*HEADER    DNA BINDING PROTEIN                     09-JUN-12   2LUA              
*TITLE     SOLUTION STRUCTURE OF CXC DOMAIN OF MSL2                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN MALE-SPECIFIC LETHAL-2;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: CXC DOMAIN;                                                
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER;                        
*SOURCE   3 ORGANISM_COMMON: FRUIT FLY;                                          
*SOURCE   4 ORGANISM_TAXID: 7227;                                                
*SOURCE   5 GENE: MSL-2, CG3241;                                                 
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET28A                                    
*KEYWDS    DNA BINDING PROTEIN, METAL BINDING                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.FENG, K.YE, S.ZHENG, J.WANG                                         
*REVDAT   1   17-OCT-12 2LUA    0                                                


assign (resid 55 and name HG2) (resid 55 and name HD1) 2.25 0.45 0.45  !ambig!     c13noe.609
    or (resid 37 and name HG1) (resid 37 and name HB1)                 !!     c13noe.609
    or (resid 55 and name HG2) (resid 55 and name HB1)                 !!     c13noe.609
    or (resid 55 and name HG1) (resid 55 and name HD2)                 !!     c13noe.609
    or (resid 55 and name HG1) (resid 55 and name HB1)                 !!     c13noe.609
    or (resid 55 and name HG2) (resid 55 and name HD2)                 !!     c13noe.609
    or (resid 55 and name HG1) (resid 55 and name HD1)                 !!     c13noe.609
assign (resid 55 and name HG2) (resid 55 and name HE1) 2.66 0.86 0.86  !ambig!     c13noe.699
    or (resid 37 and name HG1) (resid 37 and name HE2)                 !!     c13noe.699
    or (resid 37 and name HG1) (resid 37 and name HE1)                 !!     c13noe.699
    or (resid 55 and name HG2) (resid 55 and name HE2)                 !!     c13noe.699
    or (resid 55 and name HG1) (resid 55 and name HE1)                 !!     c13noe.699
    or (resid 55 and name HG1) (resid 55 and name HE2)                 !!     c13noe.699
assign (resid 55 and name HD1) (resid 55 and name HE2) 2.63 0.83 0.83  !ambig!     c13noe.799
    or (resid 51 and name HD2) (resid 51 and name HE1)                 !!     c13noe.799
    or (resid 55 and name HD2) (resid 55 and name HE1)                 !!     c13noe.799
    or (resid 55 and name HD2) (resid 55 and name HE2)                 !!     c13noe.799
    or (resid 51 and name HD2) (resid 51 and name HE2)                 !!     c13noe.799
    or (resid 55 and name HD1) (resid 55 and name HE1)                 !!     c13noe.799
assign (resid 28 and name HB2) (resid 50 and name HA) 2.98 1.18 1.18  !ambig!     c13noe.367
    or (resid 42 and name HB2) (resid 52 and name HB2)                 !!     c13noe.367
    or (resid 28 and name HB2) (resid 16 and name HB2)                 !!     c13noe.367
    or (resid 28 and name HB2) (resid 52 and name HB2)                 !!     c13noe.367
    or (resid 28 and name HB2) (resid 16 and name HB1)                 !!     c13noe.367
assign (resid 15 and name HG2) (resid 15 and name HD2) 2.67 0.87 0.87  !ambig!     c13noe.505
    or (resid 15 and name HG1) (resid 15 and name HD2)                 !!     c13noe.505
    or (resid 15 and name HG2) (resid 15 and name HD1)                 !!     c13noe.505
    or (resid 15 and name HG1) (resid 15 and name HD1)                 !!     c13noe.505
assign (resid 50 and name HA) (resid 50 and name HB2) 2.46 0.66 0.66  !ambig!     c13noe.37
    or (resid 50 and name HA) (resid 28 and name HB2)                 !!     c13noe.37
    or (resid 50 and name HA) (resid 27 and name HB)                 !!     c13noe.37
    or (resid 50 and name HA) (resid 28 and name HB1)                 !!     c13noe.37
assign (resid 29 and name HD2) (resid 51 and name HB2) 2.93 1.13 1.13  !ambig!     c13noe.744
    or (resid 29 and name HD2) (resid 51 and name HD2)                 !!     c13noe.744
    or (resid 29 and name HD1) (resid 51 and name HB2)                 !!     c13noe.744
    or (resid 29 and name HD1) (resid 51 and name HD2)                 !!     c13noe.744
assign (resid 37 and name HD2) (resid 37 and name HE1) 2.85 1.05 1.05  !ambig!     c13noe.778
    or (resid 37 and name HD1) (resid 37 and name HE2)                 !!     c13noe.778
    or (resid 37 and name HD2) (resid 37 and name HE2)                 !!     c13noe.778
    or (resid 37 and name HD1) (resid 37 and name HE1)                 !!     c13noe.778
assign (resid 9 and name HD1) (resid 9 and name HG1) 2.43 0.63 0.63  !ambig!     c13noe.605
    or (resid 10 and name HD1) (resid 10 and name HG1)                 !!     c13noe.605
    or (resid 9 and name HD1) (resid 9 and name HG2)                 !!     c13noe.605
    or (resid 10 and name HD1) (resid 10 and name HG2)                 !!     c13noe.605
assign (resid 29 and name HD2) (resid 26 and name HA) 3.02 1.22 1.22  !ambig!     c13noe.739
    or (resid 29 and name HD1) (resid 26 and name HA)                 !!     c13noe.739
    or (resid 29 and name HD1) (resid 53 and name HD2)                 !!     c13noe.739
    or (resid 29 and name HD2) (resid 53 and name HD2)                 !!     c13noe.739
assign (resid 51 and name HG2) (resid 51 and name HE2) 2.75 0.95 0.95  !ambig!     c13noe.529
    or (resid 51 and name HG2) (resid 51 and name HE1)                 !!     c13noe.529
    or (resid 51 and name HG1) (resid 51 and name HE1)                 !!     c13noe.529
    or (resid 51 and name HG1) (resid 51 and name HE2)                 !!     c13noe.529
assign (resid 15 and name HD2) (resid 15 and name HG2) 2.49 0.69 0.69  !ambig!     c13noe.115
    or (resid 15 and name HD1) (resid 15 and name HG2)                 !!     c13noe.115
    or (resid 15 and name HD2) (resid 15 and name HG1)                 !!     c13noe.115
    or (resid 15 and name HD1) (resid 15 and name HG1)                 !!     c13noe.115
assign (resid 16 and name HB2) (resid 27 and name HB) 3.50 1.70 1.70  !ambig!     c13noe.346
    or (resid 16 and name HB1) (resid 27 and name HB)                 !!     c13noe.346
    or (resid 16 and name HB2) (resid 28 and name HB1)                 !!     c13noe.346
    or (resid 16 and name HB1) (resid 28 and name HB1)                 !!     c13noe.346
assign (resid 29 and name HD2) (resid 29 and name HB1) 2.41 0.61 0.61  !ambig!     c13noe.746
    or (resid 29 and name HD1) (resid 29 and name HG1)                 !!     c13noe.746
    or (resid 29 and name HD2) (resid 29 and name HG1)                 !!     c13noe.746
    or (resid 29 and name HD1) (resid 29 and name HB1)                 !!     c13noe.746
assign (resid 28 and name HB1) (resid 52 and name HB2) 3.36 1.56 1.56  !ambig!     c13noe.678
    or (resid 28 and name HB1) (resid 50 and name HA)                 !!     c13noe.678
    or (resid 28 and name HB1) (resid 16 and name HB2)                 !!     c13noe.678
    or (resid 28 and name HB1) (resid 16 and name HB1)                 !!     c13noe.678
assign (resid 34 and name HG2) (resid 34 and name HD2) 2.40 0.60 0.60  !ambig!     c13noe.488
    or (resid 34 and name HG1) (resid 34 and name HD2)                 !!     c13noe.488
    or (resid 34 and name HG1) (resid 34 and name HA)                 !!     c13noe.488
    or (resid 34 and name HG2) (resid 34 and name HA)                 !!     c13noe.488
assign (resid 15 and name HG2) (resid 46 and name HB2) 3.34 1.54 1.54  !ambig!     c13noe.507
    or (resid 15 and name HG1) (resid 46 and name HB2)                 !!     c13noe.507
    or (resid 15 and name HG2) (resid 47 and name HB2)                 !!     c13noe.507
    or (resid 15 and name HG1) (resid 47 and name HB2)                 !!     c13noe.507
assign (resid 18 and name HA) (resid 18 and name HG2#) 2.36 0.56 0.56  !ambig!     c13noe.623
    or (resid 18 and name HA) (resid 48 and name HG1#)                 !!     c13noe.623
    or (resid 18 and name HA) (resid 18 and name HD1#)                 !!     c13noe.623
    or (resid 18 and name HA) (resid 48 and name HG2#)                 !!     c13noe.623
assign (resid 29 and name HD1) (resid 53 and name HG1) 3.88 2.08 2.08  !ambig!     c13noe.742
    or (resid 29 and name HD1) (resid 53 and name HB2)                 !!     c13noe.742
    or (resid 29 and name HD2) (resid 53 and name HG1)                 !!     c13noe.742
    or (resid 29 and name HD2) (resid 53 and name HB2)                 !!     c13noe.742
assign (resid 11 and name HD2) (resid 11 and name HN) 2.91 1.11 1.11  !ambig!     c13noe.299
    or (resid 11 and name HD1) (resid 11 and name HN)                 !!     c13noe.299
    or (resid 11 and name HB2) (resid 11 and name HN)                 !!     c13noe.299
assign (resid 47 and name HB1) (resid 48 and name HG1#) 3.90 2.10 2.10  !ambig!     c13noe.279
    or (resid 47 and name HB1) (resid 18 and name HD1#)                 !!     c13noe.279
    or (resid 47 and name HB1) (resid 48 and name HG2#)                 !!     c13noe.279
assign (resid 44 and name HA2) (resid 13 and name HG2) 2.82 1.02 1.02  !ambig!     c13noe.710
    or (resid 17 and name HA2) (resid 27 and name HG2#)                 !!     c13noe.710
    or (resid 44 and name HA2) (resid 43 and name HB#)                 !!     c13noe.710
assign (resid 18 and name HG11) (resid 18 and name HA) 2.78 0.98 0.98  !ambig!     c13noe.452
    or (resid 29 and name HG1) (resid 53 and name HD1)                 !!     c13noe.452
    or (resid 18 and name HG11) (resid 16 and name HA)                 !!     c13noe.452
assign (resid 13 and name HG1) (resid 45 and name HA) 3.63 1.83 1.83  !ambig!     c13noe.697
    or (resid 37 and name HG1) (resid 31 and name HB2)                 !!     c13noe.697
    or (resid 37 and name HG1) (resid 31 and name HB1)                 !!     c13noe.697
assign (resid 31 and name HA) (resid 37 and name HB1) 3.42 1.62 1.62  !ambig!     c13noe.661
    or (resid 31 and name HA) (resid 32 and name HG2)                 !!     c13noe.661
    or (resid 31 and name HA) (resid 32 and name HG1)                 !!     c13noe.661
assign (resid 55 and name HG2) (resid 55 and name HN) 2.83 1.03 1.03  !ambig!     c13noe.518
    or (resid 55 and name HG1) (resid 55 and name HN)                 !!     c13noe.518
    or (resid 37 and name HG1) (resid 37 and name HN)                 !!     c13noe.518
assign (resid 45 and name HA) (resid 46 and name HN) 2.33 0.53 0.53  !ambig!     c13noe.756
    or (resid 36 and name HA) (resid 36 and name HN)                 !!     c13noe.756
    or (resid 36 and name HA) (resid 40 and name HN)                 !!     c13noe.756
assign (resid 11 and name HB2) (resid 11 and name HA) 2.61 0.81 0.81  !ambig!     c13noe.340
    or (resid 11 and name HD1) (resid 11 and name HA)                 !!     c13noe.340
    or (resid 11 and name HD2) (resid 11 and name HA)                 !!     c13noe.340
assign (resid 47 and name HB1) (resid 27 and name HG2#) 3.47 1.67 1.67  !long!     c13noe.280
assign (resid 51 and name HB1) (resid 50 and name HA) 3.12 1.32 1.32  !ambig!     c13noe.376
    or (resid 51 and name HB1) (resid 29 and name HD2)                 !!     c13noe.376
    or (resid 51 and name HB1) (resid 29 and name HD1)                 !!     c13noe.376
assign (resid 47 and name HB2) (resid 18 and name HD1#) 3.90 2.10 2.10  !ambig!     c13noe.281
    or (resid 47 and name HB2) (resid 48 and name HG1#)                 !!     c13noe.281
    or (resid 47 and name HB2) (resid 48 and name HG2#)                 !!     c13noe.281
assign (resid 27 and name HG2#) (resid 16 and name HB2) 2.35 0.55 0.55  !ambig!     c13noe.558
    or (resid 27 and name HG2#) (resid 50 and name HA)                 !!     c13noe.558
    or (resid 27 and name HG2#) (resid 16 and name HB1)                 !!     c13noe.558
assign (resid 43 and name HB#) (resid 11 and name HD1) 3.49 1.69 1.69  !ambig!     c13noe.7
    or (resid 43 and name HB#) (resid 11 and name HD2)                 !!     c13noe.7
    or (resid 43 and name HB#) (resid 11 and name HB2)                 !!     c13noe.7
assign (resid 13 and name HB2) (resid 46 and name HN) 2.67 0.87 0.87  !ambig!     c13noe.195
    or (resid 48 and name HB) (resid 48 and name HN)                 !!     c13noe.195
    or (resid 13 and name HB1) (resid 46 and name HN)                 !!     c13noe.195
assign (resid 47 and name HB2) (resid 50 and name HB2) 3.05 1.25 1.25  !ambig!     c13noe.261
    or (resid 47 and name HB2) (resid 28 and name HB2)                 !!     c13noe.261
    or (resid 47 and name HB2) (resid 45 and name HB1)                 !!     c13noe.261
assign (resid 28 and name HA) (resid 33 and name HB2) 2.46 0.66 0.66  !ambig!     c13noe.627
    or (resid 28 and name HA) (resid 36 and name HB1)                 !!     c13noe.627
    or (resid 28 and name HA) (resid 35 and name HB2)                 !!     c13noe.627
assign (resid 29 and name HG1) (resid 29 and name HB2) 2.20 0.40 0.40  !ambig!     c13noe.468
    or (resid 18 and name HG11) (resid 18 and name HD1#)                 !!     c13noe.468
    or (resid 18 and name HG11) (resid 18 and name HG2#)                 !!     c13noe.468
assign (resid 47 and name HB1) (resid 16 and name HB1) 2.81 1.01 1.01  !ambig!     c13noe.266
    or (resid 47 and name HB1) (resid 50 and name HA)                 !!     c13noe.266
    or (resid 47 and name HB1) (resid 16 and name HB2)                 !!     c13noe.266
assign (resid 27 and name HB) (resid 50 and name HA) 3.08 1.28 1.28  !ambig!     c13noe.22
    or (resid 27 and name HB) (resid 16 and name HB2)                 !!     c13noe.22
    or (resid 27 and name HB) (resid 16 and name HB1)                 !!     c13noe.22
assign (resid 21 and name HB1) (resid 21 and name HA) 2.44 0.64 0.64  !ambig!     c13noe.716
    or (resid 19 and name HB1) (resid 19 and name HA)                 !!     c13noe.716
    or (resid 19 and name HB2) (resid 19 and name HA)                 !!     c13noe.716
assign (resid 52 and name HB1) (resid 42 and name HB2) 2.55 0.75 0.75  !ambig!     c13noe.148
    or (resid 52 and name HB1) (resid 28 and name HB1)                 !!     c13noe.148
    or (resid 52 and name HB1) (resid 28 and name HB2)                 !!     c13noe.148
assign (resid 21 and name HB1) (resid 22 and name HN) 3.34 1.54 1.54  !ambig!     c13noe.714
    or (resid 19 and name HB1) (resid 19 and name HN)                 !!     c13noe.714
    or (resid 19 and name HB2) (resid 19 and name HN)                 !!     c13noe.714
assign (resid 39 and name HA) (resid 39 and name HB2) 2.44 0.64 0.64  !ambig!     c13noe.70
    or (resid 39 and name HA) (resid 54 and name HB2)                 !!     c13noe.70
    or (resid 39 and name HA) (resid 54 and name HB1)                 !!     c13noe.70
assign (resid 27 and name HA) (resid 16 and name HB1) 3.11 1.31 1.31  !ambig!     c13noe.668
    or (resid 27 and name HA) (resid 50 and name HA)                 !!     c13noe.668
    or (resid 27 and name HA) (resid 16 and name HB2)                 !!     c13noe.668
assign (resid 47 and name HB2) (resid 16 and name HB2) 2.75 0.95 0.95  !ambig!     c13noe.269
    or (resid 47 and name HB2) (resid 50 and name HA)                 !!     c13noe.269
    or (resid 47 and name HB2) (resid 16 and name HB1)                 !!     c13noe.269
assign (resid 11 and name HG2) (resid 11 and name HD1) 2.19 0.39 0.39  !ambig!     c13noe.608
    or (resid 11 and name HG2) (resid 11 and name HB2)                 !!     c13noe.608
    or (resid 11 and name HG2) (resid 11 and name HD2)                 !!     c13noe.608
assign (resid 52 and name HB2) (resid 28 and name HB1) 2.54 0.74 0.74  !ambig!     c13noe.150
    or (resid 52 and name HB2) (resid 42 and name HB2)                 !!     c13noe.150
    or (resid 52 and name HB2) (resid 28 and name HB2)                 !!     c13noe.150
assign (resid 28 and name HB2) (resid 27 and name HG2#) 3.69 1.89 1.89  !ambig!     c13noe.394
    or (resid 28 and name HB2) (resid 29 and name HB1)                 !!     c13noe.394
assign (resid 28 and name HB1) (resid 51 and name HN) 2.87 1.07 1.07  !ambig!     c13noe.676
    or (resid 28 and name HB1) (resid 29 and name HN)                 !!     c13noe.676
assign (resid 13 and name HB2) (resid 13 and name HA) 2.53 0.73 0.73  !ambig!     c13noe.204
    or (resid 13 and name HB1) (resid 13 and name HA)                 !!     c13noe.204
assign (resid 51 and name HB2) (resid 51 and name HG2) 2.29 0.49 0.49  !ambig!     c13noe.390
    or (resid 51 and name HB2) (resid 51 and name HG1)                 !!     c13noe.390
assign (resid 42 and name HA) (resid 45 and name HB2) 3.32 1.52 1.52  !ambig!     c13noe.673
    or (resid 42 and name HA) (resid 52 and name HB1)                 !!     c13noe.673
assign (resid 53 and name HD2) (resid 29 and name HB1) 3.38 1.58 1.58  !ambig!     c13noe.587
    or (resid 53 and name HD2) (resid 29 and name HG1)                 !!     c13noe.587
assign (resid 28 and name HB1) (resid 52 and name HB1) 3.35 1.55 1.55  !ambig!     c13noe.679
    or (resid 28 and name HB1) (resid 36 and name HB2)                 !!     c13noe.679
assign (resid 55 and name HB1) (resid 55 and name HG1) 2.29 0.49 0.49  !ambig!     c13noe.680
    or (resid 55 and name HB1) (resid 55 and name HG2)                 !!     c13noe.680
assign (resid 39 and name HB1) (resid 39 and name HD#) 2.89 1.09 1.09  !intra!     c13noe.200
assign (resid 29 and name HB2) (resid 26 and name HA) 3.18 1.38 1.38  !ambig!     c13noe.343
    or (resid 29 and name HB2) (resid 53 and name HD2)                 !!     c13noe.343
assign (resid 39 and name HB2) (resid 39 and name HD#) 2.92 1.12 1.12  !intra!     c13noe.201
assign (resid 16 and name HB1) (resid 27 and name HG2#) 2.55 0.75 0.75  !ambig!     c13noe.396
    or (resid 16 and name HB2) (resid 27 and name HG2#)                 !!     c13noe.396
assign (resid 13 and name HG2) (resid 44 and name HA1) 3.76 1.96 1.96  !ambig!     c13noe.527
    or (resid 13 and name HG2) (resid 45 and name HA)                 !!     c13noe.527
assign (resid 55 and name HG2) (resid 55 and name HA) 2.70 0.90 0.90  !ambig!     c13noe.524
    or (resid 55 and name HG1) (resid 55 and name HA)                 !!     c13noe.524
assign (resid 56 and name HB2) (resid 56 and name HA) 2.77 0.97 0.97  !ambig!     c13noe.408
    or (resid 56 and name HB1) (resid 56 and name HA)                 !!     c13noe.408
assign (resid 28 and name HA) (resid 27 and name HG2#) 3.68 1.88 1.88  !ambig!     c13noe.702
    or (resid 28 and name HA) (resid 29 and name HB1)                 !!     c13noe.702
assign (resid 36 and name HB2) (resid 28 and name HB1) 3.85 2.05 2.05  !ambig!     c13noe.175
    or (resid 36 and name HB2) (resid 28 and name HB2)                 !!     c13noe.175
assign (resid 36 and name HB1) (resid 36 and name HE#) 3.90 2.10 2.10  !intra!     c13noe.170
assign (resid 51 and name HB2) (resid 51 and name HN) 2.92 1.12 1.12  !ambig!     c13noe.312
    or (resid 51 and name HB2) (resid 29 and name HN)                 !!     c13noe.312
assign (resid 9 and name HB1) (resid 9 and name HD2) 3.45 1.65 1.65  !ambig!     c13noe.413
    or (resid 9 and name HB1) (resid 10 and name HD2)                 !!     c13noe.413
assign (resid 36 and name HB2) (resid 36 and name HD#) 2.59 0.79 0.79  !intra!     c13noe.167
assign (resid 36 and name HB1) (resid 36 and name HD#) 2.62 0.82 0.82  !intra!     c13noe.169
