809  -5.491  17.991
  604    HB2  HIS  84           2HB      HIS  84 -21.886  -3.457  19.134
  605    HB3  HIS  84           1HB      HIS  84 -23.631  -3.228  19.094
  606    HD1  HIS  84           1HD      HIS  84 -20.998  -5.424  20.672
  607    HD2  HIS  84           2HD      HIS  84 -25.027  -4.497  21.097
  608    HE1  HIS  84           1HE      HIS  84 -21.716  -6.513  22.822
  609    HE2  HIS  84           2HE      HIS  84 -24.137  -5.871  23.098