assign (resid 36 and name HB2) (resid 36 and name HE#) 3.77 1.97 1.97  !intra!     c13noe.168
assign (resid 37 and name HG2) (resid 37 and name HE2) 3.27 1.47 1.47  !ambig!     c13noe.528
    or (resid 37 and name HG2) (resid 37 and name HE1)                 !!     c13noe.528
assign (resid 51 and name HG2) (resid 51 and name HB1) 2.53 0.73 0.73  !ambig!     c13noe.533
    or (resid 51 and name HG1) (resid 51 and name HB1)                 !!     c13noe.533
assign (resid 55 and name HG1) (resid 55 and name HB2) 2.75 0.95 0.95  !ambig!     c13noe.532
    or (resid 55 and name HG2) (resid 55 and name HB2)                 !!     c13noe.532
assign (resid 13 and name HG2) (resid 13 and name HB2) 2.31 0.51 0.51  !ambig!     c13noe.534
    or (resid 13 and name HG2) (resid 13 and name HB1)                 !!     c13noe.534
assign (resid 10 and name HD1) (resid 10 and name HA) 2.50 0.70 0.70  !ambig!     c13noe.607
    or (resid 9 and name HD1) (resid 8 and name HA)                 !!     c13noe.607
assign (resid 9 and name HD1) (resid 9 and name HB1) 2.86 1.06 1.06  !ambig!     c13noe.606
    or (resid 10 and name HD1) (resid 9 and name HB1)                 !!     c13noe.606
assign (resid 13 and name HB1) (resid 13 and name HN) 2.80 1.00 1.00  !ambig!     c13noe.693
    or (resid 13 and name HB2) (resid 13 and name HN)                 !!     c13noe.693
assign (resid 37 and name HG1) (resid 37 and name HA) 3.22 1.42 1.42  !ambig!     c13noe.698
    or (resid 13 and name HG1) (resid 44 and name HA2)                 !!     c13noe.698
assign (resid 15 and name HG2) (resid 15 and name HA) 2.96 1.16 1.16  !ambig!     c13noe.700
    or (resid 15 and name HG1) (resid 15 and name HA)                 !!     c13noe.700
assign (resid 13 and name HG2) (resid 13 and name HE2) 3.37 1.57 1.57  !ambig!     c13noe.530
    or (resid 13 and name HG2) (resid 13 and name HE1)                 !!     c13noe.530
assign (resid 13 and name HB2) (resid 13 and name HG1) 2.79 0.99 0.99  !ambig!     c13noe.531
    or (resid 13 and name HB1) (resid 13 and name HG1)                 !!     c13noe.531
assign (resid 18 and name HB) (resid 18 and name HG2#) 2.37 0.57 0.57  !ambig!     c13noe.185
    or (resid 18 and name HB) (resid 18 and name HD1#)                 !!     c13noe.185
assign (resid 42 and name HB2) (resid 52 and name HB1) 2.67 0.87 0.87  !ambig!     c13noe.366
    or (resid 28 and name HB2) (resid 52 and name HB1)                 !!     c13noe.366
assign (resid 53 and name HG1) (resid 36 and name HE#) 3.01 1.21 1.21  !long!     c13noe.639
assign (resid 53 and name HG2) (resid 36 and name HE#) 3.10 1.30 1.30  !long!     c13noe.640
assign (resid 33 and name HB2) (resid 28 and name HB1) 3.78 1.98 1.98  !ambig!     c13noe.350
    or (resid 33 and name HB2) (resid 28 and name HB2)                 !!     c13noe.350
assign (resid 33 and name HB2) (resid 28 and name HA) 2.47 0.67 0.67  !ambig!     c13noe.349
    or (resid 33 and name HB2) (resid 34 and name HD1)                 !!     c13noe.349
assign (resid 33 and name HB1) (resid 28 and name HB1) 3.90 2.10 2.10  !ambig!     c13noe.348
    or (resid 33 and name HB1) (resid 28 and name HB2)                 !!     c13noe.348
assign (resid 28 and name HB1) (resid 33 and name HB2) 3.78 1.98 1.98  !ambig!     c13noe.368
    or (resid 28 and name HB1) (resid 47 and name HB2)                 !!     c13noe.368
assign (resid 33 and name HB1) (resid 28 and name HA) 2.79 0.99 0.99  !ambig!     c13noe.347
    or (resid 33 and name HB1) (resid 34 and name HD1)                 !!     c13noe.347
assign (resid 47 and name HB2) (resid 16 and name HN) 2.81 1.01 1.01  !ambig!     c13noe.245
    or (resid 47 and name HB2) (resid 47 and name HN)                 !!     c13noe.245
assign (resid 47 and name HB1) (resid 16 and name HN) 2.60 0.80 0.80  !ambig!     c13noe.244
    or (resid 47 and name HB1) (resid 47 and name HN)                 !!     c13noe.244
assign (resid 29 and name HG1) (resid 29 and name HD1) 2.65 0.85 0.85  !ambig!     c13noe.644
    or (resid 29 and name HG1) (resid 29 and name HD2)                 !!     c13noe.644
assign (resid 16 and name HB2) (resid 47 and name HB1) 3.20 1.40 1.40  !ambig!     c13noe.369
    or (resid 16 and name HB1) (resid 47 and name HB1)                 !!     c13noe.369
assign (resid 16 and name HB1) (resid 47 and name HB2) 2.79 0.99 0.99  !ambig!     c13noe.370
    or (resid 16 and name HB2) (resid 47 and name HB2)                 !!     c13noe.370
assign (resid 16 and name HB2) (resid 17 and name HN) 2.80 1.00 1.00  !ambig!     c13noe.292
    or (resid 16 and name HB1) (resid 17 and name HN)                 !!     c13noe.292
assign (resid 45 and name HB1) (resid 13 and name HB2) 3.67 1.87 1.87  !ambig!     c13noe.273
    or (resid 45 and name HB1) (resid 13 and name HB1)                 !!     c13noe.273
assign (resid 16 and name HA) (resid 16 and name HB2) 2.27 0.47 0.47  !ambig!     c13noe.625
    or (resid 16 and name HA) (resid 16 and name HB1)                 !!     c13noe.625
assign (resid 28 and name HA) (resid 28 and name HB1) 2.33 0.53 0.53  !ambig!     c13noe.626
    or (resid 28 and name HA) (resid 28 and name HB2)                 !!     c13noe.626
assign (resid 34 and name HB2) (resid 34 and name HD1) 2.84 1.04 1.04  !ambig!     c13noe.355
    or (resid 53 and name HB1) (resid 53 and name HD1)                 !!     c13noe.355
assign (resid 59 and name HB) (resid 59 and name HG2#) 3.19 1.39 1.39  !ambig!     c13noe.282
    or (resid 59 and name HB) (resid 59 and name HG1#)                 !!     c13noe.282
assign (resid 55 and name HB2) (resid 55 and name HG1) 2.51 0.71 0.71  !ambig!     c13noe.277
    or (resid 55 and name HB2) (resid 55 and name HG2)                 !!     c13noe.277
assign (resid 34 and name HD2) (resid 33 and name HA) 2.56 0.76 0.76  !ambig!     c13noe.585
    or (resid 53 and name HD2) (resid 52 and name HA)                 !!     c13noe.585
assign (resid 16 and name HB1) (resid 28 and name HN) 3.59 1.79 1.79  !ambig!     c13noe.288
    or (resid 16 and name HB2) (resid 28 and name HN)                 !!     c13noe.288
assign (resid 47 and name HB2) (resid 16 and name HA) 3.90 2.10 2.10  !ambig!     c13noe.260
    or (resid 47 and name HB2) (resid 28 and name HA)                 !!     c13noe.260
assign (resid 34 and name HD2) (resid 34 and name HG2) 2.60 0.80 0.80  !ambig!     c13noe.586
    or (resid 34 and name HD2) (resid 34 and name HG1)                 !!     c13noe.586
assign (resid 27 and name HA) (resid 29 and name HN) 3.12 1.32 1.32  !ambig!     c13noe.629
    or (resid 27 and name HA) (resid 51 and name HN)                 !!     c13noe.629
assign (resid 16 and name HA) (resid 17 and name HN) 2.40 0.60 0.60  !ambig!     c13noe.581
    or (resid 16 and name HA) (resid 15 and name HN)                 !!     c13noe.581
assign (resid 28 and name HB2) (resid 52 and name HN) 3.14 1.34 1.34  !ambig!     c13noe.287
    or (resid 42 and name HB2) (resid 52 and name HN)                 !!     c13noe.287
assign (resid 10 and name HB2) (resid 10 and name HG2) 2.19 0.39 0.39  !ambig!     c13noe.383
    or (resid 10 and name HB2) (resid 10 and name HG1)                 !!     c13noe.383
assign (resid 31 and name HA) (resid 36 and name HD#) 3.11 1.31 1.31  !long!     c13noe.664
assign (resid 28 and name HB2) (resid 51 and name HN) 2.82 1.02 1.02  !ambig!     c13noe.303
    or (resid 28 and name HB2) (resid 29 and name HN)                 !!     c13noe.303
assign (resid 13 and name HB2) (resid 13 and name HG1) 2.28 0.48 0.48  !ambig!     c13noe.225
    or (resid 13 and name HB1) (resid 13 and name HG1)                 !!     c13noe.225
assign (resid 14 and name HB1) (resid 34 and name HG2) 2.59 0.79 0.79  !ambig!     c13noe.221
    or (resid 14 and name HB1) (resid 34 and name HG1)                 !!     c13noe.221
assign (resid 14 and name HB2) (resid 34 and name HG2) 2.76 0.96 0.96  !ambig!     c13noe.220
    or (resid 14 and name HB2) (resid 34 and name HG1)                 !!     c13noe.220
assign (resid 18 and name HG2#) (resid 19 and name HA) 3.76 1.96 1.96  !ambig!     c13noe.666
    or (resid 18 and name HG2#) (resid 17 and name HA1)                 !!     c13noe.666
assign (resid 14 and name HB2) (resid 34 and name HD1) 3.06 1.26 1.26  !ambig!     c13noe.211
    or (resid 14 and name HB2) (resid 16 and name HA)                 !!     c13noe.211
assign (resid 51 and name HB1) (resid 51 and name HG2) 2.22 0.42 0.42  !ambig!     c13noe.387
    or (resid 51 and name HB1) (resid 51 and name HG1)                 !!     c13noe.387
assign (resid 27 and name HG2#) (resid 51 and name HN) 3.33 1.53 1.53  !ambig!     c13noe.545
    or (resid 27 and name HG2#) (resid 29 and name HN)                 !!     c13noe.545
assign (resid 13 and name HB2) (resid 45 and name HA) 2.76 0.96 0.96  !ambig!     c13noe.215
    or (resid 13 and name HB1) (resid 45 and name HA)                 !!     c13noe.215
assign (resid 10 and name HB1) (resid 10 and name HG2) 2.45 0.65 0.65  !ambig!     c13noe.385
    or (resid 10 and name HB1) (resid 10 and name HG1)                 !!     c13noe.385
assign (resid 16 and name HB2) (resid 16 and name HA) 2.39 0.59 0.59  !ambig!     c13noe.345
    or (resid 16 and name HB1) (resid 16 and name HA)                 !!     c13noe.345
assign (resid 48 and name HB) (resid 48 and name HG2#) 2.27 0.47 0.47  !ambig!     c13noe.226
    or (resid 48 and name HB) (resid 48 and name HG1#)                 !!     c13noe.226
assign (resid 11 and name HG1) (resid 11 and name HE1) 3.00 1.20 1.20  !ambig!     c13noe.556
    or (resid 11 and name HG1) (resid 11 and name HE2)                 !!     c13noe.556
assign (resid 11 and name HB1) (resid 11 and name HE1) 3.08 1.28 1.28  !ambig!     c13noe.377
    or (resid 11 and name HB1) (resid 11 and name HE2)                 !!     c13noe.377
assign (resid 11 and name HB2) (resid 11 and name HE1) 3.02 1.22 1.22  !ambig!     c13noe.378
    or (resid 11 and name HB2) (resid 11 and name HE2)                 !!     c13noe.378
assign (resid 10 and name HB1) (resid 11 and name HN) 3.59 1.79 1.79  !ambig!     c13noe.297
    or (resid 11 and name HB2) (resid 11 and name HN)                 !!     c13noe.297
assign (resid 42 and name HB1) (resid 45 and name HB2) 2.86 1.06 1.06  !ambig!     c13noe.374
    or (resid 42 and name HB1) (resid 52 and name HB1)                 !!     c13noe.374
assign (resid 32 and name HA) (resid 32 and name HG2) 2.61 0.81 0.81  !ambig!     c13noe.651
    or (resid 32 and name HA) (resid 32 and name HG1)                 !!     c13noe.651
assign (resid 11 and name HG2) (resid 11 and name HE1) 3.07 1.27 1.27  !ambig!     c13noe.555
    or (resid 11 and name HG2) (resid 11 and name HE2)                 !!     c13noe.555
assign (resid 55 and name HB1) (resid 56 and name HN) 2.77 0.97 0.97  !ambig!     c13noe.231
    or (resid 55 and name HB1) (resid 55 and name HN)                 !!     c13noe.231
assign (resid 55 and name HB2) (resid 55 and name HN) 2.82 1.02 1.02  !ambig!     c13noe.230
    or (resid 55 and name HB2) (resid 56 and name HN)                 !!     c13noe.230
assign (resid 56 and name HB2) (resid 56 and name HG1) 2.38 0.58 0.58  !ambig!     c13noe.659
    or (resid 56 and name HB2) (resid 56 and name HG2)                 !!     c13noe.659
assign (resid 53 and name HD1) (resid 29 and name HB1) 3.02 1.22 1.22  !ambig!     c13noe.657
    or (resid 53 and name HD1) (resid 29 and name HG1)                 !!     c13noe.657
assign (resid 50 and name HB2) (resid 50 and name HN) 2.58 0.78 0.78  !ambig!     c13noe.233
    or (resid 45 and name HB1) (resid 45 and name HN)                 !!     c13noe.233
assign (resid 25 and name HB2) (resid 25 and name HD2#) 2.54 0.74 0.74  !ambig!     c13noe.614
    or (resid 25 and name HB2) (resid 25 and name HD1#)                 !!     c13noe.614
assign (resid 58 and name HB1) (resid 58 and name HD#) 2.86 1.06 1.06  !intra!     c13noe.164
assign (resid 12 and name HG2) (resid 12 and name HA) 3.05 1.25 1.25  !ambig!     c13noe.491
    or (resid 12 and name HG1) (resid 12 and name HA)                 !!     c13noe.491
assign (resid 10 and name HG2) (resid 10 and name HA) 2.71 0.91 0.91  !ambig!     c13noe.490
    or (resid 10 and name HG1) (resid 10 and name HA)                 !!     c13noe.490
assign (resid 53 and name HD2) (resid 36 and name HE#) 3.12 1.32 1.32  !long!     c13noe.589
assign (resid 37 and name HA) (resid 31 and name HA) 3.47 1.67 1.67  !ambig!     c13noe.68
    or (resid 37 and name HA) (resid 38 and name HB1)                 !!     c13noe.68
assign (resid 39 and name HA) (resid 39 and name HD#) 2.93 1.13 1.13  !intra!     c13noe.67
assign (resid 37 and name HA) (resid 36 and name HD#) 3.08 1.28 1.28  !seq!     c13noe.66
assign (resid 46 and name HB1) (resid 15 and name HG2) 3.52 1.72 1.72  !ambig!     c13noe.459
    or (resid 46 and name HB1) (resid 15 and name HG1)                 !!     c13noe.459
assign (resid 35 and name HA) (resid 34 and name HB2) 3.31 1.51 1.51  !ambig!     c13noe.55
    or (resid 35 and name HA) (resid 12 and name HB1)                 !!     c13noe.55
assign (resid 48 and name HG1#) (resid 18 and name HA) 3.02 1.22 1.22  !ambig!     c13noe.790
    or (resid 48 and name HG2#) (resid 18 and name HA)                 !!     c13noe.790
assign (resid 18 and name HD1#) (resid 15 and name HD1) 3.53 1.73 1.73  !ambig!     c13noe.53
    or (resid 18 and name HD1#) (resid 15 and name HD2)                 !!     c13noe.53
assign (resid 13 and name HB2) (resid 13 and name HG2) 2.50 0.70 0.70  !ambig!     c13noe.787
    or (resid 13 and name HB1) (resid 13 and name HG2)                 !!     c13noe.787
assign (resid 48 and name HG1#) (resid 48 and name HN) 2.91 1.11 1.11  !ambig!     c13noe.788
    or (resid 48 and name HG2#) (resid 48 and name HN)                 !!     c13noe.788
assign (resid 34 and name HG2) (resid 33 and name HA) 3.44 1.64 1.64  !ambig!     c13noe.487
    or (resid 34 and name HG1) (resid 33 and name HA)                 !!     c13noe.487
assign (resid 12 and name HD1) (resid 12 and name HG1) 2.54 0.74 0.74  !ambig!     c13noe.599
    or (resid 12 and name HD1) (resid 12 and name HG2)                 !!     c13noe.599
assign (resid 29 and name HA) (resid 29 and name HB1) 2.53 0.73 0.73  !ambig!     c13noe.81
    or (resid 29 and name HA) (resid 29 and name HG1)                 !!     c13noe.81
assign (resid 29 and name HA) (resid 36 and name HB1) 3.54 1.74 1.74  !ambig!     c13noe.80
    or (resid 29 and name HA) (resid 33 and name HB2)                 !!     c13noe.80
assign (resid 29 and name HA) (resid 53 and name HD1) 3.40 1.60 1.60  !ambig!     c13noe.79
    or (resid 29 and name HA) (resid 28 and name HA)                 !!     c13noe.79
assign (resid 10 and name HG2) (resid 10 and name HD2) 2.37 0.57 0.57  !ambig!     c13noe.497
    or (resid 10 and name HG1) (resid 10 and name HD2)                 !!     c13noe.497
assign (resid 34 and name HG1) (resid 14 and name HB1) 2.71 0.91 0.91  !ambig!     c13noe.496
    or (resid 34 and name HG2) (resid 14 and name HB1)                 !!     c13noe.496
assign (resid 34 and name HG2) (resid 14 and name HB2) 2.85 1.05 1.05  !ambig!     c13noe.495
    or (resid 34 and name HG1) (resid 14 and name HB2)                 !!     c13noe.495
assign (resid 29 and name HA) (resid 53 and name HD2) 3.32 1.52 1.52  !ambig!     c13noe.78
    or (resid 29 and name HA) (resid 26 and name HA)                 !!     c13noe.78
assign (resid 16 and name HB2) (resid 47 and name HA) 3.87 2.07 2.07  !ambig!     c13noe.321
    or (resid 16 and name HB1) (resid 47 and name HA)                 !!     c13noe.321
assign (resid 35 and name HB2) (resid 36 and name HA) 3.48 1.68 1.68  !ambig!     c13noe.449
    or (resid 35 and name HB2) (resid 34 and name HD1)                 !!     c13noe.449
assign (resid 35 and name HB1) (resid 34 and name HD1) 3.65 1.85 1.85  !ambig!     c13noe.450
    or (resid 35 and name HB1) (resid 36 and name HA)                 !!     c13noe.450
assign (resid 37 and name HB2) (resid 31 and name HB2) 3.77 1.97 1.97  !ambig!     c13noe.771
    or (resid 37 and name HB2) (resid 31 and name HB1)                 !!     c13noe.771
assign (resid 29 and name HA) (resid 36 and name HE#) 3.23 1.43 1.43  !long!     c13noe.76
assign (resid 34 and name HG2) (resid 34 and name HD1) 2.47 0.67 0.67  !ambig!     c13noe.494
    or (resid 34 and name HG1) (resid 34 and name HD1)                 !!     c13noe.494
assign (resid 34 and name HG1) (resid 35 and name HN) 2.71 0.91 0.91  !ambig!     c13noe.471
    or (resid 34 and name HG2) (resid 35 and name HN)                 !!     c13noe.471
assign (resid 10 and name HG2) (resid 11 and name HN) 3.88 2.08 2.08  !ambig!     c13noe.472
    or (resid 10 and name HG1) (resid 11 and name HN)                 !!     c13noe.472
assign (resid 34 and name HB2) (resid 34 and name HA) 2.49 0.69 0.69  !ambig!     c13noe.335
    or (resid 34 and name HB2) (resid 34 and name HD2)                 !!     c13noe.335
assign (resid 56 and name HG1) (resid 56 and name HB2) 2.22 0.42 0.42  !ambig!     c13noe.811
    or (resid 56 and name HG2) (resid 56 and name HB2)                 !!     c13noe.811
assign (resid 49 and name HA1) (resid 48 and name HG1#) 3.30 1.50 1.50  !ambig!     c13noe.814
    or (resid 49 and name HA1) (resid 48 and name HG2#)                 !!     c13noe.814
assign (resid 33 and name HB2) (resid 34 and name HD2) 3.54 1.74 1.74  !ambig!     c13noe.331
    or (resid 33 and name HB2) (resid 31 and name HA)                 !!     c13noe.331
assign (resid 43 and name HB#) (resid 11 and name HE1) 2.99 1.19 1.19  !ambig!     c13noe.6
    or (resid 43 and name HB#) (resid 11 and name HE2)                 !!     c13noe.6
assign (resid 9 and name HB2) (resid 10 and name HD1) 3.00 1.20 1.20  !ambig!     c13noe.823
    or (resid 9 and name HB2) (resid 9 and name HD1)                 !!     c13noe.823
assign (resid 12 and name HG2) (resid 13 and name HN) 3.90 2.10 2.10  !ambig!     c13noe.478
    or (resid 12 and name HG1) (resid 13 and name HN)                 !!     c13noe.478
assign (resid 9 and name HB2) (resid 9 and name HG2) 2.72 0.92 0.92  !ambig!     c13noe.825
    or (resid 9 and name HB2) (resid 9 and name HG1)                 !!     c13noe.825
assign (resid 41 and name HB2) (resid 42 and name HN) 2.52 0.72 0.72  !ambig!     c13noe.593
    or (resid 41 and name HB2) (resid 41 and name HN)                 !!     c13noe.593
assign (resid 12 and name HB1) (resid 12 and name HA) 2.35 0.55 0.55  !ambig!     c13noe.334
    or (resid 53 and name HB1) (resid 53 and name HA)                 !!     c13noe.334
assign (resid 9 and name HB2) (resid 9 and name HD2) 3.23 1.43 1.43  !ambig!     c13noe.822
    or (resid 9 and name HB2) (resid 10 and name HD2)                 !!     c13noe.822
assign (resid 56 and name HG1) (resid 56 and name HA) 2.70 0.90 0.90  !ambig!     c13noe.809
    or (resid 56 and name HG2) (resid 56 and name HA)                 !!     c13noe.809
assign (resid 51 and name HG1) (resid 51 and name HA) 2.68 0.88 0.88  !ambig!     c13noe.794
    or (resid 51 and name HG2) (resid 51 and name HA)                 !!     c13noe.794
assign (resid 55 and name HD1) (resid 55 and name HA) 2.93 1.13 1.13  !ambig!     c13noe.800
    or (resid 55 and name HD2) (resid 55 and name HA)                 !!     c13noe.800
assign (resid 53 and name HG1) (resid 36 and name HD#) 3.66 1.86 1.86  !long!     c13noe.802
assign (resid 46 and name HB2) (resid 15 and name HG2) 3.08 1.28 1.28  !ambig!     c13noe.461
    or (resid 46 and name HB2) (resid 15 and name HG1)                 !!     c13noe.461
assign (resid 35 and name HA) (resid 35 and name HB2) 2.36 0.56 0.56  !ambig!     c13noe.51
    or (resid 35 and name HA) (resid 35 and name HB1)                 !!     c13noe.51
assign (resid 51 and name HG2) (resid 53 and name HD1) 3.90 2.10 2.10  !ambig!     c13noe.792
    or (resid 51 and name HG1) (resid 53 and name HD1)                 !!     c13noe.792
assign (resid 53 and name HG2) (resid 36 and name HD#) 3.68 1.88 1.88  !long!     c13noe.803
assign (resid 46 and name HB2) (resid 18 and name HD1#) 3.57 1.77 1.77  !ambig!     c13noe.467
    or (resid 46 and name HB2) (resid 18 and name HG2#)                 !!     c13noe.467
assign (resid 53 and name HD2) (resid 53 and name HG2) 2.86 1.06 1.06  !ambig!     c13noe.807
    or (resid 53 and name HD2) (resid 51 and name HG2)                 !!     c13noe.807
assign (resid 56 and name HG2) (resid 56 and name HN) 3.00 1.20 1.20  !ambig!     c13noe.808
    or (resid 56 and name HG1) (resid 56 and name HN)                 !!     c13noe.808
assign (resid 34 and name HG2) (resid 14 and name HA) 3.23 1.43 1.43  !ambig!     c13noe.484
    or (resid 34 and name HG1) (resid 14 and name HA)                 !!     c13noe.484
assign (resid 50 and name HA) (resid 28 and name HA) 3.53 1.73 1.73  !ambig!     c13noe.36
    or (resid 50 and name HA) (resid 27 and name HA)                 !!     c13noe.36
assign (resid 46 and name HB1) (resid 18 and name HD1#) 3.18 1.38 1.38  !ambig!     c13noe.466
    or (resid 46 and name HB1) (resid 18 and name HG2#)                 !!     c13noe.466
assign (resid 12 and name HG2) (resid 12 and name HD1) 2.64 0.84 0.84  !ambig!     c13noe.498
    or (resid 12 and name HG1) (resid 12 and name HD1)                 !!     c13noe.498
assign (resid 48 and name HA) (resid 48 and name HG2#) 2.36 0.56 0.56  !ambig!     c13noe.726
    or (resid 48 and name HA) (resid 48 and name HG1#)                 !!     c13noe.726
assign (resid 26 and name HA) (resid 29 and name HB1) 2.91 1.11 1.11  !ambig!     c13noe.727
    or (resid 26 and name HA) (resid 29 and name HG1)                 !!     c13noe.727
assign (resid 51 and name HG1) (resid 51 and name HN) 3.02 1.22 1.22  !ambig!     c13noe.519
    or (resid 51 and name HG2) (resid 51 and name HN)                 !!     c13noe.519
assign (resid 29 and name HB2) (resid 29 and name HD2) 2.56 0.76 0.76  !ambig!     c13noe.423
    or (resid 29 and name HB2) (resid 29 and name HD1)                 !!     c13noe.423
assign (resid 58 and name HB2) (resid 58 and name HD#) 2.85 1.05 1.05  !intra!     c13noe.142
assign (resid 53 and name HD1) (resid 36 and name HD#) 3.12 1.32 1.32  !long!     c13noe.603
assign (resid 29 and name HG2) (resid 29 and name HD1) 2.47 0.67 0.67  !ambig!     c13noe.729
    or (resid 29 and name HG2) (resid 29 and name HD2)                 !!     c13noe.729
assign (resid 32 and name HB2) (resid 32 and name HG2) 2.26 0.46 0.46  !ambig!     c13noe.428
    or (resid 32 and name HB2) (resid 32 and name HG1)                 !!     c13noe.428
assign (resid 29 and name HG1) (resid 26 and name HA) 3.21 1.41 1.41  !ambig!     c13noe.735
    or (resid 29 and name HG1) (resid 53 and name HD2)                 !!     c13noe.735
assign (resid 25 and name HG) (resid 25 and name HD2#) 2.45 0.65 0.65  !ambig!     c13noe.517
    or (resid 25 and name HG) (resid 25 and name HD1#)                 !!     c13noe.517
assign (resid 29 and name HG2) (resid 36 and name HE#) 3.90 2.10 2.10  !long!     c13noe.730
assign (resid 32 and name HB1) (resid 32 and name HG2) 2.34 0.54 0.54  !ambig!     c13noe.427
    or (resid 32 and name HB1) (resid 32 and name HG1)                 !!     c13noe.427
assign (resid 29 and name HG1) (resid 36 and name HE#) 3.90 2.10 2.10  !long!     c13noe.733
assign (resid 52 and name HB1) (resid 41 and name HA) 3.87 2.07 2.07  !ambig!     c13noe.144
    or (resid 52 and name HB1) (resid 53 and name HA)                 !!     c13noe.144
assign (resid 15 and name HB1) (resid 15 and name HD2) 3.09 1.29 1.29  !ambig!     c13noe.416
    or (resid 15 and name HB1) (resid 15 and name HD1)                 !!     c13noe.416
assign (resid 36 and name HB2) (resid 33 and name HN) 3.54 1.74 1.74  !ambig!     c13noe.157
    or (resid 36 and name HB2) (resid 52 and name HD21)                 !!     c13noe.157
assign (resid 20 and name HA2) (resid 20 and name HN) 3.20 1.40 1.40  !ambig!     c13noe.715
    or (resid 20 and name HA2) (resid 21 and name HN)                 !!     c13noe.715
assign (resid 36 and name HB1) (resid 33 and name HN) 3.67 1.87 1.87  !ambig!     c13noe.163
    or (resid 36 and name HB1) (resid 52 and name HD21)                 !!     c13noe.163
assign (resid 9 and name HB1) (resid 9 and name HD1) 2.95 1.15 1.15  !ambig!     c13noe.414
    or (resid 9 and name HB1) (resid 10 and name HD1)                 !!     c13noe.414
assign (resid 53 and name HD1) (resid 36 and name HE#) 3.07 1.27 1.27  !long!     c13noe.604
assign (resid 15 and name HB1) (resid 46 and name HB2) 3.90 2.10 2.10  !ambig!     c13noe.417
    or (resid 15 and name HB1) (resid 47 and name HB2)                 !!     c13noe.417
assign (resid 52 and name HB2) (resid 53 and name HD1) 3.50 1.70 1.70  !ambig!     c13noe.149
    or (resid 52 and name HB2) (resid 28 and name HA)                 !!     c13noe.149
assign (resid 15 and name HB2) (resid 47 and name HB2) 3.90 2.10 2.10  !ambig!     c13noe.421
    or (resid 15 and name HB2) (resid 46 and name HB2)                 !!     c13noe.421
assign (resid 29 and name HB1) (resid 29 and name HD2) 2.62 0.82 0.82  !ambig!     c13noe.422
    or (resid 29 and name HB1) (resid 29 and name HD1)                 !!     c13noe.422
assign (resid 32 and name HB2) (resid 32 and name HD2) 3.13 1.33 1.33  !ambig!     c13noe.418
    or (resid 32 and name HB2) (resid 32 and name HD1)                 !!     c13noe.418
assign (resid 32 and name HB1) (resid 32 and name HD2) 3.13 1.33 1.33  !ambig!     c13noe.419
    or (resid 32 and name HB1) (resid 32 and name HD1)                 !!     c13noe.419
assign (resid 15 and name HB2) (resid 15 and name HD2) 2.84 1.04 1.04  !ambig!     c13noe.420
    or (resid 15 and name HB2) (resid 15 and name HD1)                 !!     c13noe.420
assign (resid 36 and name HA) (resid 36 and name HD#) 2.67 0.87 0.87  !intra!     c13noe.760
assign (resid 49 and name HA2) (resid 48 and name HG1#) 3.20 1.40 1.40  !ambig!     c13noe.98
    or (resid 49 and name HA2) (resid 48 and name HG2#)                 !!     c13noe.98
assign (resid 49 and name HA2) (resid 24 and name HB) 3.21 1.41 1.41  !ambig!     c13noe.95
    or (resid 49 and name HA2) (resid 48 and name HA)                 !!     c13noe.95
assign (resid 36 and name HA) (resid 39 and name HN) 3.57 1.77 1.77  !ambig!     c13noe.758
    or (resid 45 and name HA) (resid 47 and name HN)                 !!     c13noe.758
assign (resid 34 and name HG2) (resid 34 and name HB2) 2.24 0.44 0.44  !ambig!     c13noe.512
    or (resid 34 and name HG1) (resid 34 and name HB2)                 !!     c13noe.512
assign (resid 12 and name HG2) (resid 12 and name HB2) 2.60 0.80 0.80  !ambig!     c13noe.511
    or (resid 12 and name HG1) (resid 12 and name HB2)                 !!     c13noe.511
assign (resid 34 and name HB1) (resid 34 and name HA) 2.44 0.64 0.64  !ambig!     c13noe.755
    or (resid 34 and name HB1) (resid 34 and name HD2)                 !!     c13noe.755
assign (resid 12 and name HG2) (resid 12 and name HD2) 2.73 0.93 0.93  !ambig!     c13noe.500
    or (resid 12 and name HG1) (resid 12 and name HD2)                 !!     c13noe.500
assign (resid 45 and name HA) (resid 13 and name HB2) 2.57 0.77 0.77  !ambig!     c13noe.765
    or (resid 45 and name HA) (resid 13 and name HB1)                 !!     c13noe.765
assign (resid 10 and name HG1) (resid 10 and name HD1) 2.40 0.60 0.60  !ambig!     c13noe.499
    or (resid 10 and name HG2) (resid 10 and name HD1)                 !!     c13noe.499
assign (resid 12 and name HD2) (resid 12 and name HG2) 2.64 0.84 0.84  !ambig!     c13noe.90
    or (resid 12 and name HD2) (resid 12 and name HG1)                 !!     c13noe.90
assign (resid 45 and name HA) (resid 45 and name HB2) 2.47 0.67 0.67  !ambig!     c13noe.762
    or (resid 36 and name HA) (resid 36 and name HB2)                 !!     c13noe.762
assign (resid 9 and name HD1) (resid 9 and name HB2) 2.95 1.15 1.15  !ambig!     c13noe.92
    or (resid 10 and name HD1) (resid 9 and name HB2)                 !!     c13noe.92
assign (resid 34 and name HD1) (resid 34 and name HG2) 2.27 0.47 0.47  !ambig!     c13noe.600
    or (resid 34 and name HD1) (resid 34 and name HG1)                 !!     c13noe.600
assign (resid 53 and name HD2) (resid 36 and name HD#) 3.05 1.25 1.25  !long!     c13noe.588
assign (resid 29 and name HD1) (resid 51 and name HB1) 2.81 1.01 1.01  !ambig!     c13noe.743
    or (resid 29 and name HD2) (resid 51 and name HB1)                 !!     c13noe.743
assign (resid 29 and name HD1) (resid 29 and name HG2) 2.45 0.65 0.65  !ambig!     c13noe.745
    or (resid 29 and name HD2) (resid 29 and name HG2)                 !!     c13noe.745
assign (resid 40 and name HB2) (resid 11 and name HB2) 3.90 2.10 2.10  !ambig!     c13noe.117
    or (resid 40 and name HB2) (resid 11 and name HD1)                 !!     c13noe.117
assign (resid 15 and name HB1) (resid 18 and name HD1#) 3.14 1.34 1.34  !ambig!     c13noe.430
    or (resid 15 and name HB1) (resid 18 and name HG2#)                 !!     c13noe.430
assign (resid 29 and name HD2) (resid 29 and name HN) 3.46 1.66 1.66  !ambig!     c13noe.738
    or (resid 29 and name HD1) (resid 29 and name HN)                 !!     c13noe.738
assign (resid 29 and name HD2) (resid 53 and name HD1) 3.12 1.32 1.32  !ambig!     c13noe.740
    or (resid 29 and name HD1) (resid 53 and name HD1)                 !!     c13noe.740
assign (resid 40 and name HB1) (resid 11 and name HB2) 3.27 1.47 1.47  !ambig!     c13noe.116
    or (resid 40 and name HB1) (resid 11 and name HD1)                 !!     c13noe.116
assign (resid 32 and name HG2) (resid 32 and name HD1) 2.66 0.86 0.86  !ambig!     c13noe.749
    or (resid 32 and name HG2) (resid 32 and name HD2)                 !!     c13noe.749
assign (resid 18 and name HG12) (resid 18 and name HD1#) 2.32 0.52 0.52  !ambig!     c13noe.516
    or (resid 18 and name HG12) (resid 18 and name HG2#)                 !!     c13noe.516
assign (resid 16 and name HB2) (resid 16 and name HN) 2.61 0.81 0.81  !ambig!     c13noe.317
    or (resid 16 and name HB1) (resid 16 and name HN)                 !!     c13noe.317
assign (resid 15 and name HB2) (resid 18 and name HG2#) 3.51 1.71 1.71  !ambig!     c13noe.431
    or (resid 15 and name HB2) (resid 18 and name HD1#)                 !!     c13noe.431
assign (resid 29 and name HD2) (resid 29 and name HB2) 2.63 0.83 0.83  !ambig!     c13noe.747
    or (resid 29 and name HD1) (resid 29 and name HB2)                 !!     c13noe.747
!assign (resid 34 and name HD2) (resid 34 and name HD1) 2.23 0.43 0.43  !geminal!     c13noe.584
!assign (resid 41 and name HB2) (resid 41 and name HB1) 2.31 0.51 0.51  !geminal!     c13noe.592
assign (resid 41 and name HB2) (resid 41 and name HA) 2.53 0.73 0.73  !intra!     c13noe.591
assign (resid 41 and name HB2) (resid 43 and name HN) 3.16 1.36 1.36  !medium!     c13noe.590
!assign (resid 18 and name HG12) (resid 18 and name HG11) 2.21 0.41 0.41  !geminal!     c13noe.515
assign (resid 13 and name HG2) (resid 13 and name HN) 3.54 1.74 1.74  !intra!     c13noe.520
assign (resid 32 and name HG1) (resid 32 and name HB1) 2.51 0.71 0.71  !intra!     c13noe.513
assign (resid 18 and name HG12) (resid 18 and name HA) 3.07 1.27 1.27  !intra!     c13noe.501
assign (resid 10 and name HG2) (resid 10 and name HB2) 2.27 0.47 0.47  !intra!     c13noe.510
assign (resid 25 and name HD1#) (resid 25 and name HB2) 2.74 0.94 0.94  !intra!     c13noe.535
assign (resid 27 and name HG2#) (resid 28 and name HN) 2.97 1.17 1.17  !seq!     c13noe.539
assign (resid 25 and name HD1#) (resid 25 and name HA) 3.34 1.54 1.54  !intra!     c13noe.525
assign (resid 25 and name HD1#) (resid 25 and name HN) 3.90 2.10 2.10  !intra!     c13noe.521
assign (resid 13 and name HG2) (resid 13 and name HA) 3.08 1.28 1.28  !intra!     c13noe.523
assign (resid 54 and name HB1) (resid 54 and name HD2) 3.32 1.52 1.52  !intra!     c13noe.482
assign (resid 18 and name HG12) (resid 18 and name HN) 2.93 1.13 1.13  !intra!     c13noe.483
assign (resid 54 and name HB2) (resid 54 and name HD2) 3.34 1.54 1.54  !intra!     c13noe.481
assign (resid 32 and name HG1) (resid 32 and name HN) 3.13 1.33 1.33  !intra!     c13noe.479
assign (resid 25 and name HG) (resid 25 and name HN) 3.05 1.25 1.25  !intra!     c13noe.480
assign (resid 32 and name HG1) (resid 32 and name HA) 2.98 1.18 1.18  !intra!     c13noe.492
assign (resid 25 and name HG) (resid 25 and name HA) 3.27 1.47 1.47  !intra!     c13noe.493
assign (resid 32 and name HG2) (resid 32 and name HA) 2.90 1.10 1.10  !intra!     c13noe.489
assign (resid 54 and name HB2) (resid 54 and name HA) 2.67 0.87 0.87  !intra!     c13noe.485
assign (resid 54 and name HB1) (resid 54 and name HA) 2.58 0.78 0.78  !intra!     c13noe.486
assign (resid 26 and name HG2#) (resid 26 and name HN) 3.21 1.41 1.41  !intra!     c13noe.567
assign (resid 24 and name HG2#) (resid 25 and name HN) 3.90 2.10 2.10  !seq!     c13noe.568
assign (resid 24 and name HG2#) (resid 25 and name HN) 3.90 2.10 2.10  !seq!     c13noe.565
assign (resid 27 and name HG2#) (resid 47 and name HB2) 3.46 1.66 1.66  !long!     c13noe.559
assign (resid 24 and name HG2#) (resid 24 and name HN) 3.68 1.88 1.88  !intra!     c13noe.564
assign (resid 16 and name HA) (resid 16 and name HN) 2.63 0.83 0.83  !intra!     c13noe.582
assign (resid 18 and name HA) (resid 18 and name HN) 2.65 0.85 0.85  !intra!     c13noe.583
assign (resid 26 and name HG2#) (resid 26 and name HB) 2.27 0.47 0.47  !intra!     c13noe.573
assign (resid 26 and name HG2#) (resid 27 and name HN) 3.60 1.80 1.80  !seq!     c13noe.569
assign (resid 24 and name HG2#) (resid 24 and name HA) 2.55 0.75 0.75  !intra!     c13noe.572
assign (resid 27 and name HG2#) (resid 48 and name HN) 3.33 1.53 1.53  !long!     c13noe.544
assign (resid 27 and name HG2#) (resid 27 and name HN) 3.21 1.41 1.41  !intra!     c13noe.547
assign (resid 27 and name HG2#) (resid 17 and name HN) 3.52 1.72 1.72  !long!     c13noe.542
assign (resid 11 and name HG2) (resid 11 and name HN) 3.47 1.67 1.67  !intra!     c13noe.540
assign (resid 11 and name HG1) (resid 11 and name HN) 3.42 1.62 1.62  !intra!     c13noe.541
assign (resid 27 and name HG2#) (resid 27 and name HB) 2.43 0.63 0.63  !intra!     c13noe.554
assign (resid 27 and name HG2#) (resid 47 and name HB1) 3.62 1.82 1.82  !long!     c13noe.557
assign (resid 27 and name HG2#) (resid 27 and name HA) 2.46 0.66 0.66  !intra!     c13noe.553
assign (resid 11 and name HG2) (resid 11 and name HA) 3.26 1.46 1.46  !intra!     c13noe.548
assign (resid 27 and name HG2#) (resid 17 and name HA1) 3.00 1.20 1.20  !long!     c13noe.551
!assign (resid 29 and name HG2) (resid 29 and name HG1) 2.23 0.43 0.43  !geminal!     c13noe.736
assign (resid 29 and name HG2) (resid 53 and name HD2) 3.28 1.48 1.48  !long!     c13noe.734
assign (resid 30 and name HB1) (resid 26 and name HB) 3.90 2.10 2.10  !medium!     c13noe.748
assign (resid 29 and name HG2) (resid 29 and name HB2) 2.70 0.90 0.90  !intra!     c13noe.737
assign (resid 29 and name HG2) (resid 53 and name HD1) 3.77 1.97 1.97  !long!     c13noe.728
assign (resid 26 and name HA) (resid 26 and name HG2#) 2.69 0.89 0.89  !intra!     c13noe.725
assign (resid 29 and name HG1) (resid 29 and name HN) 3.90 2.10 2.10  !intra!     c13noe.732
assign (resid 29 and name HG2) (resid 29 and name HN) 3.76 1.96 1.96  !intra!     c13noe.731
assign (resid 45 and name HA) (resid 45 and name HN) 2.93 1.13 1.13  !intra!     c13noe.757
assign (resid 34 and name HB1) (resid 34 and name HD1) 3.12 1.32 1.32  !intra!     c13noe.754
assign (resid 45 and name HA) (resid 13 and name HA) 3.03 1.23 1.23  !long!     c13noe.761
assign (resid 36 and name HA) (resid 54 and name HD2) 2.98 1.18 1.18  !long!     c13noe.759
assign (resid 34 and name HA) (resid 34 and name HB2) 2.61 0.81 0.81  !intra!     c13noe.751
assign (resid 34 and name HA) (resid 37 and name HB1) 3.14 1.34 1.34  !medium!     c13noe.750
!assign (resid 34 and name HB1) (resid 34 and name HB2) 2.21 0.41 0.41  !geminal!     c13noe.753
assign (resid 34 and name HA) (resid 34 and name HB1) 2.57 0.77 0.77  !intra!     c13noe.752
assign (resid 26 and name HA) (resid 27 and name HN) 2.88 1.08 1.08  !seq!     c13noe.724
assign (resid 17 and name HA2) (resid 48 and name HN) 3.58 1.78 1.78  !long!     c13noe.707
assign (resid 44 and name HA2) (resid 44 and name HN) 2.74 0.94 0.94  !intra!     c13noe.706
!assign (resid 44 and name HA2) (resid 44 and name HA1) 2.10 0.30 0.30  !geminal!     c13noe.709
!assign (resid 17 and name HA2) (resid 17 and name HA1) 2.15 0.35 0.35  !geminal!     c13noe.708
assign (resid 49 and name HA1) (resid 49 and name HN) 2.58 0.78 0.78  !intra!     c13noe.703
assign (resid 28 and name HA) (resid 30 and name HN) 3.57 1.77 1.77  !medium!     c13noe.701
assign (resid 49 and name HA1) (resid 50 and name HN) 2.86 1.06 1.06  !seq!     c13noe.705
assign (resid 17 and name HA2) (resid 17 and name HN) 2.71 0.91 0.91  !intra!     c13noe.704
assign (resid 25 and name HD2#) (resid 25 and name HA) 2.78 0.98 0.98  !intra!     c13noe.721
assign (resid 25 and name HB1) (resid 25 and name HA) 2.77 0.97 0.97  !intra!     c13noe.720
assign (resid 25 and name HD2#) (resid 25 and name HG) 2.54 0.74 0.74  !intra!     c13noe.723
assign (resid 25 and name HD2#) (resid 25 and name HB2) 2.84 1.04 1.04  !intra!     c13noe.722
assign (resid 18 and name HA) (resid 19 and name HN) 3.33 1.53 1.53  !seq!     c13noe.712
assign (resid 17 and name HA2) (resid 48 and name HB) 3.59 1.79 1.79  !long!     c13noe.711
assign (resid 25 and name HB1) (resid 25 and name HN) 3.02 1.22 1.22  !intra!     c13noe.719
assign (resid 23 and name HB2) (resid 23 and name HD22) 3.72 1.92 1.92  !intra!     c13noe.717
assign (resid 36 and name HA) (resid 36 and name HB1) 2.53 0.73 0.73  !intra!     c13noe.763
assign (resid 53 and name HG1) (resid 52 and name HA) 3.44 1.64 1.64  !seq!     c13noe.805
assign (resid 53 and name HG2) (resid 54 and name HN) 3.38 1.58 1.58  !seq!     c13noe.804
assign (resid 57 and name HB1) (resid 58 and name HN) 3.37 1.57 1.57  !seq!     c13noe.812
assign (resid 53 and name HG2) (resid 52 and name HA) 3.47 1.67 1.67  !seq!     c13noe.806
assign (resid 48 and name HG2#) (resid 48 and name HB) 2.32 0.52 0.52  !intra!     c13noe.791
assign (resid 48 and name HG2#) (resid 48 and name HA) 2.61 0.81 0.81  !intra!     c13noe.789
assign (resid 53 and name HG1) (resid 54 and name HN) 3.68 1.88 1.88  !seq!     c13noe.801
assign (resid 51 and name HG2) (resid 25 and name HA) 3.74 1.94 1.94  !long!     c13noe.793
assign (resid 9 and name HD2) (resid 8 and name HA) 2.48 0.68 0.68  !seq!     c13noe.820
assign (resid 10 and name HD2) (resid 9 and name HA) 2.44 0.64 0.64  !seq!     c13noe.819
!assign (resid 9 and name HB2) (resid 9 and name HB1) 2.21 0.41 0.41  !geminal!     c13noe.824
assign (resid 9 and name HB2) (resid 9 and name HA) 2.60 0.80 0.80  !intra!     c13noe.821
assign (resid 45 and name HB2) (resid 47 and name HN) 3.12 1.32 1.32  !medium!     c13noe.815
assign (resid 29 and name HA) (resid 29 and name HG2) 2.96 1.16 1.16  !intra!     c13noe.813
assign (resid 35 and name HB1) (resid 36 and name HB2) 3.64 1.84 1.84  !seq!     c13noe.818
assign (resid 27 and name HA) (resid 28 and name HN) 3.63 1.83 1.83  !seq!     c13noe.817
assign (resid 45 and name HB2) (resid 42 and name HB1) 3.51 1.71 1.71  !medium!     c13noe.786
assign (resid 37 and name HB2) (resid 34 and name HA) 3.51 1.71 1.71  !medium!     c13noe.770
assign (resid 37 and name HB1) (resid 37 and name HA) 2.71 0.91 0.91  !intra!     c13noe.769
assign (resid 37 and name HB2) (resid 37 and name HG1) 2.57 0.77 0.77  !intra!     c13noe.773
assign (resid 37 and name HB1) (resid 37 and name HG1) 2.51 0.71 0.71  !intra!     c13noe.772
assign (resid 37 and name HB2) (resid 37 and name HN) 2.63 0.83 0.83  !intra!     c13noe.766
assign (resid 45 and name HA) (resid 45 and name HB1) 2.42 0.62 0.62  !intra!     c13noe.764
assign (resid 37 and name HB2) (resid 37 and name HA) 2.68 0.88 0.88  !intra!     c13noe.768
assign (resid 37 and name HB1) (resid 38 and name HN) 3.50 1.70 1.70  !seq!     c13noe.767
assign (resid 43 and name HA) (resid 43 and name HB#) 2.41 0.61 0.61  !intra!     c13noe.781
assign (resid 41 and name HB1) (resid 43 and name HN) 3.61 1.81 1.81  !medium!     c13noe.780
assign (resid 43 and name HA) (resid 44 and name HN) 2.73 0.93 0.93  !seq!     c13noe.783
assign (resid 43 and name HA) (resid 43 and name HN) 2.94 1.14 1.14  !intra!     c13noe.782
assign (resid 37 and name HG2) (resid 37 and name HN) 3.31 1.51 1.51  !intra!     c13noe.775
!assign (resid 37 and name HB2) (resid 37 and name HB1) 2.25 0.45 0.45  !geminal!     c13noe.774
assign (resid 37 and name HG2) (resid 37 and name HB2) 3.06 1.26 1.26  !intra!     c13noe.777
assign (resid 37 and name HG2) (resid 37 and name HA) 3.37 1.57 1.57  !intra!     c13noe.776
assign (resid 27 and name HA) (resid 27 and name HB) 2.69 0.89 0.89  !intra!     c13noe.631
assign (resid 27 and name HA) (resid 27 and name HN) 2.74 0.94 0.94  !intra!     c13noe.630
assign (resid 53 and name HG1) (resid 53 and name HD1) 2.80 1.00 1.00  !intra!     c13noe.633
assign (resid 27 and name HA) (resid 27 and name HG2#) 2.49 0.69 0.69  !intra!     c13noe.632
assign (resid 18 and name HA) (resid 18 and name HG11) 2.90 1.10 1.10  !intra!     c13noe.622
assign (resid 18 and name HA) (resid 18 and name HG12) 2.91 1.11 1.11  !intra!     c13noe.621
assign (resid 28 and name HA) (resid 29 and name HN) 2.84 1.04 1.04  !seq!     c13noe.628
assign (resid 28 and name HA) (resid 28 and name HN) 2.50 0.70 0.70  !intra!     c13noe.624
!assign (resid 53 and name HG1) (resid 53 and name HG2) 2.28 0.48 0.48  !geminal!     c13noe.641
assign (resid 53 and name HG2) (resid 53 and name HA) 3.25 1.45 1.45  !intra!     c13noe.638
!assign (resid 20 and name HA1) (resid 20 and name HA2) 2.27 0.47 0.47  !geminal!     c13noe.645
!assign (resid 53 and name HG2) (resid 53 and name HG1) 2.13 0.33 0.33  !geminal!     c13noe.642
assign (resid 53 and name HG1) (resid 53 and name HA) 3.15 1.35 1.35  !intra!     c13noe.635
assign (resid 53 and name HG1) (resid 53 and name HD2) 2.85 1.05 1.05  !intra!     c13noe.634
assign (resid 53 and name HG2) (resid 53 and name HD2) 2.84 1.04 1.04  !intra!     c13noe.637
assign (resid 53 and name HG2) (resid 53 and name HD1) 2.91 1.11 1.11  !intra!     c13noe.636
assign (resid 18 and name HA) (resid 18 and name HB) 2.61 0.81 0.81  !intra!     c13noe.620
assign (resid 34 and name HD1) (resid 34 and name HB2) 3.00 1.20 1.20  !intra!     c13noe.601
!assign (resid 9 and name HD2) (resid 9 and name HD1) 2.02 0.22 0.22  !geminal!     c13noe.598
assign (resid 25 and name HB1) (resid 25 and name HD1#) 2.71 0.91 0.91  !intra!     c13noe.610
assign (resid 53 and name HD1) (resid 53 and name HG2) 2.71 0.91 0.91  !intra!     c13noe.602
assign (resid 34 and name HD1) (resid 33 and name HA) 2.32 0.52 0.52  !seq!     c13noe.595
assign (resid 47 and name HB2) (resid 27 and name HG2#) 3.51 1.71 1.71  !long!     c13noe.594
assign (resid 12 and name HD1) (resid 11 and name HA) 2.31 0.51 0.51  !seq!     c13noe.597
!assign (resid 34 and name HD1) (resid 34 and name HD2) 2.09 0.29 0.29  !geminal!     c13noe.596
assign (resid 18 and name HG2#) (resid 18 and name HB) 2.53 0.73 0.73  !intra!     c13noe.617
assign (resid 18 and name HG2#) (resid 18 and name HN) 2.97 1.17 1.17  !intra!     c13noe.616
assign (resid 18 and name HG2#) (resid 18 and name HG11) 3.05 1.25 1.25  !intra!     c13noe.619
assign (resid 18 and name HG2#) (resid 18 and name HG12) 2.93 1.13 1.13  !intra!     c13noe.618
assign (resid 25 and name HB2) (resid 25 and name HA) 2.66 0.86 0.86  !intra!     c13noe.612
!assign (resid 25 and name HB1) (resid 25 and name HB2) 2.20 0.40 0.40  !geminal!     c13noe.611
assign (resid 18 and name HG2#) (resid 18 and name HA) 2.66 0.86 0.86  !intra!     c13noe.615
!assign (resid 25 and name HB2) (resid 25 and name HB1) 2.17 0.37 0.37  !geminal!     c13noe.613
!assign (resid 20 and name HA2) (resid 20 and name HA1) 2.27 0.47 0.47  !geminal!     c13noe.646
assign (resid 12 and name HD1) (resid 12 and name HB2) 3.05 1.25 1.25  !intra!     c13noe.682
assign (resid 25 and name HD1#) (resid 25 and name HB1) 2.72 0.92 0.92  !intra!     c13noe.681
assign (resid 12 and name HB2) (resid 13 and name HN) 3.06 1.26 1.26  !seq!     c13noe.687
assign (resid 11 and name HG1) (resid 11 and name HA) 3.13 1.33 1.33  !intra!     c13noe.683
assign (resid 44 and name HA1) (resid 44 and name HN) 2.91 1.11 1.11  !intra!     c13noe.674
assign (resid 42 and name HA) (resid 42 and name HB1) 2.68 0.88 0.88  !intra!     c13noe.672
assign (resid 28 and name HB1) (resid 28 and name HA) 2.78 0.98 0.98  !intra!     c13noe.677
assign (resid 44 and name HA1) (resid 45 and name HN) 3.25 1.45 1.45  !seq!     c13noe.675
assign (resid 48 and name HB) (resid 17 and name HA1) 2.85 1.05 1.05  !long!     c13noe.694
assign (resid 12 and name HD1) (resid 40 and name HD22) 3.90 2.10 2.10  !long!     c13noe.692
assign (resid 13 and name HG1) (resid 13 and name HA) 3.29 1.49 1.49  !intra!     c13noe.696
assign (resid 13 and name HG1) (resid 13 and name HN) 3.37 1.57 1.57  !intra!     c13noe.695
assign (resid 12 and name HB2) (resid 12 and name HD1) 3.09 1.29 1.29  !intra!     c13noe.689
assign (resid 12 and name HB2) (resid 12 and name HD2) 3.29 1.49 1.49  !intra!     c13noe.688
assign (resid 12 and name HD1) (resid 40 and name HD21) 3.87 2.07 2.07  !long!     c13noe.691
assign (resid 12 and name HB2) (resid 12 and name HA) 2.54 0.74 0.74  !intra!     c13noe.690
assign (resid 42 and name HA) (resid 42 and name HB2) 2.58 0.78 0.78  !intra!     c13noe.671
assign (resid 34 and name HD1) (resid 35 and name HN) 3.21 1.41 1.41  !seq!     c13noe.653
assign (resid 53 and name HD1) (resid 29 and name HB2) 3.57 1.77 1.77  !long!     c13noe.652
assign (resid 34 and name HD1) (resid 14 and name HB1) 2.99 1.19 1.19  !long!     c13noe.655
assign (resid 53 and name HD1) (resid 54 and name HN) 3.28 1.48 1.48  !seq!     c13noe.654
assign (resid 25 and name HB2) (resid 25 and name HN) 3.55 1.75 1.75  !intra!     c13noe.648
assign (resid 25 and name HB2) (resid 26 and name HN) 3.90 2.10 2.10  !seq!     c13noe.647
assign (resid 32 and name HA) (resid 32 and name HB1) 2.50 0.70 0.70  !intra!     c13noe.650
assign (resid 32 and name HA) (resid 32 and name HN) 2.76 0.96 0.96  !intra!     c13noe.649
assign (resid 31 and name HA) (resid 32 and name HN) 3.19 1.39 1.39  !seq!     c13noe.665
assign (resid 31 and name HA) (resid 37 and name HA) 3.53 1.73 1.73  !long!     c13noe.663
assign (resid 42 and name HA) (resid 43 and name HN) 2.94 1.14 1.14  !seq!     c13noe.670
assign (resid 42 and name HA) (resid 42 and name HN) 2.92 1.12 1.12  !intra!     c13noe.669
assign (resid 33 and name HB1) (resid 30 and name HN) 3.12 1.32 1.32  !medium!     c13noe.658
assign (resid 34 and name HD1) (resid 33 and name HB1) 3.51 1.71 1.71  !seq!     c13noe.656
assign (resid 31 and name HA) (resid 37 and name HG1) 3.33 1.53 1.53  !long!     c13noe.662
assign (resid 31 and name HA) (resid 37 and name HB2) 2.82 1.02 1.02  !long!     c13noe.660
assign (resid 58 and name HB1) (resid 58 and name HN) 2.90 1.10 1.10  !intra!     c13noe.158
assign (resid 36 and name HB2) (resid 36 and name HN) 2.58 0.78 0.78  !intra!     c13noe.156
assign (resid 23 and name HB2) (resid 23 and name HD21) 3.24 1.44 1.44  !intra!     c13noe.160
assign (resid 58 and name HB2) (resid 58 and name HN) 2.97 1.17 1.17  !intra!     c13noe.159
assign (resid 36 and name HB1) (resid 37 and name HN) 2.86 1.06 1.06  !seq!     c13noe.155
!assign (resid 52 and name HB2) (resid 52 and name HB1) 2.26 0.46 0.46  !geminal!     c13noe.152
!assign (resid 52 and name HB1) (resid 52 and name HB2) 2.26 0.46 0.46  !geminal!     c13noe.151
assign (resid 36 and name HB2) (resid 37 and name HN) 3.10 1.30 1.30  !seq!     c13noe.154
assign (resid 52 and name HB2) (resid 42 and name HB1) 3.90 2.10 2.10  !long!     c13noe.153
assign (resid 58 and name HB1) (resid 58 and name HA) 2.76 0.96 0.96  !intra!     c13noe.173
assign (resid 23 and name HB2) (resid 23 and name HA) 2.67 0.87 0.87  !intra!     c13noe.172
assign (resid 36 and name HB1) (resid 36 and name HA) 2.75 0.95 0.95  !intra!     c13noe.176
assign (resid 36 and name HB2) (resid 36 and name HA) 2.60 0.80 0.80  !intra!     c13noe.174
assign (resid 23 and name HB1) (resid 23 and name HA) 2.76 0.96 0.96  !intra!     c13noe.171
assign (resid 36 and name HB1) (resid 36 and name HN) 2.67 0.87 0.87  !intra!     c13noe.162
assign (resid 23 and name HB1) (resid 23 and name HD21) 3.34 1.54 1.54  !intra!     c13noe.161
assign (resid 18 and name HB) (resid 18 and name HN) 2.67 0.87 0.87  !intra!     c13noe.166
assign (resid 23 and name HB1) (resid 23 and name HD22) 3.72 1.92 1.92  !intra!     c13noe.165
assign (resid 58 and name HB2) (resid 58 and name HA) 2.80 1.00 1.00  !intra!     c13noe.146
assign (resid 57 and name HB1) (resid 57 and name HA) 2.78 0.98 0.98  !intra!     c13noe.131
assign (resid 30 and name HB2) (resid 26 and name HB) 3.41 1.61 1.61  !medium!     c13noe.130
!assign (resid 30 and name HB2) (resid 30 and name HB1) 2.16 0.36 0.36  !geminal!     c13noe.133
assign (resid 57 and name HB2) (resid 57 and name HA) 2.82 1.02 1.02  !intra!     c13noe.132
assign (resid 30 and name HB2) (resid 30 and name HA) 2.53 0.73 0.73  !intra!     c13noe.129
assign (resid 30 and name HB2) (resid 30 and name HD22) 3.09 1.29 1.29  !intra!     c13noe.126
assign (resid 30 and name HB1) (resid 30 and name HD22) 3.45 1.65 1.65  !intra!     c13noe.125
assign (resid 30 and name HB1) (resid 30 and name HA) 2.54 0.74 0.74  !intra!     c13noe.128
assign (resid 30 and name HB2) (resid 30 and name HN) 3.36 1.56 1.56  !intra!     c13noe.127
assign (resid 52 and name HB1) (resid 52 and name HD21) 2.78 0.98 0.98  !intra!     c13noe.141
assign (resid 52 and name HB2) (resid 52 and name HD22) 3.06 1.26 1.26  !intra!     c13noe.140
assign (resid 52 and name HB2) (resid 52 and name HA) 2.93 1.13 1.13  !intra!     c13noe.145
assign (resid 52 and name HB1) (resid 52 and name HA) 2.90 1.10 1.10  !intra!     c13noe.143
assign (resid 52 and name HB1) (resid 52 and name HD22) 3.16 1.36 1.36  !intra!     c13noe.139
assign (resid 52 and name HB1) (resid 52 and name HN) 2.64 0.84 0.84  !intra!     c13noe.135
!assign (resid 30 and name HB1) (resid 30 and name HB2) 2.21 0.41 0.41  !geminal!     c13noe.134
assign (resid 52 and name HB2) (resid 52 and name HD21) 2.80 1.00 1.00  !intra!     c13noe.138
assign (resid 52 and name HB2) (resid 52 and name HN) 2.61 0.81 0.81  !intra!     c13noe.136
assign (resid 14 and name HB1) (resid 34 and name HD2) 2.70 0.90 0.90  !long!     c13noe.208
assign (resid 14 and name HB2) (resid 34 and name HD2) 2.71 0.91 0.91  !long!     c13noe.207
assign (resid 48 and name HB) (resid 48 and name HA) 2.80 1.00 1.00  !intra!     c13noe.210
assign (resid 48 and name HB) (resid 47 and name HA) 3.76 1.96 1.96  !seq!     c13noe.209
assign (resid 14 and name HB1) (resid 33 and name HA) 3.62 1.82 1.82  !long!     c13noe.206
assign (resid 14 and name HB2) (resid 14 and name HA) 2.50 0.70 0.70  !intra!     c13noe.202
assign (resid 39 and name HB2) (resid 39 and name HN) 3.04 1.24 1.24  !intra!     c13noe.199
assign (resid 14 and name HB2) (resid 33 and name HA) 3.53 1.73 1.73  !long!     c13noe.205
assign (resid 14 and name HB1) (resid 14 and name HA) 2.51 0.71 0.71  !intra!     c13noe.203
assign (resid 55 and name HB1) (resid 55 and name HE1) 3.90 2.10 2.10  !intra!     c13noe.219
!assign (resid 39 and name HB1) (resid 39 and name HB2) 2.18 0.38 0.38  !geminal!     c13noe.218
assign (resid 14 and name HB1) (resid 34 and name HB2) 3.90 2.10 2.10  !long!     c13noe.223
assign (resid 14 and name HB2) (resid 34 and name HB2) 3.90 2.10 2.10  !long!     c13noe.222
!assign (resid 39 and name HB2) (resid 39 and name HB1) 2.07 0.27 0.27  !geminal!     c13noe.217
!assign (resid 14 and name HB1) (resid 14 and name HB2) 2.23 0.43 0.43  !geminal!     c13noe.213
assign (resid 14 and name HB1) (resid 34 and name HD1) 2.99 1.19 1.19  !long!     c13noe.212
assign (resid 48 and name HB) (resid 17 and name HA2) 3.54 1.74 1.74  !long!     c13noe.216
!assign (resid 14 and name HB2) (resid 14 and name HB1) 2.23 0.43 0.43  !geminal!     c13noe.214
assign (resid 39 and name HB1) (resid 39 and name HN) 3.06 1.26 1.26  !intra!     c13noe.198
assign (resid 18 and name HB) (resid 18 and name HG11) 3.14 1.34 1.34  !intra!     c13noe.184
assign (resid 18 and name HB) (resid 18 and name HG12) 2.76 0.96 0.96  !intra!     c13noe.183
assign (resid 14 and name HB1) (resid 14 and name HN) 3.01 1.21 1.21  !intra!     c13noe.187
assign (resid 14 and name HB2) (resid 14 and name HN) 3.21 1.41 1.41  !intra!     c13noe.186
!assign (resid 36 and name HB1) (resid 36 and name HB2) 2.25 0.45 0.45  !geminal!     c13noe.182
!assign (resid 36 and name HB2) (resid 36 and name HB1) 2.24 0.44 0.44  !geminal!     c13noe.179
assign (resid 18 and name HB) (resid 18 and name HA) 2.69 0.89 0.89  !intra!     c13noe.178
!assign (resid 23 and name HB1) (resid 23 and name HB2) 2.09 0.29 0.29  !geminal!     c13noe.181
!assign (resid 23 and name HB2) (resid 23 and name HB1) 2.09 0.29 0.29  !geminal!     c13noe.180
assign (resid 39 and name HB2) (resid 40 and name HN) 3.61 1.81 1.81  !seq!     c13noe.194
assign (resid 39 and name HB1) (resid 40 and name HN) 3.80 2.00 2.00  !seq!     c13noe.193
assign (resid 14 and name HB1) (resid 16 and name HN) 3.47 1.67 1.67  !medium!     c13noe.197
assign (resid 14 and name HB2) (resid 16 and name HN) 2.97 1.17 1.17  !medium!     c13noe.196
assign (resid 14 and name HB1) (resid 35 and name HN) 3.44 1.64 1.64  !long!     c13noe.192
assign (resid 14 and name HB2) (resid 15 and name HN) 2.81 1.01 1.01  !seq!     c13noe.189
assign (resid 13 and name HB2) (resid 14 and name HN) 3.28 1.48 1.48  !seq!     c13noe.188
assign (resid 14 and name HB2) (resid 35 and name HN) 3.62 1.82 1.82  !long!     c13noe.191
assign (resid 14 and name HB1) (resid 15 and name HN) 3.03 1.23 1.23  !seq!     c13noe.190
assign (resid 30 and name HB2) (resid 30 and name HD21) 2.98 1.18 1.18  !intra!     c13noe.124
assign (resid 18 and name HD1#) (resid 18 and name HN) 3.41 1.61 1.61  !intra!     c13noe.47
assign (resid 35 and name HA) (resid 38 and name HN) 3.56 1.76 1.76  !medium!     c13noe.46
assign (resid 18 and name HD1#) (resid 46 and name HB1) 3.10 1.30 1.30  !long!     c13noe.50
assign (resid 18 and name HD1#) (resid 18 and name HA) 3.10 1.30 1.30  !intra!     c13noe.49
assign (resid 18 and name HD1#) (resid 48 and name HN) 3.90 2.10 2.10  !long!     c13noe.45
assign (resid 50 and name HA) (resid 27 and name HG2#) 2.98 1.18 1.18  !long!     c13noe.42
assign (resid 50 and name HA) (resid 50 and name HB1) 2.74 0.94 0.94  !intra!     c13noe.39
assign (resid 35 and name HA) (resid 40 and name HD21) 3.71 1.91 1.91  !long!     c13noe.44
assign (resid 35 and name HA) (resid 35 and name HN) 2.65 0.85 0.85  !intra!     c13noe.43
assign (resid 39 and name HA) (resid 40 and name HN) 3.09 1.29 1.29  !seq!     c13noe.61
assign (resid 37 and name HA) (resid 37 and name HN) 2.76 0.96 0.96  !intra!     c13noe.60
assign (resid 37 and name HA) (resid 38 and name HN) 3.53 1.73 1.73  !seq!     c13noe.63
assign (resid 37 and name HA) (resid 39 and name HN) 3.68 1.88 1.88  !medium!     c13noe.62
assign (resid 18 and name HD1#) (resid 18 and name HG11) 2.38 0.58 0.58  !intra!     c13noe.58
assign (resid 35 and name HA) (resid 40 and name HB2) 2.66 0.86 0.86  !long!     c13noe.54
assign (resid 18 and name HD1#) (resid 46 and name HB2) 3.32 1.52 1.52  !long!     c13noe.52
assign (resid 18 and name HD1#) (resid 18 and name HG12) 2.38 0.58 0.58  !intra!     c13noe.57
assign (resid 18 and name HD1#) (resid 18 and name HB) 2.57 0.77 0.77  !intra!     c13noe.56
assign (resid 50 and name HA) (resid 51 and name HA) 3.90 2.10 2.10  !seq!     c13noe.35
assign (resid 27 and name HB) (resid 28 and name HN) 2.37 0.57 0.57  !seq!     c13noe.11
assign (resid 43 and name HB#) (resid 41 and name HB1) 3.90 2.10 2.10  !medium!     c13noe.5
assign (resid 27 and name HB) (resid 29 and name HN) 3.32 1.52 1.52  !medium!     c13noe.14
assign (resid 41 and name HB1) (resid 41 and name HN) 2.53 0.73 0.73  !intra!     c13noe.12
assign (resid 43 and name HB#) (resid 44 and name HA2) 3.90 2.10 2.10  !seq!     c13noe.4
assign (resid 43 and name HB#) (resid 42 and name HN) 3.88 2.08 2.08  !seq!     c13noe.1
assign (resid 43 and name HB#) (resid 44 and name HN) 3.13 1.33 1.33  !seq!     c13noe.0
assign (resid 43 and name HB#) (resid 43 and name HA) 2.39 0.59 0.59  !intra!     c13noe.3
assign (resid 43 and name HB#) (resid 43 and name HN) 2.47 0.67 0.67  !intra!     c13noe.2
assign (resid 50 and name HA) (resid 51 and name HN) 2.36 0.56 0.56  !seq!     c13noe.28
assign (resid 50 and name HA) (resid 52 and name HN) 3.66 1.86 1.86  !medium!     c13noe.26
assign (resid 21 and name HB2) (resid 21 and name HA) 2.84 1.04 1.04  !intra!     c13noe.32
assign (resid 50 and name HA) (resid 50 and name HN) 2.76 0.96 0.96  !intra!     c13noe.29
assign (resid 27 and name HB) (resid 27 and name HG2#) 2.50 0.70 0.70  !intra!     c13noe.25
assign (resid 41 and name HB1) (resid 41 and name HA) 2.49 0.69 0.69  !intra!     c13noe.17
assign (resid 27 and name HB) (resid 27 and name HN) 2.87 1.07 1.07  !intra!     c13noe.16
assign (resid 27 and name HB) (resid 27 and name HA) 2.60 0.80 0.80  !intra!     c13noe.21
!assign (resid 41 and name HB1) (resid 41 and name HB2) 2.25 0.45 0.45  !geminal!     c13noe.20
assign (resid 40 and name HB1) (resid 40 and name HD22) 3.39 1.59 1.59  !intra!     c13noe.105
assign (resid 40 and name HB2) (resid 40 and name HD21) 2.76 0.96 0.96  !intra!     c13noe.104
assign (resid 40 and name HB1) (resid 40 and name HA) 2.76 0.96 0.96  !intra!     c13noe.107
assign (resid 40 and name HB2) (resid 40 and name HD22) 3.10 1.30 1.30  !intra!     c13noe.106
assign (resid 40 and name HB2) (resid 40 and name HN) 2.66 0.86 0.86  !intra!     c13noe.103
assign (resid 40 and name HB2) (resid 41 and name HN) 3.20 1.40 1.40  !seq!     c13noe.100
assign (resid 40 and name HB1) (resid 41 and name HN) 2.84 1.04 1.04  !seq!     c13noe.99
assign (resid 40 and name HB1) (resid 40 and name HD21) 3.02 1.22 1.22  !intra!     c13noe.102
assign (resid 40 and name HB1) (resid 40 and name HN) 2.99 1.19 1.19  !intra!     c13noe.101
assign (resid 57 and name HB2) (resid 57 and name HN) 2.87 1.07 1.07  !intra!     c13noe.121
assign (resid 57 and name HB1) (resid 57 and name HN) 3.07 1.27 1.27  !intra!     c13noe.120
assign (resid 30 and name HB1) (resid 30 and name HD21) 3.36 1.56 1.56  !intra!     c13noe.123
assign (resid 57 and name HB2) (resid 58 and name HN) 3.73 1.93 1.93  !seq!     c13noe.122
!assign (resid 40 and name HB1) (resid 40 and name HB2) 2.24 0.44 0.44  !geminal!     c13noe.114
assign (resid 40 and name HB1) (resid 35 and name HA) 2.93 1.13 1.13  !long!     c13noe.110
assign (resid 40 and name HB2) (resid 40 and name HA) 2.91 1.11 1.11  !intra!     c13noe.108
!assign (resid 40 and name HB2) (resid 40 and name HB1) 2.19 0.39 0.39  !geminal!     c13noe.113
assign (resid 40 and name HB2) (resid 35 and name HA) 2.69 0.89 0.89  !long!     c13noe.111
assign (resid 49 and name HA2) (resid 50 and name HN) 2.86 1.06 1.06  !seq!     c13noe.94
assign (resid 29 and name HA) (resid 29 and name HN) 2.87 1.07 1.07  !intra!     c13noe.74
assign (resid 37 and name HA) (resid 37 and name HG1) 2.78 0.98 0.98  !intra!     c13noe.73
assign (resid 29 and name HA) (resid 52 and name HA) 3.90 2.10 2.10  !long!     c13noe.77
assign (resid 29 and name HA) (resid 30 and name HN) 2.54 0.74 0.74  !seq!     c13noe.75
assign (resid 37 and name HA) (resid 37 and name HB1) 2.66 0.86 0.86  !intra!     c13noe.72
assign (resid 39 and name HA) (resid 38 and name HN) 3.40 1.60 1.60  !seq!     c13noe.65
assign (resid 39 and name HA) (resid 39 and name HN) 2.52 0.72 0.72  !intra!     c13noe.64
assign (resid 37 and name HA) (resid 37 and name HB2) 2.56 0.76 0.76  !intra!     c13noe.71
assign (resid 37 and name HA) (resid 36 and name HB1) 3.90 2.10 2.10  !seq!     c13noe.69
assign (resid 12 and name HD2) (resid 12 and name HB1) 2.94 1.14 1.14  !intra!     c13noe.89
assign (resid 12 and name HD2) (resid 12 and name HB2) 3.19 1.39 1.39  !intra!     c13noe.88
assign (resid 49 and name HA2) (resid 49 and name HN) 2.52 0.72 0.72  !intra!     c13noe.93
assign (resid 10 and name HD1) (resid 9 and name HA) 2.54 0.74 0.74  !seq!     c13noe.91
!assign (resid 12 and name HD2) (resid 12 and name HD1) 2.23 0.43 0.43  !geminal!     c13noe.87
assign (resid 12 and name HD2) (resid 40 and name HD21) 3.49 1.69 1.69  !long!     c13noe.83
assign (resid 29 and name HA) (resid 29 and name HB2) 2.62 0.82 0.82  !intra!     c13noe.82
assign (resid 12 and name HD2) (resid 11 and name HA) 2.44 0.64 0.64  !seq!     c13noe.85
assign (resid 12 and name HD2) (resid 40 and name HD22) 3.61 1.81 1.81  !long!     c13noe.84
assign (resid 45 and name HB1) (resid 14 and name HN) 2.98 1.18 1.18  !long!     c13noe.227
assign (resid 56 and name HB2) (resid 56 and name HN) 2.95 1.15 1.15  !intra!     c13noe.399
!assign (resid 29 and name HB2) (resid 29 and name HB1) 2.23 0.43 0.43  !geminal!     c13noe.398
assign (resid 15 and name HB2) (resid 15 and name HN) 3.81 2.01 2.01  !intra!     c13noe.401
assign (resid 56 and name HB1) (resid 56 and name HN) 2.90 1.10 1.10  !intra!     c13noe.400
assign (resid 51 and name HB2) (resid 29 and name HB2) 3.12 1.32 1.32  !long!     c13noe.397
!assign (resid 37 and name HB1) (resid 37 and name HB2) 2.18 0.38 0.38  !geminal!     c13noe.388
!assign (resid 51 and name HB1) (resid 51 and name HB2) 2.23 0.43 0.43  !geminal!     c13noe.386
assign (resid 29 and name HB2) (resid 51 and name HB2) 3.65 1.85 1.85  !long!     c13noe.393
!assign (resid 51 and name HB2) (resid 51 and name HB1) 2.15 0.35 0.35  !geminal!     c13noe.389
assign (resid 56 and name HB1) (resid 56 and name HA) 2.81 1.01 1.01  !intra!     c13noe.409
assign (resid 15 and name HB1) (resid 15 and name HA) 2.66 0.86 0.86  !intra!     c13noe.407
assign (resid 32 and name HB2) (resid 32 and name HA) 2.64 0.84 0.84  !intra!     c13noe.411
assign (resid 32 and name HB1) (resid 32 and name HA) 2.50 0.70 0.70  !intra!     c13noe.410
assign (resid 9 and name HB1) (resid 9 and name HA) 2.98 1.18 1.18  !intra!     c13noe.406
assign (resid 32 and name HB2) (resid 33 and name HN) 3.62 1.82 1.82  !seq!     c13noe.403
assign (resid 32 and name HB1) (resid 33 and name HN) 3.90 2.10 2.10  !seq!     c13noe.402
assign (resid 46 and name HB1) (resid 15 and name HA) 3.76 1.96 1.96  !long!     c13noe.405
assign (resid 29 and name HB1) (resid 29 and name HN) 3.63 1.83 1.83  !intra!     c13noe.404
!assign (resid 10 and name HB2) (resid 10 and name HB1) 2.25 0.45 0.45  !geminal!     c13noe.384
assign (resid 11 and name HB1) (resid 12 and name HD2) 3.22 1.42 1.42  !seq!     c13noe.362
assign (resid 11 and name HB2) (resid 12 and name HD2) 3.23 1.43 1.43  !seq!     c13noe.361
assign (resid 29 and name HB1) (resid 53 and name HD1) 3.81 2.01 2.01  !long!     c13noe.364
assign (resid 51 and name HB2) (resid 53 and name HD1) 3.90 2.10 2.10  !medium!     c13noe.363
assign (resid 10 and name HB1) (resid 10 and name HD1) 3.49 1.69 1.69  !intra!     c13noe.360
assign (resid 12 and name HB1) (resid 12 and name HD2) 2.96 1.16 1.16  !intra!     c13noe.357
assign (resid 12 and name HB1) (resid 12 and name HD1) 3.18 1.38 1.38  !intra!     c13noe.356
assign (resid 10 and name HB1) (resid 10 and name HD2) 3.75 1.95 1.95  !intra!     c13noe.359
assign (resid 11 and name HB2) (resid 12 and name HD1) 3.36 1.56 1.56  !seq!     c13noe.358
!assign (resid 34 and name HB2) (resid 34 and name HB1) 2.24 0.44 0.44  !geminal!     c13noe.380
!assign (resid 42 and name HB2) (resid 42 and name HB1) 2.14 0.34 0.34  !geminal!     c13noe.379
!assign (resid 10 and name HB1) (resid 10 and name HB2) 2.25 0.45 0.45  !geminal!     c13noe.382
!assign (resid 53 and name HB1) (resid 53 and name HB2) 2.00 0.20 0.20  !geminal!     c13noe.381
assign (resid 42 and name HB1) (resid 52 and name HB2) 3.90 2.10 2.10  !long!     c13noe.375
!assign (resid 33 and name HB1) (resid 33 and name HB2) 2.21 0.41 0.41  !geminal!     c13noe.371
assign (resid 29 and name HB2) (resid 53 and name HD1) 3.69 1.89 1.89  !long!     c13noe.365
assign (resid 42 and name HB1) (resid 52 and name HB2) 3.80 2.00 2.00  !long!     c13noe.373
!assign (resid 33 and name HB2) (resid 33 and name HB1) 2.24 0.44 0.44  !geminal!     c13noe.372
assign (resid 35 and name HB2) (resid 36 and name HB2) 3.90 2.10 2.10  !seq!     c13noe.455
!assign (resid 46 and name HB1) (resid 46 and name HB2) 2.14 0.34 0.34  !geminal!     c13noe.453
assign (resid 35 and name HB1) (resid 40 and name HB2) 3.33 1.53 1.53  !long!     c13noe.458
assign (resid 35 and name HB2) (resid 40 and name HB2) 3.57 1.77 1.77  !long!     c13noe.457
assign (resid 35 and name HB1) (resid 35 and name HA) 2.58 0.78 0.78  !intra!     c13noe.451
assign (resid 46 and name HB1) (resid 15 and name HA) 3.90 2.10 2.10  !long!     c13noe.446
assign (resid 46 and name HB2) (resid 46 and name HA) 2.79 0.99 0.99  !intra!     c13noe.445
!assign (resid 46 and name HB2) (resid 46 and name HB1) 2.15 0.35 0.35  !geminal!     c13noe.448
assign (resid 46 and name HB2) (resid 15 and name HA) 2.97 1.17 1.17  !long!     c13noe.447
assign (resid 54 and name HB2) (resid 54 and name HN) 2.94 1.14 1.14  !intra!     c13noe.475
assign (resid 54 and name HB1) (resid 55 and name HN) 3.26 1.46 1.46  !seq!     c13noe.470
assign (resid 32 and name HG2) (resid 32 and name HN) 3.00 1.20 1.20  !intra!     c13noe.477
assign (resid 54 and name HB1) (resid 54 and name HN) 2.99 1.19 1.19  !intra!     c13noe.476
assign (resid 54 and name HB2) (resid 55 and name HN) 3.50 1.70 1.70  !seq!     c13noe.469
assign (resid 18 and name HG12) (resid 18 and name HB) 2.55 0.75 0.75  !intra!     c13noe.463
assign (resid 46 and name HB2) (resid 15 and name HB1) 3.80 2.00 2.00  !long!     c13noe.460
!assign (resid 18 and name HG11) (resid 18 and name HG12) 2.19 0.39 0.39  !geminal!     c13noe.465
assign (resid 18 and name HG11) (resid 18 and name HB) 3.10 1.30 1.30  !intra!     c13noe.464
assign (resid 46 and name HB1) (resid 46 and name HA) 2.55 0.75 0.75  !intra!     c13noe.444
!assign (resid 29 and name HB1) (resid 29 and name HB2) 2.32 0.52 0.52  !geminal!     c13noe.432
!assign (resid 15 and name HB2) (resid 15 and name HB1) 2.20 0.40 0.40  !geminal!     c13noe.429
assign (resid 35 and name HB1) (resid 35 and name HN) 2.80 1.00 1.00  !intra!     c13noe.434
assign (resid 35 and name HB2) (resid 35 and name HN) 2.78 0.98 0.98  !intra!     c13noe.433
!assign (resid 15 and name HB1) (resid 15 and name HB2) 2.18 0.38 0.38  !geminal!     c13noe.426
assign (resid 15 and name HB1) (resid 46 and name HB1) 3.90 2.10 2.10  !long!     c13noe.415
assign (resid 15 and name HB2) (resid 15 and name HA) 2.92 1.12 1.12  !intra!     c13noe.412
assign (resid 56 and name HB1) (resid 56 and name HG2) 2.45 0.65 0.65  !intra!     c13noe.425
!assign (resid 9 and name HB1) (resid 9 and name HB2) 2.28 0.48 0.48  !geminal!     c13noe.424
assign (resid 32 and name HB2) (resid 32 and name HN) 2.77 0.97 0.97  !intra!     c13noe.441
assign (resid 32 and name HB1) (resid 32 and name HN) 2.93 1.13 1.13  !intra!     c13noe.440
assign (resid 18 and name HG11) (resid 18 and name HN) 3.05 1.25 1.25  !intra!     c13noe.443
assign (resid 46 and name HB2) (resid 46 and name HD2) 3.52 1.72 1.72  !intra!     c13noe.442
assign (resid 35 and name HB1) (resid 52 and name HD21) 3.21 1.41 1.41  !long!     c13noe.439
assign (resid 35 and name HB2) (resid 36 and name HN) 2.64 0.84 0.84  !seq!     c13noe.436
assign (resid 46 and name HB1) (resid 46 and name HN) 3.05 1.25 1.25  !intra!     c13noe.435
assign (resid 35 and name HB1) (resid 36 and name HN) 2.69 0.89 0.89  !seq!     c13noe.438
assign (resid 35 and name HB2) (resid 52 and name HD21) 3.69 1.89 1.89  !long!     c13noe.437
assign (resid 10 and name HB2) (resid 10 and name HD1) 3.90 2.10 2.10  !intra!     c13noe.354
!assign (resid 45 and name HB2) (resid 45 and name HB1) 2.16 0.36 0.36  !geminal!     c13noe.259
assign (resid 45 and name HB2) (resid 45 and name HA) 2.71 0.91 0.91  !intra!     c13noe.258
assign (resid 59 and name HB) (resid 59 and name HA) 3.36 1.56 1.56  !intra!     c13noe.263
!assign (resid 50 and name HB1) (resid 50 and name HB2) 2.12 0.32 0.32  !geminal!     c13noe.262
assign (resid 45 and name HB1) (resid 45 and name HA) 2.56 0.76 0.76  !intra!     c13noe.257
assign (resid 47 and name HB2) (resid 15 and name HA) 3.71 1.91 1.91  !long!     c13noe.254
assign (resid 47 and name HB2) (resid 47 and name HA) 2.53 0.73 0.73  !intra!     c13noe.253
assign (resid 55 and name HB1) (resid 55 and name HA) 2.61 0.81 0.81  !intra!     c13noe.256
assign (resid 55 and name HB2) (resid 55 and name HA) 2.68 0.88 0.88  !intra!     c13noe.255
!assign (resid 55 and name HB2) (resid 55 and name HB1) 2.14 0.34 0.34  !geminal!     c13noe.276
!assign (resid 50 and name HB2) (resid 50 and name HB1) 2.09 0.29 0.29  !geminal!     c13noe.271
assign (resid 28 and name HB1) (resid 28 and name HN) 3.90 2.10 2.10  !intra!     c13noe.284
!assign (resid 55 and name HB1) (resid 55 and name HB2) 2.09 0.29 0.29  !geminal!     c13noe.278
assign (resid 50 and name HB1) (resid 50 and name HA) 2.69 0.89 0.89  !intra!     c13noe.270
assign (resid 50 and name HB2) (resid 50 and name HA) 2.53 0.73 0.73  !intra!     c13noe.265
!assign (resid 45 and name HB1) (resid 45 and name HB2) 2.21 0.41 0.41  !geminal!     c13noe.264
!assign (resid 47 and name HB2) (resid 47 and name HB1) 2.21 0.41 0.41  !geminal!     c13noe.268
!assign (resid 47 and name HB1) (resid 47 and name HB2) 2.19 0.39 0.39  !geminal!     c13noe.267
assign (resid 47 and name HB1) (resid 15 and name HA) 3.39 1.59 1.59  !long!     c13noe.252
assign (resid 47 and name HB2) (resid 48 and name HN) 2.63 0.83 0.83  !seq!     c13noe.238
assign (resid 47 and name HB1) (resid 48 and name HN) 2.80 1.00 1.00  !seq!     c13noe.237
assign (resid 50 and name HB1) (resid 51 and name HN) 3.86 2.06 2.06  !seq!     c13noe.240
assign (resid 47 and name HB2) (resid 50 and name HN) 3.90 2.10 2.10  !medium!     c13noe.239
assign (resid 45 and name HB2) (resid 45 and name HN) 2.61 0.81 0.81  !intra!     c13noe.236
assign (resid 45 and name HB1) (resid 46 and name HN) 2.52 0.72 0.72  !seq!     c13noe.232
assign (resid 45 and name HB2) (resid 14 and name HN) 3.37 1.57 1.57  !long!     c13noe.228
assign (resid 45 and name HB2) (resid 46 and name HN) 2.77 0.97 0.97  !seq!     c13noe.235
assign (resid 50 and name HB2) (resid 51 and name HN) 3.34 1.54 1.54  !seq!     c13noe.234
assign (resid 45 and name HB1) (resid 13 and name HA) 3.46 1.66 1.66  !long!     c13noe.249
assign (resid 45 and name HB2) (resid 42 and name HA) 3.63 1.83 1.83  !medium!     c13noe.248
assign (resid 47 and name HB1) (resid 47 and name HA) 2.47 0.67 0.67  !intra!     c13noe.251
assign (resid 45 and name HB1) (resid 47 and name HA) 3.90 2.10 2.10  !medium!     c13noe.250
assign (resid 45 and name HB1) (resid 42 and name HA) 3.90 2.10 2.10  !medium!     c13noe.247
assign (resid 50 and name HB1) (resid 50 and name HN) 2.47 0.67 0.67  !intra!     c13noe.242
assign (resid 50 and name HB1) (resid 51 and name HN) 3.90 2.10 2.10  !seq!     c13noe.241
assign (resid 59 and name HB) (resid 59 and name HN) 3.56 1.76 1.76  !intra!     c13noe.246
assign (resid 45 and name HB1) (resid 47 and name HN) 2.62 0.82 0.82  !medium!     c13noe.243
assign (resid 33 and name HB1) (resid 34 and name HD2) 3.53 1.73 1.73  !seq!     c13noe.329
assign (resid 33 and name HB1) (resid 33 and name HA) 3.06 1.26 1.26  !intra!     c13noe.328
assign (resid 42 and name HB1) (resid 41 and name HA) 3.90 2.10 2.10  !seq!     c13noe.332
assign (resid 33 and name HB2) (resid 33 and name HA) 2.82 1.02 1.02  !intra!     c13noe.330
assign (resid 28 and name HB2) (resid 52 and name HA) 3.25 1.45 1.45  !long!     c13noe.323
assign (resid 42 and name HB2) (resid 42 and name HA) 2.68 0.88 0.88  !intra!     c13noe.319
assign (resid 33 and name HB2) (resid 30 and name HN) 3.33 1.53 1.53  !medium!     c13noe.318
assign (resid 42 and name HB2) (resid 41 and name HA) 3.90 2.10 2.10  !seq!     c13noe.322
assign (resid 42 and name HB1) (resid 42 and name HA) 2.81 1.01 1.01  !intra!     c13noe.320
assign (resid 28 and name HB2) (resid 28 and name HA) 2.66 0.86 0.86  !intra!     c13noe.344
assign (resid 29 and name HB1) (resid 26 and name HA) 2.80 1.00 1.00  !medium!     c13noe.342
assign (resid 10 and name HB2) (resid 10 and name HD2) 3.34 1.54 1.54  !intra!     c13noe.353
!assign (resid 42 and name HB1) (resid 42 and name HB2) 2.14 0.34 0.34  !geminal!     c13noe.352
assign (resid 37 and name HB1) (resid 34 and name HA) 3.21 1.41 1.41  !medium!     c13noe.339
assign (resid 51 and name HB1) (resid 51 and name HA) 2.52 0.72 0.72  !intra!     c13noe.336
assign (resid 10 and name HB2) (resid 10 and name HA) 2.53 0.73 0.73  !intra!     c13noe.333
assign (resid 10 and name HB1) (resid 10 and name HA) 2.90 1.10 1.10  !intra!     c13noe.338
assign (resid 11 and name HB2) (resid 11 and name HA) 2.70 0.90 0.90  !intra!     c13noe.337
assign (resid 29 and name HB2) (resid 29 and name HN) 3.37 1.57 1.57  !intra!     c13noe.314
assign (resid 34 and name HB2) (resid 35 and name HN) 3.19 1.39 1.39  !seq!     c13noe.296
assign (resid 10 and name HB2) (resid 11 and name HN) 3.35 1.55 1.55  !seq!     c13noe.295
assign (resid 37 and name HB1) (resid 37 and name HN) 2.69 0.89 0.89  !intra!     c13noe.300
assign (resid 11 and name HB1) (resid 11 and name HN) 2.90 1.10 1.10  !intra!     c13noe.298
assign (resid 42 and name HB1) (resid 42 and name HN) 2.80 1.00 1.00  !intra!     c13noe.294
assign (resid 28 and name HB1) (resid 52 and name HN) 3.28 1.48 1.48  !long!     c13noe.286
assign (resid 28 and name HB2) (resid 28 and name HN) 3.41 1.61 1.61  !intra!     c13noe.285
assign (resid 33 and name HB1) (resid 37 and name HN) 3.52 1.72 1.72  !medium!     c13noe.293
assign (resid 42 and name HB2) (resid 42 and name HN) 2.84 1.04 1.04  !intra!     c13noe.291
assign (resid 12 and name HB1) (resid 13 and name HN) 2.98 1.18 1.18  !seq!     c13noe.310
assign (resid 42 and name HB1) (resid 43 and name HN) 3.90 2.10 2.10  !seq!     c13noe.309
assign (resid 29 and name HB1) (resid 29 and name HN) 3.62 1.82 1.82  !intra!     c13noe.313
assign (resid 51 and name HB1) (resid 51 and name HN) 3.18 1.38 1.38  !intra!     c13noe.311
assign (resid 33 and name HB2) (resid 33 and name HN) 2.77 0.97 0.97  !intra!     c13noe.308
assign (resid 33 and name HB1) (resid 36 and name HN) 3.02 1.22 1.22  !medium!     c13noe.305
assign (resid 28 and name HB2) (resid 50 and name HN) 3.78 1.98 1.98  !long!     c13noe.304
assign (resid 33 and name HB2) (resid 36 and name HN) 3.55 1.75 1.75  !medium!     c13noe.307
assign (resid 33 and name HB1) (resid 33 and name HN) 2.62 0.82 0.82  !intra!     c13noe.306
assign (resid 46 and name HD2) (resid 15 and name HG1) 3.00 1.20 1.20  !ambig!     carnoe199.27
    or (resid 46 and name HD2) (resid 15 and name HB2)                 !!     carnoe199.27
    or (resid 46 and name HD2) (resid 15 and name HG2)                 !!     carnoe199.27
    or (resid 46 and name HD2) (resid 13 and name HB2)                 !!     carnoe199.27
    or (resid 46 and name HD2) (resid 13 and name HB1)                 !!     carnoe199.27
assign (resid 36 and name HE#) (resid 53 and name HD1) 2.88 1.08 1.08  !ambig!     carnoe199.15
    or (resid 36 and name HE#) (resid 36 and name HA)                 !!     carnoe199.15
assign (resid 36 and name HE#) (resid 53 and name HB2) 2.68 0.88 0.88  !ambig!     carnoe199.12
    or (resid 36 and name HE#) (resid 53 and name HG1)                 !!     carnoe199.12
assign (resid 36 and name HE#) (resid 37 and name HG2) 3.12 1.32 1.32  !ambig!     carnoe199.11
    or (resid 36 and name HE#) (resid 37 and name HG1)                 !!     carnoe199.11
assign (resid 36 and name HE#) (resid 53 and name HD2) 2.81 1.01 1.01  !ambig!     carnoe199.16
    or (resid 36 and name HE#) (resid 31 and name HA)                 !!     carnoe199.16
assign (resid 54 and name HD2) (resid 54 and name HB2) 2.52 0.72 0.72  !ambig!     carnoe199.29
    or (resid 54 and name HD2) (resid 54 and name HB1)                 !!     carnoe199.29
    or (resid 54 and name HD2) (resid 36 and name HB1)                 !!     carnoe199.29
    or (resid 54 and name HD2) (resid 39 and name HB2)                 !!     carnoe199.29
assign (resid 39 and name HD#) (resid 39 and name HB1) 2.82 1.02 1.02  !ambig!     carnoe199.25
    or (resid 39 and name HD#) (resid 39 and name HA)                 !!     carnoe199.25
assign (resid 39 and name HD#) (resid 39 and name HB2) 2.92 1.12 1.12  !ambig!     carnoe199.24
    or (resid 39 and name HD#) (resid 54 and name HB1)                 !!     carnoe199.24
assign (resid 36 and name HD#) (resid 53 and name HD2) 2.64 0.84 0.84  !ambig!     carnoe199.4
    or (resid 36 and name HD#) (resid 31 and name HA)                 !!     carnoe199.4
assign (resid 36 and name HD#) (resid 36 and name HA) 2.59 0.79 0.79  !ambig!     carnoe199.3
    or (resid 36 and name HD#) (resid 53 and name HD1)                 !!     carnoe199.3
assign (resid 36 and name HD#) (resid 29 and name HA) 2.59 0.79 0.79  !ambig!     carnoe199.1
    or (resid 36 and name HD#) (resid 33 and name HB1)                 !!     carnoe199.1
assign (resid 36 and name HD#) (resid 36 and name HB1) 2.51 0.71 0.71  !intra!     carnoe199.0
assign (resid 54 and name HD2) (resid 36 and name HA) 2.66 0.86 0.86  !ambig!     carnoe199.30
    or (resid 54 and name HD2) (resid 53 and name HD1)                 !!     carnoe199.30
assign (resid 36 and name HD#) (resid 36 and name HB2) 2.63 0.83 0.83  !intra!     carnoe199.2
assign (resid 36 and name HE#) (resid 29 and name HB2) 3.62 1.82 1.82  !long!     carnoe199.9
assign (resid 58 and name HE#) (resid 58 and name HD#) 2.00 0.20 0.20  !intra!     carnoe199.36
assign (resid 58 and name HD#) (resid 58 and name HE#) 2.00 0.20 0.20  !intra!     carnoe199.37
assign (resid 54 and name HE1) (resid 39 and name HD#) 2.67 0.87 0.87  !long!     carnoe199.33
assign (resid 58 and name HD#) (resid 58 and name HB1) 2.52 0.72 0.72  !intra!     carnoe199.35
assign (resid 36 and name HE#) (resid 29 and name HG1) 3.03 1.23 1.23  !long!     carnoe199.10
assign (resid 36 and name HE#) (resid 36 and name HB1) 3.58 1.78 1.78  !intra!     carnoe199.13
assign (resid 36 and name HD#) (resid 36 and name HE#) 2.27 0.47 0.47  !intra!     carnoe199.7
assign (resid 36 and name HD#) (resid 30 and name HA) 3.57 1.77 1.77  !long!     carnoe199.5
assign (resid 36 and name HE#) (resid 29 and name HA) 2.88 1.08 1.08  !long!     carnoe199.14
assign (resid 36 and name HE#) (resid 36 and name HD#) 2.12 0.32 0.32  !intra!     carnoe199.18
assign (resid 39 and name HE#) (resid 39 and name HB2) 3.27 1.47 1.47  !intra!     carnoe199.19
assign (resid 36 and name HE#) (resid 30 and name HA) 3.49 1.69 1.69  !long!     carnoe199.17
assign (resid 36 and name HD#) (resid 52 and name HA) 3.29 1.49 1.49  !long!     carnoe199.6
assign (resid 54 and name HE1) (resid 36 and name HA) 3.90 2.10 2.10  !long!     carnoe199.34
assign (resid 46 and name HD2) (resid 46 and name HB1) 2.89 1.09 1.09  !intra!     carnoe199.28
assign (resid 54 and name HD2) (resid 54 and name HA) 3.17 1.37 1.37  !intra!     carnoe199.31
assign (resid 54 and name HE1) (resid 39 and name HB1) 3.08 1.28 1.28  !long!     carnoe199.32
assign (resid 48 and name HN) (resid 50 and name HB2) 3.58 1.78 1.78  !ambig!     nnoe183.387
    or (resid 48 and name HN) (resid 27 and name HB)                 !!     nnoe183.387
    or (resid 48 and name HN) (resid 45 and name HB1)                 !!     nnoe183.387
    or (resid 48 and name HN) (resid 46 and name HB1)                 !!     nnoe183.387
    or (resid 48 and name HN) (resid 28 and name HB2)                 !!     nnoe183.387
    or (resid 48 and name HN) (resid 28 and name HB1)                 !!     nnoe183.387
assign (resid 43 and name HN) (resid 11 and name HB2) 3.71 1.91 1.91  !ambig!     nnoe183.146
    or (resid 43 and name HN) (resid 11 and name HD2)                 !!     nnoe183.146
    or (resid 43 and name HN) (resid 13 and name HB1)                 !!     nnoe183.146
    or (resid 43 and name HN) (resid 11 and name HD1)                 !!     nnoe183.146
    or (resid 43 and name HN) (resid 13 and name HB2)                 !!     nnoe183.146
assign (resid 52 and name HN) (resid 51 and name HD1) 3.32 1.52 1.52  !ambig!     nnoe183.84
    or (resid 52 and name HN) (resid 51 and name HG1)                 !!     nnoe183.84
    or (resid 52 and name HN) (resid 53 and name HG2)                 !!     nnoe183.84
    or (resid 52 and name HN) (resid 51 and name HG2)                 !!     nnoe183.84
assign (resid 52 and name HD22) (resid 28 and name HB1) 3.11 1.31 1.31  !ambig!     nnoe183.749
    or (resid 52 and name HD22) (resid 42 and name HB2)                 !!     nnoe183.749
    or (resid 52 and name HD22) (resid 41 and name HB1)                 !!     nnoe183.749
    or (resid 52 and name HD22) (resid 35 and name HA)                 !!     nnoe183.749
assign (resid 52 and name HD22) (resid 35 and name HB2) 3.33 1.53 1.53  !ambig!     nnoe183.752
    or (resid 52 and name HD22) (resid 40 and name HB1)                 !!     nnoe183.752
    or (resid 52 and name HD22) (resid 36 and name HB1)                 !!     nnoe183.752
    or (resid 52 and name HD22) (resid 54 and name HB1)                 !!     nnoe183.752
assign (resid 33 and name HN) (resid 34 and name HD1) 3.18 1.38 1.38  !ambig!     nnoe183.159
    or (resid 33 and name HN) (resid 31 and name HB2)                 !!     nnoe183.159
    or (resid 33 and name HN) (resid 28 and name HA)                 !!     nnoe183.159
    or (resid 33 and name HN) (resid 27 and name HA)                 !!     nnoe183.159
assign (resid 38 and name HN) (resid 36 and name HD#) 3.53 1.73 1.73  !ambig!     nnoe183.788
    or (resid 38 and name HN) (resid 39 and name HD#)                 !!     nnoe183.788
assign (resid 47 and name HN) (resid 13 and name HB2) 3.84 2.04 2.04  !ambig!     nnoe183.448
    or (resid 47 and name HN) (resid 48 and name HB)                 !!     nnoe183.448
    or (resid 47 and name HN) (resid 15 and name HB2)                 !!     nnoe183.448
    or (resid 47 and name HN) (resid 13 and name HB1)                 !!     nnoe183.448
assign (resid 52 and name HN) (resid 28 and name HB2) 2.88 1.08 1.08  !ambig!     nnoe183.77
    or (resid 52 and name HN) (resid 28 and name HB1)                 !!     nnoe183.77
    or (resid 52 and name HN) (resid 42 and name HB2)                 !!     nnoe183.77
    or (resid 52 and name HN) (resid 50 and name HB2)                 !!     nnoe183.77
assign (resid 50 and name HN) (resid 50 and name HB2) 2.78 0.98 0.98  !ambig!     nnoe183.319
    or (resid 50 and name HN) (resid 28 and name HB2)                 !!     nnoe183.319
    or (resid 50 and name HN) (resid 27 and name HB)                 !!     nnoe183.319
    or (resid 50 and name HN) (resid 28 and name HB1)                 !!     nnoe183.319
assign (resid 36 and name HN) (resid 36 and name HB1) 2.27 0.47 0.47  !ambig!     nnoe183.138
    or (resid 36 and name HN) (resid 35 and name HB2)                 !!     nnoe183.138
    or (resid 36 and name HN) (resid 33 and name HB2)                 !!     nnoe183.138
assign (resid 47 and name HN) (resid 18 and name HD1#) 3.86 2.06 2.06  !ambig!     nnoe183.452
    or (resid 47 and name HN) (resid 48 and name HG2#)                 !!     nnoe183.452
    or (resid 47 and name HN) (resid 48 and name HG1#)                 !!     nnoe183.452
assign (resid 26 and name HN) (resid 29 and name HB2) 3.38 1.58 1.58  !ambig!     nnoe183.839
    or (resid 26 and name HN) (resid 25 and name HD2#)                 !!     nnoe183.839
    or (resid 26 and name HN) (resid 25 and name HD1#)                 !!     nnoe183.839
assign (resid 37 and name HN) (resid 38 and name HB1) 3.32 1.52 1.52  !ambig!     nnoe183.485
    or (resid 37 and name HN) (resid 31 and name HA)                 !!     nnoe183.485
    or (resid 37 and name HN) (resid 32 and name HA)                 !!     nnoe183.485
assign (resid 14 and name HN) (resid 35 and name HB2) 3.87 2.07 2.07  !ambig!     nnoe183.58
    or (resid 14 and name HN) (resid 46 and name HB2)                 !!     nnoe183.58
    or (resid 14 and name HN) (resid 47 and name HB2)                 !!     nnoe183.58
assign (resid 41 and name HN) (resid 11 and name HB2) 3.33 1.53 1.53  !ambig!     nnoe183.575
    or (resid 41 and name HN) (resid 11 and name HD1)                 !!     nnoe183.575
    or (resid 41 and name HN) (resid 11 and name HD2)                 !!     nnoe183.575
assign (resid 43 and name HN) (resid 41 and name HB2) 3.18 1.38 1.38  !ambig!     nnoe183.128
    or (resid 43 and name HN) (resid 44 and name HA1)                 !!     nnoe183.128
    or (resid 43 and name HN) (resid 45 and name HA)                 !!     nnoe183.128
assign (resid 19 and name HN) (resid 18 and name HA) 2.56 0.76 0.76  !ambig!     nnoe183.588
    or (resid 19 and name HN) (resid 19 and name HB1)                 !!     nnoe183.588
    or (resid 19 and name HN) (resid 19 and name HB2)                 !!     nnoe183.588
assign (resid 15 and name HN) (resid 15 and name HG2) 2.57 0.77 0.77  !ambig!     nnoe183.467
    or (resid 15 and name HN) (resid 15 and name HB2)                 !!     nnoe183.467
    or (resid 15 and name HN) (resid 15 and name HG1)                 !!     nnoe183.467
assign (resid 33 and name HN) (resid 32 and name HA) 2.54 0.74 0.74  !ambig!     nnoe183.158
    or (resid 33 and name HN) (resid 31 and name HA)                 !!     nnoe183.158
    or (resid 33 and name HN) (resid 34 and name HD2)                 !!     nnoe183.158
assign (resid 32 and name HN) (resid 33 and name HB1) 3.01 1.21 1.21  !ambig!     nnoe183.390
    or (resid 32 and name HN) (resid 32 and name HD1)                 !!     nnoe183.390
    or (resid 32 and name HN) (resid 32 and name HD2)                 !!     nnoe183.390
assign (resid 48 and name HN) (resid 16 and name HB1) 3.32 1.52 1.52  !ambig!     nnoe183.392
    or (resid 48 and name HN) (resid 50 and name HA)                 !!     nnoe183.392
    or (resid 48 and name HN) (resid 16 and name HB2)                 !!     nnoe183.392
assign (resid 40 and name HD22) (resid 11 and name HB2) 3.90 2.10 2.10  !ambig!     nnoe183.715
    or (resid 40 and name HD22) (resid 11 and name HD1)                 !!     nnoe183.715
    or (resid 40 and name HD22) (resid 11 and name HD2)                 !!     nnoe183.715
assign (resid 40 and name HD21) (resid 11 and name HB2) 3.90 2.10 2.10  !ambig!     nnoe183.702
    or (resid 40 and name HD21) (resid 11 and name HD1)                 !!     nnoe183.702
    or (resid 40 and name HD21) (resid 11 and name HD2)                 !!     nnoe183.702
assign (resid 22 and name HN) (resid 21 and name HB1) 3.44 1.64 1.64  !ambig!     nnoe183.354
    or (resid 22 and name HN) (resid 22 and name HB2)                 !!     nnoe183.354
    or (resid 22 and name HN) (resid 22 and name HB1)                 !!     nnoe183.354
assign (resid 50 and name HN) (resid 51 and name HG1) 3.90 2.10 2.10  !ambig!     nnoe183.329
    or (resid 50 and name HN) (resid 51 and name HD1)                 !!     nnoe183.329
    or (resid 50 and name HN) (resid 51 and name HG2)                 !!     nnoe183.329
assign (resid 50 and name HN) (resid 48 and name HB) 3.77 1.97 1.97  !ambig!     nnoe183.328
    or (resid 50 and name HN) (resid 51 and name HD2)                 !!     nnoe183.328
    or (resid 50 and name HN) (resid 51 and name HB2)                 !!     nnoe183.328
assign (resid 29 and name HN) (resid 28 and name HB2) 2.67 0.87 0.87  !ambig!     nnoe183.611
    or (resid 29 and name HN) (resid 28 and name HB1)                 !!     nnoe183.611
    or (resid 29 and name HN) (resid 27 and name HB)                 !!     nnoe183.611
assign (resid 52 and name HD21) (resid 28 and name HB1) 2.96 1.16 1.16  !ambig!     nnoe183.763
    or (resid 52 and name HD21) (resid 28 and name HB2)                 !!     nnoe183.763
    or (resid 52 and name HD21) (resid 35 and name HA)                 !!     nnoe183.763
assign (resid 33 and name HN) (resid 37 and name HB1) 3.18 1.38 1.38  !ambig!     nnoe183.166
    or (resid 33 and name HN) (resid 32 and name HG1)                 !!     nnoe183.166
    or (resid 33 and name HN) (resid 32 and name HG2)                 !!     nnoe183.166
assign (resid 28 and name HN) (resid 28 and name HB2) 2.21 0.41 0.41  !ambig!     nnoe183.207
    or (resid 28 and name HN) (resid 27 and name HB)                 !!     nnoe183.207
    or (resid 28 and name HN) (resid 28 and name HB1)                 !!     nnoe183.207
assign (resid 54 and name HN) (resid 39 and name HA) 3.61 1.81 1.81  !ambig!     nnoe183.277
    or (resid 54 and name HN) (resid 52 and name HB2)                 !!     nnoe183.277
    or (resid 54 and name HN) (resid 39 and name HB1)                 !!     nnoe183.277
assign (resid 30 and name HN) (resid 28 and name HA) 3.04 1.24 1.24  !ambig!     nnoe183.731
    or (resid 30 and name HN) (resid 27 and name HA)                 !!     nnoe183.731
    or (resid 30 and name HN) (resid 53 and name HD1)                 !!     nnoe183.731
assign (resid 30 and name HN) (resid 33 and name HB2) 2.66 0.86 0.86  !ambig!     nnoe183.736
    or (resid 30 and name HN) (resid 30 and name HB2)                 !!     nnoe183.736
    or (resid 30 and name HN) (resid 36 and name HB1)                 !!     nnoe183.736
assign (resid 51 and name HN) (resid 28 and name HB2) 2.41 0.61 0.61  !ambig!     nnoe183.31
    or (resid 51 and name HN) (resid 28 and name HB1)                 !!     nnoe183.31
    or (resid 51 and name HN) (resid 50 and name HB2)                 !!     nnoe183.31
assign (resid 51 and name HN) (resid 28 and name HA) 3.23 1.43 1.43  !ambig!     nnoe183.30
    or (resid 51 and name HN) (resid 27 and name HA)                 !!     nnoe183.30
    or (resid 51 and name HN) (resid 53 and name HD1)                 !!     nnoe183.30
assign (resid 40 and name HN) (resid 40 and name HB1) 2.69 0.89 0.89  !ambig!     nnoe183.498
    or (resid 40 and name HN) (resid 39 and name HB2)                 !!     nnoe183.498
    or (resid 40 and name HN) (resid 54 and name HB1)                 !!     nnoe183.498
assign (resid 51 and name HN) (resid 51 and name HG1) 2.57 0.77 0.77  !ambig!     nnoe183.38
    or (resid 51 and name HN) (resid 51 and name HG2)                 !!     nnoe183.38
    or (resid 51 and name HN) (resid 51 and name HD1)                 !!     nnoe183.38
assign (resid 11 and name HN) (resid 11 and name HD2) 2.66 0.86 0.86  !ambig!     nnoe183.881
    or (resid 11 and name HN) (resid 11 and name HD1)                 !!     nnoe183.881
    or (resid 11 and name HN) (resid 11 and name HB2)                 !!     nnoe183.881
assign (resid 47 and name HN) (resid 46 and name HN) 2.40 0.60 0.60  !ambig!     nnoe183.422
    or (resid 47 and name HN) (resid 48 and name HN)                 !!     nnoe183.422
assign (resid 29 and name HN) (resid 28 and name HA) 2.68 0.88 0.88  !ambig!     nnoe183.610
    or (resid 29 and name HN) (resid 27 and name HA)                 !!     nnoe183.610
assign (resid 20 and name HN) (resid 19 and name HB2) 3.19 1.39 1.39  !ambig!     nnoe183.758
    or (resid 20 and name HN) (resid 19 and name HB1)                 !!     nnoe183.758
assign (resid 28 and name HN) (resid 28 and name HA) 2.45 0.65 0.65  !ambig!     nnoe183.205
    or (resid 28 and name HN) (resid 27 and name HA)                 !!     nnoe183.205
assign (resid 35 and name HN) (resid 34 and name HB2) 2.81 1.01 1.01  !ambig!     nnoe183.20
    or (resid 35 and name HN) (resid 12 and name HB1)                 !!     nnoe183.20
assign (resid 35 and name HN) (resid 34 and name HG2) 2.44 0.64 0.64  !ambig!     nnoe183.19
    or (resid 35 and name HN) (resid 34 and name HG1)                 !!     nnoe183.19
assign (resid 28 and name HN) (resid 27 and name HG2#) 2.85 1.05 1.05  !ambig!     nnoe183.213
    or (resid 28 and name HN) (resid 29 and name HB1)                 !!     nnoe183.213
assign (resid 23 and name HN) (resid 22 and name HB2) 3.79 1.99 1.99  !ambig!     nnoe183.234
    or (resid 23 and name HN) (resid 22 and name HB1)                 !!     nnoe183.234
assign (resid 52 and name HD22) (resid 52 and name HB1) 3.12 1.32 1.32  !ambig!     nnoe183.750
    or (resid 52 and name HD22) (resid 36 and name HB2)                 !!     nnoe183.750
assign (resid 13 and name HN) (resid 13 and name HB1) 2.58 0.78 0.78  !ambig!     nnoe183.410
    or (resid 13 and name HN) (resid 13 and name HB2)                 !!     nnoe183.410
assign (resid 29 and name HN) (resid 29 and name HG2) 3.22 1.42 1.42  !ambig!     nnoe183.617
    or (resid 29 and name HN) (resid 29 and name HG1)                 !!     nnoe183.617
assign (resid 29 and name HN) (resid 29 and name HD2) 3.33 1.53 1.53  !ambig!     nnoe183.613
    or (resid 29 and name HN) (resid 29 and name HD1)                 !!     nnoe183.613
assign (resid 52 and name HD21) (resid 42 and name HN) 3.54 1.74 1.74  !ambig!     nnoe183.755
    or (resid 52 and name HD21) (resid 41 and name HN)                 !!     nnoe183.755
assign (resid 48 and name HN) (resid 48 and name HG1#) 2.52 0.72 0.72  !ambig!     nnoe183.415
    or (resid 48 and name HN) (resid 48 and name HG2#)                 !!     nnoe183.415
assign (resid 29 and name HN) (resid 36 and name HB1) 3.63 1.83 1.83  !ambig!     nnoe183.614
    or (resid 29 and name HN) (resid 33 and name HB2)                 !!     nnoe183.614
assign (resid 28 and name HN) (resid 26 and name HN) 3.90 2.10 2.10  !ambig!     nnoe183.197
    or (resid 28 and name HN) (resid 52 and name HD21)                 !!     nnoe183.197
assign (resid 33 and name HN) (resid 32 and name HB1) 3.15 1.35 1.35  !ambig!     nnoe183.164
    or (resid 33 and name HN) (resid 37 and name HB2)                 !!     nnoe183.164
assign (resid 33 and name HN) (resid 33 and name HB2) 2.44 0.64 0.64  !ambig!     nnoe183.163
    or (resid 33 and name HN) (resid 36 and name HB1)                 !!     nnoe183.163
assign (resid 47 and name HN) (resid 47 and name HB1) 2.41 0.61 0.61  !ambig!     nnoe183.439
    or (resid 47 and name HN) (resid 45 and name HB2)                 !!     nnoe183.439
assign (resid 47 and name HN) (resid 47 and name HB2) 2.74 0.94 0.94  !ambig!     nnoe183.442
    or (resid 47 and name HN) (resid 46 and name HB2)                 !!     nnoe183.442
assign (resid 19 and name HN) (resid 18 and name HG2#) 3.10 1.30 1.30  !ambig!     nnoe183.596
    or (resid 19 and name HN) (resid 18 and name HD1#)                 !!     nnoe183.596
assign (resid 39 and name HN) (resid 39 and name HD#) 2.95 1.15 1.15  !intra!     nnoe183.866
assign (resid 47 and name HN) (resid 50 and name HB1) 3.58 1.78 1.78  !ambig!     nnoe183.443
    or (resid 47 and name HN) (resid 42 and name HB1)                 !!     nnoe183.443
assign (resid 33 and name HN) (resid 36 and name HD#) 3.86 2.06 2.06  !medium!     nnoe183.155
assign (resid 18 and name HN) (resid 16 and name HB2) 3.81 2.01 2.01  !ambig!     nnoe183.438
    or (resid 18 and name HN) (resid 16 and name HB1)                 !!     nnoe183.438
assign (resid 16 and name HN) (resid 16 and name HB2) 2.40 0.60 0.60  !ambig!     nnoe183.187
    or (resid 16 and name HN) (resid 16 and name HB1)                 !!     nnoe183.187
assign (resid 16 and name HN) (resid 47 and name HB1) 2.55 0.75 0.75  !ambig!     nnoe183.186
    or (resid 16 and name HN) (resid 45 and name HB2)                 !!     nnoe183.186
assign (resid 52 and name HD21) (resid 52 and name HB1) 2.85 1.05 1.05  !ambig!     nnoe183.764
    or (resid 52 and name HD21) (resid 36 and name HB2)                 !!     nnoe183.764
assign (resid 29 and name HN) (resid 30 and name HA) 3.55 1.75 1.75  !ambig!     nnoe183.607
    or (resid 29 and name HN) (resid 51 and name HA)                 !!     nnoe183.607
assign (resid 16 and name HN) (resid 48 and name HN) 3.31 1.51 1.51  !ambig!     nnoe183.176
    or (resid 16 and name HN) (resid 46 and name HN)                 !!     nnoe183.176
assign (resid 47 and name HN) (resid 45 and name HB1) 2.47 0.67 0.67  !ambig!     nnoe183.436
    or (resid 47 and name HN) (resid 46 and name HB1)                 !!     nnoe183.436
assign (resid 16 and name HN) (resid 45 and name HB1) 3.67 1.87 1.87  !ambig!     nnoe183.185
    or (resid 16 and name HN) (resid 50 and name HB2)                 !!     nnoe183.185
assign (resid 52 and name HD21) (resid 35 and name HB2) 3.34 1.54 1.54  !ambig!     nnoe183.768
    or (resid 52 and name HD21) (resid 36 and name HB1)                 !!     nnoe183.768
assign (resid 52 and name HD22) (resid 42 and name HN) 3.43 1.63 1.63  !ambig!     nnoe183.743
    or (resid 52 and name HD22) (resid 41 and name HN)                 !!     nnoe183.743
assign (resid 32 and name HN) (resid 33 and name HB2) 3.73 1.93 1.93  !ambig!     nnoe183.885
    or (resid 32 and name HN) (resid 36 and name HB1)                 !!     nnoe183.885
assign (resid 32 and name HN) (resid 31 and name HB2) 2.97 1.17 1.17  !ambig!     nnoe183.382
    or (resid 32 and name HN) (resid 31 and name HB1)                 !!     nnoe183.382
assign (resid 32 and name HN) (resid 32 and name HA) 2.40 0.60 0.60  !ambig!     nnoe183.377
    or (resid 32 and name HN) (resid 31 and name HA)                 !!     nnoe183.377
assign (resid 40 and name HD21) (resid 12 and name HG2) 3.80 2.00 2.00  !ambig!     nnoe183.701
    or (resid 40 and name HD21) (resid 12 and name HG1)                 !!     nnoe183.701
assign (resid 48 and name HN) (resid 17 and name HA2) 3.18 1.38 1.38  !ambig!     nnoe183.386
    or (resid 48 and name HN) (resid 49 and name HA2)                 !!     nnoe183.386
assign (resid 35 and name HN) (resid 34 and name HA) 2.62 0.82 0.82  !ambig!     nnoe183.10
    or (resid 35 and name HN) (resid 34 and name HD2)                 !!     nnoe183.10
assign (resid 25 and name HN) (resid 25 and name HB2) 2.82 1.02 1.02  !ambig!     nnoe183.295
    or (resid 54 and name HN) (resid 53 and name HG2)                 !!     nnoe183.295
assign (resid 48 and name HN) (resid 18 and name HA) 3.37 1.57 1.57  !ambig!     nnoe183.384
    or (resid 48 and name HN) (resid 16 and name HA)                 !!     nnoe183.384
assign (resid 40 and name HD21) (resid 12 and name HD1) 3.25 1.45 1.45  !ambig!     nnoe183.695
    or (resid 40 and name HD21) (resid 38 and name HB2)                 !!     nnoe183.695
assign (resid 45 and name HN) (resid 13 and name HG2) 3.30 1.50 1.50  !ambig!     nnoe183.330
    or (resid 45 and name HN) (resid 43 and name HB#)                 !!     nnoe183.330
assign (resid 45 and name HN) (resid 13 and name HB2) 3.24 1.44 1.44  !ambig!     nnoe183.326
    or (resid 45 and name HN) (resid 13 and name HB1)                 !!     nnoe183.326
assign (resid 46 and name HN) (resid 13 and name HB2) 3.17 1.37 1.37  !ambig!     nnoe183.524
    or (resid 46 and name HN) (resid 13 and name HB1)                 !!     nnoe183.524
assign (resid 50 and name HN) (resid 48 and name HG2#) 3.57 1.77 1.77  !ambig!     nnoe183.332
    or (resid 50 and name HN) (resid 48 and name HG1#)                 !!     nnoe183.332
assign (resid 39 and name HN) (resid 39 and name HA) 2.20 0.40 0.40  !ambig!     nnoe183.647
    or (resid 39 and name HN) (resid 39 and name HB1)                 !!     nnoe183.647
assign (resid 39 and name HN) (resid 37 and name HA) 2.91 1.11 1.11  !ambig!     nnoe183.643
    or (resid 39 and name HN) (resid 38 and name HB2)                 !!     nnoe183.643
assign (resid 44 and name HN) (resid 45 and name HB1) 3.90 2.10 2.10  !ambig!     nnoe183.683
    or (resid 44 and name HN) (resid 42 and name HB2)                 !!     nnoe183.683
assign (resid 48 and name HN) (resid 47 and name HN) 3.24 1.44 1.44  !ambig!     nnoe183.366
    or (resid 48 and name HN) (resid 16 and name HN)                 !!     nnoe183.366
assign (resid 54 and name HN) (resid 53 and name HB2) 2.88 1.08 1.08  !ambig!     nnoe183.287
    or (resid 54 and name HN) (resid 53 and name HG1)                 !!     nnoe183.287
assign (resid 56 and name HN) (resid 55 and name HG2) 3.33 1.53 1.53  !ambig!     nnoe183.250
    or (resid 56 and name HN) (resid 55 and name HG1)                 !!     nnoe183.250
assign (resid 56 and name HN) (resid 56 and name HB1) 2.58 0.78 0.78  !ambig!     nnoe183.247
    or (resid 56 and name HN) (resid 55 and name HB2)                 !!     nnoe183.247
assign (resid 54 and name HN) (resid 36 and name HD#) 3.37 1.57 1.57  !long!     nnoe183.877
assign (resid 46 and name HN) (resid 45 and name HB1) 2.35 0.55 0.55  !ambig!     nnoe183.516
    or (resid 46 and name HN) (resid 46 and name HB1)                 !!     nnoe183.516
assign (resid 56 and name HN) (resid 56 and name HG2) 3.01 1.21 1.21  !ambig!     nnoe183.244
    or (resid 56 and name HN) (resid 56 and name HG1)                 !!     nnoe183.244
assign (resid 57 and name HN) (resid 56 and name HG2) 3.17 1.37 1.37  !ambig!     nnoe183.243
    or (resid 57 and name HN) (resid 56 and name HG1)                 !!     nnoe183.243
assign (resid 30 and name HN) (resid 29 and name HG1) 3.15 1.35 1.35  !ambig!     nnoe183.740
    or (resid 30 and name HN) (resid 29 and name HB1)                 !!     nnoe183.740
assign (resid 29 and name HN) (resid 29 and name HB1) 2.64 0.84 0.84  !ambig!     nnoe183.618
    or (resid 29 and name HN) (resid 29 and name HG1)                 !!     nnoe183.618
assign (resid 58 and name HN) (resid 58 and name HD#) 3.13 1.33 1.33  !intra!     nnoe183.261
assign (resid 54 and name HN) (resid 53 and name HG1) 3.16 1.36 1.36  !ambig!     nnoe183.878
    or (resid 54 and name HN) (resid 53 and name HG2)                 !!     nnoe183.878
assign (resid 32 and name HN) (resid 30 and name HB2) 3.37 1.57 1.57  !ambig!     nnoe183.394
    or (resid 32 and name HN) (resid 36 and name HB1)                 !!     nnoe183.394
assign (resid 39 and name HN) (resid 39 and name HE#) 3.90 2.10 2.10  !intra!     nnoe183.632
assign (resid 16 and name HN) (resid 15 and name HG2) 3.62 1.82 1.82  !ambig!     nnoe183.884
    or (resid 16 and name HN) (resid 15 and name HG1)                 !!     nnoe183.884
assign (resid 32 and name HN) (resid 32 and name HB1) 2.88 1.08 1.08  !ambig!     nnoe183.401
    or (resid 32 and name HN) (resid 37 and name HB2)                 !!     nnoe183.401
assign (resid 54 and name HN) (resid 36 and name HE#) 3.74 1.94 1.94  !long!     nnoe183.262
assign (resid 25 and name HN) (resid 25 and name HA) 2.58 0.78 0.78  !ambig!     nnoe183.270
    or (resid 25 and name HN) (resid 24 and name HB)                 !!     nnoe183.270
assign (resid 13 and name HN) (resid 13 and name HE1) 3.76 1.96 1.96  !ambig!     nnoe183.396
    or (resid 13 and name HN) (resid 13 and name HE2)                 !!     nnoe183.396
assign (resid 17 and name HN) (resid 18 and name HD1#) 3.81 2.01 2.01  !ambig!     nnoe183.821
    or (resid 17 and name HN) (resid 18 and name HG2#)                 !!     nnoe183.821
assign (resid 11 and name HN) (resid 12 and name HD1) 3.34 1.54 1.54  !ambig!     nnoe183.97
    or (resid 11 and name HN) (resid 10 and name HD2)                 !!     nnoe183.97
assign (resid 11 and name HN) (resid 10 and name HG2) 3.44 1.64 1.64  !ambig!     nnoe183.105
    or (resid 11 and name HN) (resid 10 and name HG1)                 !!     nnoe183.105
assign (resid 11 and name HN) (resid 11 and name HE1) 3.57 1.77 1.77  !ambig!     nnoe183.100
    or (resid 11 and name HN) (resid 11 and name HE2)                 !!     nnoe183.100
assign (resid 26 and name HN) (resid 25 and name HA) 2.70 0.90 0.90  !ambig!     nnoe183.826
    or (resid 26 and name HN) (resid 26 and name HB)                 !!     nnoe183.826
assign (resid 52 and name HN) (resid 50 and name HB1) 3.90 2.10 2.10  !ambig!     nnoe183.81
    or (resid 52 and name HN) (resid 42 and name HB1)                 !!     nnoe183.81
assign (resid 17 and name HN) (resid 48 and name HG1#) 3.90 2.10 2.10  !ambig!     nnoe183.822
    or (resid 17 and name HN) (resid 48 and name HG2#)                 !!     nnoe183.822
assign (resid 49 and name HN) (resid 48 and name HG2#) 2.45 0.65 0.65  !ambig!     nnoe183.580
    or (resid 49 and name HN) (resid 48 and name HG1#)                 !!     nnoe183.580
assign (resid 15 and name HN) (resid 16 and name HB1) 3.78 1.98 1.98  !ambig!     nnoe183.463
    or (resid 15 and name HN) (resid 16 and name HB2)                 !!     nnoe183.463
assign (resid 17 and name HN) (resid 16 and name HA) 2.24 0.44 0.44  !ambig!     nnoe183.811
    or (resid 17 and name HN) (resid 18 and name HA)                 !!     nnoe183.811
assign (resid 36 and name HN) (resid 52 and name HD21) 3.17 1.37 1.37  !ambig!     nnoe183.117
    or (resid 36 and name HN) (resid 33 and name HN)                 !!     nnoe183.117
assign (resid 15 and name HN) (resid 15 and name HD2) 3.62 1.82 1.82  !ambig!     nnoe183.462
    or (resid 15 and name HN) (resid 15 and name HD1)                 !!     nnoe183.462
assign (resid 55 and name HN) (resid 55 and name HG2) 3.04 1.24 1.24  !ambig!     nnoe183.111
    or (resid 55 and name HN) (resid 55 and name HG1)                 !!     nnoe183.111
assign (resid 11 and name HN) (resid 11 and name HB1) 2.63 0.83 0.83  !ambig!     nnoe183.107
    or (resid 11 and name HN) (resid 10 and name HB1)                 !!     nnoe183.107
assign (resid 15 and name HN) (resid 34 and name HG1) 3.54 1.74 1.74  !ambig!     nnoe183.465
    or (resid 15 and name HN) (resid 34 and name HG2)                 !!     nnoe183.465
assign (resid 17 and name HN) (resid 16 and name HB2) 2.65 0.85 0.85  !ambig!     nnoe183.814
    or (resid 17 and name HN) (resid 16 and name HB1)                 !!     nnoe183.814
assign (resid 14 and name HN) (resid 34 and name HG1) 3.38 1.58 1.58  !ambig!     nnoe183.60
    or (resid 14 and name HN) (resid 34 and name HG2)                 !!     nnoe183.60
assign (resid 59 and name HN) (resid 59 and name HG1#) 2.87 1.07 1.07  !ambig!     nnoe183.852
    or (resid 59 and name HN) (resid 59 and name HG2#)                 !!     nnoe183.852
assign (resid 41 and name HN) (resid 40 and name HB1) 2.61 0.81 0.81  !ambig!     nnoe183.562
    or (resid 41 and name HN) (resid 54 and name HB1)                 !!     nnoe183.562
assign (resid 14 and name HN) (resid 13 and name HB2) 2.51 0.71 0.71  !ambig!     nnoe183.63
    or (resid 14 and name HN) (resid 13 and name HB1)                 !!     nnoe183.63
assign (resid 37 and name HN) (resid 36 and name HB1) 2.53 0.73 0.73  !ambig!     nnoe183.496
    or (resid 37 and name HN) (resid 33 and name HB1)                 !!     nnoe183.496
assign (resid 40 and name HN) (resid 39 and name HA) 2.56 0.76 0.76  !ambig!     nnoe183.497
    or (resid 40 and name HN) (resid 39 and name HB1)                 !!     nnoe183.497
assign (resid 42 and name HN) (resid 42 and name HB2) 2.40 0.60 0.60  !ambig!     nnoe183.553
    or (resid 42 and name HN) (resid 41 and name HB1)                 !!     nnoe183.553
assign (resid 14 and name HN) (resid 47 and name HN) 3.53 1.73 1.73  !ambig!     nnoe183.47
    or (resid 14 and name HN) (resid 16 and name HN)                 !!     nnoe183.47
assign (resid 37 and name HN) (resid 36 and name HE#) 3.90 2.10 2.10  !seq!     nnoe183.481
assign (resid 52 and name HD21) (resid 36 and name HD#) 3.90 2.10 2.10  !long!     nnoe183.859
assign (resid 51 and name HN) (resid 29 and name HB1) 3.42 1.62 1.62  !ambig!     nnoe183.40
    or (resid 51 and name HN) (resid 27 and name HG2#)                 !!     nnoe183.40
assign (resid 37 and name HN) (resid 36 and name HD#) 2.90 1.10 1.10  !seq!     nnoe183.480
assign (resid 52 and name HD22) (resid 36 and name HD#) 3.90 2.10 2.10  !long!     nnoe183.858
assign (resid 21 and name HN) (resid 20 and name HA2) 2.81 1.01 1.01  !ambig!     nnoe183.845
    or (resid 21 and name HN) (resid 21 and name HB1)                 !!     nnoe183.845
assign (resid 55 and name HN) (resid 54 and name HA) 2.17 0.37 0.37  !ambig!     nnoe183.840
    or (resid 55 and name HN) (resid 55 and name HA)                 !!     nnoe183.840
assign (resid 37 and name HN) (resid 34 and name HA) 3.32 1.52 1.52  !ambig!     nnoe183.484
    or (resid 37 and name HN) (resid 34 and name HD2)                 !!     nnoe183.484
assign (resid 36 and name HN) (resid 36 and name HD#) 3.14 1.34 1.34  !intra!     nnoe183.120
assign (resid 51 and name HN) (resid 26 and name HA) 3.82 2.02 2.02  !ambig!     nnoe183.29
    or (resid 51 and name HN) (resid 25 and name HA)                 !!     nnoe183.29
assign (resid 36 and name HN) (resid 34 and name HA) 3.33 1.53 1.53  !ambig!     nnoe183.127
    or (resid 36 and name HN) (resid 34 and name HD2)                 !!     nnoe183.127
assign (resid 36 and name HN) (resid 37 and name HA) 3.68 1.88 1.88  !ambig!     nnoe183.131
    or (resid 36 and name HN) (resid 14 and name HB1)                 !!     nnoe183.131
assign (resid 36 and name HN) (resid 37 and name HB2) 3.66 1.86 1.86  !ambig!     nnoe183.145
    or (resid 36 and name HN) (resid 34 and name HB2)                 !!     nnoe183.145
assign (resid 38 and name HN) (resid 37 and name HA) 2.62 0.82 0.82  !ambig!     nnoe183.793
    or (resid 38 and name HN) (resid 38 and name HB2)                 !!     nnoe183.793
assign (resid 43 and name HN) (resid 42 and name HB2) 3.06 1.26 1.26  !ambig!     nnoe183.130
    or (resid 43 and name HN) (resid 41 and name HB1)                 !!     nnoe183.130
assign (resid 18 and name HN) (resid 18 and name HD1#) 2.83 1.03 1.03  !ambig!     nnoe183.451
    or (resid 18 and name HN) (resid 18 and name HG2#)                 !!     nnoe183.451
assign (resid 38 and name HN) (resid 36 and name HB1) 3.42 1.62 1.62  !ambig!     nnoe183.797
    or (resid 38 and name HN) (resid 39 and name HB2)                 !!     nnoe183.797
assign (resid 38 and name HN) (resid 39 and name HA) 3.44 1.64 1.64  !ambig!     nnoe183.796
    or (resid 38 and name HN) (resid 39 and name HB1)                 !!     nnoe183.796
assign (resid 15 and name HN) (resid 16 and name HA) 3.22 1.42 1.42  !ambig!     nnoe183.459
    or (resid 15 and name HN) (resid 34 and name HD1)                 !!     nnoe183.459
assign (resid 36 and name HN) (resid 34 and name HG1) 3.55 1.75 1.75  !ambig!     nnoe183.142
    or (resid 36 and name HN) (resid 34 and name HG2)                 !!     nnoe183.142
assign (resid 39 and name HN) (resid 38 and name HB1) 3.28 1.48 1.48  !seq!     nnoe183.639
assign (resid 39 and name HN) (resid 38 and name HA) 2.83 1.03 1.03  !seq!     nnoe183.637
assign (resid 39 and name HN) (resid 36 and name HA) 3.34 1.54 1.54  !medium!     nnoe183.642
assign (resid 41 and name HN) (resid 41 and name HB1) 2.48 0.68 0.68  !intra!     nnoe183.555
assign (resid 42 and name HN) (resid 52 and name HB1) 3.34 1.54 1.54  !long!     nnoe183.556
assign (resid 49 and name HN) (resid 50 and name HA) 3.75 1.95 1.95  !seq!     nnoe183.557
assign (resid 30 and name HD21) (resid 26 and name HB) 3.44 1.64 1.64  !medium!     nnoe183.640
assign (resid 30 and name HD21) (resid 30 and name HN) 3.58 1.78 1.78  !intra!     nnoe183.633
assign (resid 42 and name HN) (resid 52 and name HB2) 3.66 1.86 1.86  !long!     nnoe183.558
assign (resid 42 and name HN) (resid 42 and name HA) 2.77 0.97 0.97  !intra!     nnoe183.539
assign (resid 41 and name HN) (resid 40 and name HA) 2.27 0.47 0.47  !seq!     nnoe183.541
assign (resid 21 and name HN) (resid 21 and name HA) 3.19 1.39 1.39  !intra!     nnoe183.598
assign (resid 30 and name HD21) (resid 30 and name HA) 3.72 1.92 1.92  !intra!     nnoe183.636
assign (resid 39 and name HN) (resid 40 and name HA) 3.80 2.00 2.00  !seq!     nnoe183.634
assign (resid 21 and name HN) (resid 20 and name HA1) 3.12 1.32 1.32  !seq!     nnoe183.599
assign (resid 39 and name HN) (resid 35 and name HA) 3.90 2.10 2.10  !medium!     nnoe183.644
assign (resid 30 and name HD22) (resid 33 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.662
!assign (resid 30 and name HD22) (resid 30 and name HD21) 2.22 0.42 0.42  !geminal!     nnoe183.663
assign (resid 30 and name HD22) (resid 29 and name HN) 3.90 2.10 2.10  !seq!     nnoe183.661
assign (resid 41 and name HN) (resid 41 and name HB2) 2.97 1.17 1.17  !intra!     nnoe183.552
assign (resid 30 and name HD22) (resid 32 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.660
assign (resid 30 and name HD22) (resid 26 and name HB) 3.79 1.99 1.99  !medium!     nnoe183.667
assign (resid 30 and name HD22) (resid 33 and name HB1) 3.90 2.10 2.10  !medium!     nnoe183.670
assign (resid 24 and name HN) (resid 24 and name HG2#) 3.09 1.29 1.29  !intra!     nnoe183.595
assign (resid 30 and name HD22) (resid 30 and name HN) 3.90 2.10 2.10  !intra!     nnoe183.664
assign (resid 30 and name HD22) (resid 30 and name HA) 3.90 2.10 2.10  !intra!     nnoe183.666
assign (resid 42 and name HN) (resid 52 and name HD22) 3.38 1.58 1.58  !long!     nnoe183.529
assign (resid 30 and name HD21) (resid 30 and name HB2) 2.76 0.96 0.96  !intra!     nnoe183.650
assign (resid 49 and name HN) (resid 48 and name HN) 3.33 1.53 1.53  !seq!     nnoe183.531
assign (resid 30 and name HD21) (resid 30 and name HB1) 3.22 1.42 1.42  !intra!     nnoe183.649
assign (resid 49 and name HN) (resid 49 and name HA2) 2.31 0.51 0.51  !intra!     nnoe183.554
assign (resid 39 and name HN) (resid 39 and name HB2) 2.73 0.93 0.93  !intra!     nnoe183.648
assign (resid 39 and name HN) (resid 37 and name HB1) 3.75 1.95 1.95  !medium!     nnoe183.653
assign (resid 42 and name HN) (resid 43 and name HN) 2.70 0.90 0.90  !seq!     nnoe183.530
assign (resid 42 and name HN) (resid 41 and name HA) 2.36 0.56 0.56  !seq!     nnoe183.545
assign (resid 39 and name HN) (resid 40 and name HB2) 3.73 1.93 1.93  !seq!     nnoe183.651
assign (resid 39 and name HN) (resid 37 and name HB2) 3.90 2.10 2.10  !medium!     nnoe183.652
assign (resid 42 and name HN) (resid 42 and name HB1) 2.76 0.96 0.96  !intra!     nnoe183.564
assign (resid 29 and name HN) (resid 51 and name HB1) 3.90 2.10 2.10  !long!     nnoe183.615
assign (resid 29 and name HN) (resid 51 and name HB2) 3.44 1.64 1.64  !long!     nnoe183.616
assign (resid 41 and name HN) (resid 43 and name HN) 3.75 1.95 1.95  !medium!     nnoe183.534
assign (resid 42 and name HN) (resid 41 and name HB2) 2.38 0.58 0.58  !seq!     nnoe183.550
assign (resid 24 and name HN) (resid 23 and name HA) 2.47 0.67 0.67  !seq!     nnoe183.585
assign (resid 49 and name HN) (resid 48 and name HA) 2.18 0.38 0.38  !seq!     nnoe183.547
assign (resid 29 and name HN) (resid 30 and name HN) 2.63 0.83 0.83  !seq!     nnoe183.604
assign (resid 19 and name HN) (resid 18 and name HN) 2.85 1.05 1.05  !seq!     nnoe183.583
assign (resid 19 and name HN) (resid 19 and name HA) 2.79 0.99 0.99  !intra!     nnoe183.584
assign (resid 29 and name HN) (resid 52 and name HA) 3.90 2.10 2.10  !long!     nnoe183.606
assign (resid 42 and name HN) (resid 52 and name HD21) 3.33 1.53 1.53  !long!     nnoe183.535
assign (resid 49 and name HN) (resid 50 and name HN) 2.50 0.70 0.70  !seq!     nnoe183.536
assign (resid 29 and name HN) (resid 26 and name HB) 3.47 1.67 1.67  !medium!     nnoe183.608
assign (resid 29 and name HN) (resid 26 and name HA) 3.27 1.47 1.47  !medium!     nnoe183.609
assign (resid 41 and name HN) (resid 41 and name HA) 2.61 0.81 0.81  !intra!     nnoe183.549
assign (resid 24 and name HN) (resid 24 and name HB) 3.13 1.33 1.33  !intra!     nnoe183.587
assign (resid 24 and name HN) (resid 23 and name HB1) 3.90 2.10 2.10  !seq!     nnoe183.591
assign (resid 24 and name HN) (resid 24 and name HA) 3.44 1.64 1.64  !intra!     nnoe183.586
assign (resid 24 and name HN) (resid 23 and name HB2) 3.90 2.10 2.10  !seq!     nnoe183.590
assign (resid 29 and name HN) (resid 29 and name HA) 2.57 0.77 0.77  !intra!     nnoe183.612
assign (resid 19 and name HN) (resid 17 and name HA2) 3.58 1.78 1.78  !medium!     nnoe183.589
assign (resid 30 and name HD21) (resid 29 and name HN) 3.77 1.97 1.97  !seq!     nnoe183.627
assign (resid 19 and name HN) (resid 18 and name HG12) 3.50 1.70 1.70  !seq!     nnoe183.593
assign (resid 41 and name HN) (resid 40 and name HB2) 3.04 1.24 1.24  !seq!     nnoe183.566
assign (resid 49 and name HN) (resid 48 and name HB) 3.05 1.25 1.25  !seq!     nnoe183.574
assign (resid 30 and name HD21) (resid 32 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.626
assign (resid 49 and name HN) (resid 50 and name HB1) 3.59 1.79 1.79  !seq!     nnoe183.565
!assign (resid 30 and name HD21) (resid 30 and name HD22) 2.19 0.39 0.39  !geminal!     nnoe183.631
assign (resid 41 and name HN) (resid 40 and name HN) 3.30 1.50 1.50  !seq!     nnoe183.533
assign (resid 39 and name HN) (resid 38 and name HN) 2.43 0.63 0.63  !seq!     nnoe183.630
assign (resid 41 and name HN) (resid 40 and name HD22) 3.90 2.10 2.10  !seq!     nnoe183.538
assign (resid 42 and name HN) (resid 43 and name HB#) 3.90 2.10 2.10  !seq!     nnoe183.577
assign (resid 29 and name HN) (resid 26 and name HG2#) 3.90 2.10 2.10  !medium!     nnoe183.619
assign (resid 21 and name HN) (resid 21 and name HB2) 3.29 1.49 1.49  !intra!     nnoe183.600
assign (resid 24 and name HN) (resid 25 and name HN) 3.52 1.72 1.72  !seq!     nnoe183.582
assign (resid 29 and name HN) (resid 30 and name HD21) 3.81 2.01 2.01  !seq!     nnoe183.602
assign (resid 29 and name HN) (resid 28 and name HN) 2.57 0.77 0.77  !seq!     nnoe183.601
assign (resid 49 and name HN) (resid 49 and name HA1) 2.40 0.60 0.60  !intra!     nnoe183.551
assign (resid 39 and name HN) (resid 40 and name HN) 2.51 0.71 0.71  !seq!     nnoe183.623
assign (resid 39 and name HN) (resid 37 and name HN) 3.44 1.64 1.64  !medium!     nnoe183.622
assign (resid 19 and name HN) (resid 18 and name HB) 2.96 1.16 1.16  !seq!     nnoe183.592
assign (resid 29 and name HN) (resid 29 and name HB2) 2.74 0.94 0.94  !intra!     nnoe183.620
assign (resid 17 and name HN) (resid 48 and name HB) 3.90 2.10 2.10  !long!     nnoe183.817
assign (resid 17 and name HN) (resid 18 and name HB) 3.85 2.05 2.05  !seq!     nnoe183.816
assign (resid 17 and name HN) (resid 27 and name HG2#) 3.00 1.20 1.20  !long!     nnoe183.819
assign (resid 17 and name HN) (resid 18 and name HG12) 3.90 2.10 2.10  !seq!     nnoe183.818
assign (resid 17 and name HN) (resid 47 and name HA) 3.68 1.88 1.88  !long!     nnoe183.808
assign (resid 17 and name HN) (resid 16 and name HN) 3.44 1.64 1.64  !seq!     nnoe183.807
assign (resid 17 and name HN) (resid 17 and name HA2) 2.34 0.54 0.54  !intra!     nnoe183.812
assign (resid 17 and name HN) (resid 17 and name HA1) 2.48 0.68 0.68  !intra!     nnoe183.809
assign (resid 26 and name HN) (resid 27 and name HB) 3.90 2.10 2.10  !seq!     nnoe183.829
assign (resid 26 and name HN) (resid 27 and name HA) 3.53 1.73 1.73  !seq!     nnoe183.828
assign (resid 26 and name HN) (resid 25 and name HG) 3.90 2.10 2.10  !seq!     nnoe183.834
assign (resid 26 and name HN) (resid 25 and name HB1) 3.31 1.51 1.51  !seq!     nnoe183.833
assign (resid 26 and name HN) (resid 25 and name HN) 3.05 1.25 1.25  !seq!     nnoe183.823
assign (resid 17 and name HN) (resid 18 and name HG11) 3.90 2.10 2.10  !seq!     nnoe183.820
assign (resid 26 and name HN) (resid 26 and name HA) 2.44 0.64 0.64  !intra!     nnoe183.827
assign (resid 26 and name HN) (resid 27 and name HN) 2.54 0.74 0.74  !seq!     nnoe183.824
assign (resid 17 and name HN) (resid 18 and name HN) 2.66 0.86 0.86  !seq!     nnoe183.806
assign (resid 38 and name HN) (resid 38 and name HA) 2.62 0.82 0.82  !intra!     nnoe183.790
assign (resid 38 and name HN) (resid 39 and name HN) 2.46 0.66 0.66  !seq!     nnoe183.787
assign (resid 38 and name HN) (resid 36 and name HA) 3.44 1.64 1.64  !medium!     nnoe183.792
assign (resid 38 and name HN) (resid 38 and name HB1) 2.93 1.13 1.13  !intra!     nnoe183.791
assign (resid 20 and name HN) (resid 20 and name HA2) 2.76 0.96 0.96  !intra!     nnoe183.782
assign (resid 20 and name HN) (resid 20 and name HA1) 2.89 1.09 1.09  !intra!     nnoe183.781
assign (resid 38 and name HN) (resid 40 and name HN) 3.01 1.21 1.21  !medium!     nnoe183.785
assign (resid 38 and name HN) (resid 37 and name HN) 2.62 0.82 0.82  !seq!     nnoe183.783
assign (resid 38 and name HN) (resid 37 and name HG1) 3.71 1.91 1.91  !seq!     nnoe183.803
assign (resid 38 and name HN) (resid 37 and name HG2) 3.64 1.84 1.84  !seq!     nnoe183.802
assign (resid 17 and name HN) (resid 48 and name HN) 3.90 2.10 2.10  !long!     nnoe183.805
assign (resid 17 and name HN) (resid 19 and name HN) 3.83 2.03 2.03  !medium!     nnoe183.804
assign (resid 38 and name HN) (resid 40 and name HB2) 3.82 2.02 2.02  !medium!     nnoe183.799
assign (resid 38 and name HN) (resid 35 and name HA) 3.22 1.42 1.42  !medium!     nnoe183.794
assign (resid 38 and name HN) (resid 37 and name HB1) 2.71 0.91 0.91  !seq!     nnoe183.801
assign (resid 38 and name HN) (resid 37 and name HB2) 2.96 1.16 1.16  !seq!     nnoe183.800
assign (resid 27 and name HN) (resid 26 and name HB) 3.29 1.49 1.49  !seq!     nnoe183.870
assign (resid 25 and name HN) (resid 25 and name HD2#) 3.34 1.54 1.54  !intra!     nnoe183.869
assign (resid 50 and name HN) (resid 49 and name HA2) 2.70 0.90 0.90  !seq!     nnoe183.872
assign (resid 45 and name HN) (resid 42 and name HB1) 3.45 1.65 1.65  !medium!     nnoe183.871
assign (resid 52 and name HD21) (resid 42 and name HA) 3.90 2.10 2.10  !long!     nnoe183.862
assign (resid 52 and name HD22) (resid 42 and name HA) 3.90 2.10 2.10  !long!     nnoe183.861
assign (resid 36 and name HN) (resid 35 and name HB1) 2.50 0.70 0.70  !seq!     nnoe183.867
assign (resid 54 and name HN) (resid 54 and name HB1) 2.82 1.02 1.02  !intra!     nnoe183.865
assign (resid 48 and name HN) (resid 18 and name HG11) 3.90 2.10 2.10  !long!     nnoe183.887
assign (resid 32 and name HN) (resid 32 and name HG1) 2.96 1.16 1.16  !intra!     nnoe183.886
assign (resid 50 and name HN) (resid 52 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.889
assign (resid 30 and name HD22) (resid 32 and name HB2) 3.87 2.07 2.07  !medium!     nnoe183.888
assign (resid 56 and name HN) (resid 56 and name HB2) 2.91 1.11 1.11  !intra!     nnoe183.875
assign (resid 55 and name HN) (resid 54 and name HB2) 3.10 1.30 1.30  !seq!     nnoe183.874
assign (resid 35 and name HN) (resid 14 and name HB2) 3.36 1.56 1.56  !long!     nnoe183.880
assign (resid 54 and name HN) (resid 53 and name HD2) 2.67 0.87 0.87  !seq!     nnoe183.876
assign (resid 52 and name HD21) (resid 54 and name HD2) 3.90 2.10 2.10  !medium!     nnoe183.860
assign (resid 30 and name HN) (resid 36 and name HB2) 3.67 1.87 1.87  !long!     nnoe183.846
assign (resid 41 and name HN) (resid 40 and name HD21) 3.90 2.10 2.10  !seq!     nnoe183.844
assign (resid 59 and name HN) (resid 59 and name HA) 2.81 1.01 1.01  !intra!     nnoe183.848
assign (resid 59 and name HN) (resid 58 and name HA) 2.30 0.50 0.50  !seq!     nnoe183.847
assign (resid 26 and name HN) (resid 26 and name HG2#) 2.88 1.08 1.08  !intra!     nnoe183.838
assign (resid 26 and name HN) (resid 25 and name HB2) 3.31 1.51 1.51  !seq!     nnoe183.835
assign (resid 33 and name HN) (resid 36 and name HB2) 3.90 2.10 2.10  !medium!     nnoe183.842
assign (resid 55 and name HN) (resid 54 and name HB1) 2.97 1.17 1.17  !seq!     nnoe183.841
assign (resid 14 and name HN) (resid 14 and name HA) 2.70 0.90 0.90  !intra!     nnoe183.855
assign (resid 35 and name HN) (resid 35 and name HB1) 2.86 1.06 1.06  !intra!     nnoe183.854
assign (resid 52 and name HD22) (resid 52 and name HN) 3.90 2.10 2.10  !intra!     nnoe183.857
assign (resid 16 and name HN) (resid 14 and name HB1) 3.38 1.58 1.58  !medium!     nnoe183.856
assign (resid 59 and name HN) (resid 58 and name HB2) 3.38 1.58 1.58  !seq!     nnoe183.850
assign (resid 59 and name HN) (resid 58 and name HB1) 3.40 1.60 1.60  !seq!     nnoe183.849
assign (resid 59 and name HN) (resid 58 and name HN) 3.10 1.30 1.30  !seq!     nnoe183.853
assign (resid 59 and name HN) (resid 59 and name HB) 2.95 1.15 1.15  !intra!     nnoe183.851
assign (resid 20 and name HN) (resid 19 and name HA) 2.81 1.01 1.01  !seq!     nnoe183.780
assign (resid 40 and name HD21) (resid 40 and name HB1) 3.05 1.25 1.25  !intra!     nnoe183.698
assign (resid 40 and name HD21) (resid 12 and name HD2) 3.38 1.58 1.58  !long!     nnoe183.697
assign (resid 40 and name HD21) (resid 12 and name HB1) 3.90 2.10 2.10  !long!     nnoe183.700
assign (resid 40 and name HD21) (resid 40 and name HB2) 2.86 1.06 1.06  !intra!     nnoe183.699
assign (resid 40 and name HD21) (resid 38 and name HB1) 3.47 1.67 1.67  !medium!     nnoe183.693
assign (resid 40 and name HD21) (resid 11 and name HA) 3.88 2.08 2.08  !long!     nnoe183.692
assign (resid 40 and name HD21) (resid 35 and name HA) 3.87 2.07 2.07  !long!     nnoe183.696
assign (resid 40 and name HD21) (resid 38 and name HA) 3.90 2.10 2.10  !medium!     nnoe183.694
assign (resid 40 and name HD22) (resid 12 and name HD1) 3.29 1.49 1.49  !long!     nnoe183.708
assign (resid 40 and name HD22) (resid 38 and name HB1) 3.40 1.60 1.60  !medium!     nnoe183.707
assign (resid 40 and name HD22) (resid 12 and name HD2) 3.46 1.66 1.66  !long!     nnoe183.710
assign (resid 40 and name HD22) (resid 35 and name HA) 3.90 2.10 2.10  !long!     nnoe183.709
!assign (resid 40 and name HD22) (resid 40 and name HD21) 2.23 0.43 0.43  !geminal!     nnoe183.704
assign (resid 40 and name HD22) (resid 40 and name HN) 3.86 2.06 2.06  !intra!     nnoe183.703
assign (resid 40 and name HD22) (resid 11 and name HA) 3.90 2.10 2.10  !long!     nnoe183.706
assign (resid 40 and name HD22) (resid 40 and name HA) 3.90 2.10 2.10  !intra!     nnoe183.705
assign (resid 40 and name HD21) (resid 40 and name HA) 3.72 1.92 1.92  !intra!     nnoe183.691
assign (resid 44 and name HN) (resid 45 and name HN) 2.77 0.97 0.97  !seq!     nnoe183.676
assign (resid 44 and name HN) (resid 43 and name HN) 3.53 1.73 1.73  !seq!     nnoe183.675
assign (resid 44 and name HN) (resid 43 and name HA) 2.27 0.47 0.47  !seq!     nnoe183.680
assign (resid 31 and name HN) (resid 30 and name HA) 3.30 1.50 1.50  !seq!     nnoe183.678
assign (resid 30 and name HD22) (resid 30 and name HB2) 3.10 1.30 1.30  !intra!     nnoe183.672
assign (resid 30 and name HD22) (resid 30 and name HB1) 3.33 1.53 1.53  !intra!     nnoe183.671
assign (resid 31 and name HN) (resid 32 and name HN) 3.90 2.10 2.10  !seq!     nnoe183.674
assign (resid 30 and name HD22) (resid 32 and name HB1) 3.90 2.10 2.10  !medium!     nnoe183.673
assign (resid 44 and name HN) (resid 43 and name HB#) 2.71 0.91 0.91  !seq!     nnoe183.688
assign (resid 31 and name HN) (resid 30 and name HB2) 3.49 1.69 1.69  !seq!     nnoe183.686
!assign (resid 40 and name HD21) (resid 40 and name HD22) 2.24 0.44 0.44  !geminal!     nnoe183.690
assign (resid 40 and name HD21) (resid 40 and name HN) 3.44 1.64 1.64  !intra!     nnoe183.689
assign (resid 44 and name HN) (resid 44 and name HA2) 2.46 0.66 0.66  !intra!     nnoe183.682
assign (resid 44 and name HN) (resid 44 and name HA1) 2.48 0.68 0.68  !intra!     nnoe183.681
assign (resid 31 and name HN) (resid 30 and name HB1) 3.37 1.57 1.57  !seq!     nnoe183.685
assign (resid 44 and name HN) (resid 45 and name HB2) 3.87 2.07 2.07  !seq!     nnoe183.684
assign (resid 52 and name HD21) (resid 52 and name HA) 3.90 2.10 2.10  !intra!     nnoe183.760
assign (resid 23 and name HD21) (resid 23 and name HA) 3.24 1.44 1.44  !intra!     nnoe183.759
assign (resid 52 and name HD21) (resid 36 and name HA) 3.61 1.81 1.81  !long!     nnoe183.762
assign (resid 52 and name HD21) (resid 41 and name HA) 3.38 1.58 1.58  !long!     nnoe183.761
assign (resid 52 and name HD22) (resid 35 and name HB1) 3.15 1.35 1.35  !long!     nnoe183.753
assign (resid 52 and name HD22) (resid 52 and name HB2) 3.16 1.36 1.36  !intra!     nnoe183.751
!assign (resid 52 and name HD21) (resid 52 and name HD22) 2.44 0.64 0.64  !geminal!     nnoe183.757
assign (resid 52 and name HD21) (resid 52 and name HN) 3.76 1.96 1.96  !intra!     nnoe183.754
assign (resid 23 and name HD22) (resid 23 and name HB1) 3.34 1.54 1.54  !intra!     nnoe183.773
assign (resid 23 and name HD22) (resid 23 and name HA) 3.47 1.67 1.67  !intra!     nnoe183.772
assign (resid 20 and name HN) (resid 19 and name HN) 3.90 2.10 2.10  !seq!     nnoe183.778
assign (resid 23 and name HD22) (resid 23 and name HB2) 3.27 1.47 1.47  !intra!     nnoe183.774
assign (resid 23 and name HD21) (resid 23 and name HB2) 2.96 1.16 1.16  !intra!     nnoe183.766
assign (resid 23 and name HD21) (resid 23 and name HB1) 3.01 1.21 1.21  !intra!     nnoe183.765
assign (resid 52 and name HD21) (resid 35 and name HB1) 3.34 1.54 1.54  !long!     nnoe183.769
assign (resid 52 and name HD21) (resid 52 and name HB2) 2.89 1.09 1.09  !intra!     nnoe183.767
assign (resid 52 and name HD22) (resid 36 and name HA) 3.38 1.58 1.58  !long!     nnoe183.748
assign (resid 30 and name HN) (resid 33 and name HN) 3.28 1.48 1.48  !medium!     nnoe183.721
assign (resid 30 and name HN) (resid 29 and name HN) 2.59 0.79 0.79  !seq!     nnoe183.720
assign (resid 30 and name HN) (resid 30 and name HA) 2.62 0.82 0.82  !intra!     nnoe183.726
assign (resid 30 and name HN) (resid 30 and name HD21) 3.36 1.56 1.56  !intra!     nnoe183.722
assign (resid 40 and name HD22) (resid 40 and name HB2) 3.03 1.23 1.23  !intra!     nnoe183.712
assign (resid 40 and name HD22) (resid 40 and name HB1) 3.33 1.53 1.53  !intra!     nnoe183.711
assign (resid 30 and name HN) (resid 32 and name HN) 3.43 1.63 1.63  !medium!     nnoe183.719
assign (resid 30 and name HN) (resid 28 and name HN) 3.46 1.66 1.66  !medium!     nnoe183.716
!assign (resid 52 and name HD22) (resid 52 and name HD21) 2.41 0.61 0.61  !geminal!     nnoe183.745
assign (resid 30 and name HN) (resid 29 and name HB2) 3.53 1.73 1.73  !seq!     nnoe183.742
assign (resid 52 and name HD22) (resid 41 and name HA) 2.98 1.18 1.18  !long!     nnoe183.747
assign (resid 52 and name HD22) (resid 54 and name HD2) 3.90 2.10 2.10  !medium!     nnoe183.746
assign (resid 30 and name HN) (resid 29 and name HA) 2.51 0.71 0.71  !seq!     nnoe183.734
assign (resid 30 and name HN) (resid 31 and name HA) 3.60 1.80 1.80  !seq!     nnoe183.730
assign (resid 30 and name HN) (resid 29 and name HG2) 3.69 1.89 1.89  !seq!     nnoe183.738
assign (resid 30 and name HN) (resid 30 and name HB1) 3.00 1.20 1.20  !intra!     nnoe183.735
assign (resid 16 and name HN) (resid 14 and name HA) 3.33 1.53 1.53  !medium!     nnoe183.178
assign (resid 16 and name HN) (resid 15 and name HN) 2.45 0.65 0.65  !seq!     nnoe183.175
assign (resid 16 and name HN) (resid 17 and name HA1) 3.90 2.10 2.10  !seq!     nnoe183.181
assign (resid 16 and name HN) (resid 47 and name HA) 3.00 1.20 1.20  !long!     nnoe183.179
assign (resid 33 and name HN) (resid 32 and name HB2) 2.93 1.13 1.13  !seq!     nnoe183.165
assign (resid 33 and name HN) (resid 33 and name HB1) 2.43 0.63 0.63  !intra!     nnoe183.162
assign (resid 16 and name HN) (resid 14 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.174
assign (resid 33 and name HN) (resid 30 and name HD21) 3.90 2.10 2.10  !medium!     nnoe183.172
assign (resid 16 and name HN) (resid 15 and name HB2) 3.23 1.43 1.43  !seq!     nnoe183.191
assign (resid 16 and name HN) (resid 15 and name HB1) 3.41 1.61 1.61  !seq!     nnoe183.190
assign (resid 28 and name HN) (resid 29 and name HN) 2.60 0.80 0.80  !seq!     nnoe183.196
assign (resid 16 and name HN) (resid 27 and name HG2#) 3.53 1.73 1.73  !long!     nnoe183.192
assign (resid 16 and name HN) (resid 16 and name HA) 2.47 0.67 0.67  !intra!     nnoe183.183
assign (resid 16 and name HN) (resid 15 and name HA) 2.57 0.77 0.77  !seq!     nnoe183.182
assign (resid 16 and name HN) (resid 47 and name HB2) 2.83 1.03 1.03  !long!     nnoe183.188
assign (resid 16 and name HN) (resid 14 and name HB2) 2.67 0.87 0.87  !medium!     nnoe183.184
assign (resid 33 and name HN) (resid 33 and name HA) 2.69 0.89 0.89  !intra!     nnoe183.157
assign (resid 36 and name HN) (resid 35 and name HA) 2.84 1.04 1.04  !seq!     nnoe183.132
assign (resid 36 and name HN) (resid 36 and name HA) 2.56 0.76 0.76  !intra!     nnoe183.129
assign (resid 36 and name HN) (resid 36 and name HB2) 2.49 0.69 0.69  !intra!     nnoe183.134
assign (resid 43 and name HN) (resid 45 and name HB2) 3.90 2.10 2.10  !medium!     nnoe183.133
assign (resid 36 and name HN) (resid 33 and name HA) 3.74 1.94 1.94  !medium!     nnoe183.124
assign (resid 43 and name HN) (resid 42 and name HA) 2.66 0.86 0.86  !seq!     nnoe183.121
assign (resid 43 and name HN) (resid 43 and name HA) 2.57 0.77 0.77  !intra!     nnoe183.126
assign (resid 43 and name HN) (resid 41 and name HA) 3.25 1.45 1.45  !medium!     nnoe183.125
assign (resid 33 and name HN) (resid 35 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.153
assign (resid 33 and name HN) (resid 37 and name HN) 3.44 1.64 1.64  !medium!     nnoe183.152
assign (resid 33 and name HN) (resid 30 and name HN) 3.22 1.42 1.42  !medium!     nnoe183.156
assign (resid 33 and name HN) (resid 32 and name HN) 2.34 0.54 0.54  !seq!     nnoe183.154
assign (resid 43 and name HN) (resid 42 and name HB1) 3.17 1.37 1.37  !seq!     nnoe183.139
assign (resid 36 and name HN) (resid 33 and name HB1) 2.90 1.10 1.10  !medium!     nnoe183.135
assign (resid 43 and name HN) (resid 43 and name HB#) 2.44 0.64 0.64  !intra!     nnoe183.151
assign (resid 36 and name HN) (resid 37 and name HB1) 3.90 2.10 2.10  !seq!     nnoe183.148
assign (resid 28 and name HN) (resid 27 and name HN) 3.31 1.51 1.51  !seq!     nnoe183.199
assign (resid 58 and name HN) (resid 59 and name HN) 3.13 1.33 1.33  !seq!     nnoe183.259
assign (resid 25 and name HN) (resid 27 and name HN) 3.57 1.77 1.77  !medium!     nnoe183.258
assign (resid 54 and name HN) (resid 54 and name HA) 2.45 0.65 0.65  !intra!     nnoe183.264
assign (resid 54 and name HN) (resid 54 and name HD2) 3.00 1.20 1.20  !intra!     nnoe183.260
assign (resid 56 and name HN) (resid 55 and name HB1) 3.21 1.41 1.41  !seq!     nnoe183.249
assign (resid 57 and name HN) (resid 56 and name HB1) 3.22 1.42 1.42  !seq!     nnoe183.246
assign (resid 25 and name HN) (resid 26 and name HN) 2.66 0.86 0.86  !seq!     nnoe183.257
assign (resid 54 and name HN) (resid 55 and name HN) 3.58 1.78 1.78  !seq!     nnoe183.254
assign (resid 54 and name HN) (resid 54 and name HB2) 2.70 0.90 0.90  !intra!     nnoe183.278
assign (resid 54 and name HN) (resid 52 and name HB1) 3.56 1.76 1.76  !medium!     nnoe183.276
assign (resid 58 and name HN) (resid 58 and name HB2) 2.76 0.96 0.96  !intra!     nnoe183.280
assign (resid 58 and name HN) (resid 58 and name HB1) 2.67 0.87 0.87  !intra!     nnoe183.279
assign (resid 58 and name HN) (resid 57 and name HA) 2.51 0.71 0.71  !seq!     nnoe183.267
assign (resid 54 and name HN) (resid 52 and name HA) 3.16 1.36 1.36  !medium!     nnoe183.265
assign (resid 54 and name HN) (resid 53 and name HD1) 2.97 1.17 1.17  !seq!     nnoe183.274
assign (resid 58 and name HN) (resid 58 and name HA) 2.74 0.94 0.94  !intra!     nnoe183.268
assign (resid 57 and name HN) (resid 56 and name HB2) 3.19 1.39 1.39  !seq!     nnoe183.245
assign (resid 57 and name HN) (resid 58 and name HN) 3.43 1.63 1.63  !seq!     nnoe183.220
assign (resid 28 and name HN) (resid 29 and name HB2) 3.90 2.10 2.10  !seq!     nnoe183.214
assign (resid 23 and name HN) (resid 23 and name HA) 2.83 1.03 1.03  !intra!     nnoe183.226
assign (resid 57 and name HN) (resid 57 and name HA) 2.61 0.81 0.81  !intra!     nnoe183.223
assign (resid 28 and name HN) (resid 26 and name HA) 3.62 1.82 1.82  !medium!     nnoe183.204
assign (resid 28 and name HN) (resid 30 and name HN) 3.63 1.83 1.83  !medium!     nnoe183.201
assign (resid 28 and name HN) (resid 51 and name HB2) 3.90 2.10 2.10  !long!     nnoe183.211
assign (resid 28 and name HN) (resid 50 and name HA) 2.84 1.04 1.04  !long!     nnoe183.209
assign (resid 23 and name HN) (resid 23 and name HB2) 3.71 1.91 1.91  !intra!     nnoe183.240
assign (resid 23 and name HN) (resid 23 and name HB1) 3.62 1.82 1.82  !intra!     nnoe183.239
assign (resid 57 and name HN) (resid 57 and name HB2) 2.60 0.80 0.80  !intra!     nnoe183.242
assign (resid 57 and name HN) (resid 57 and name HB1) 2.81 1.01 1.01  !intra!     nnoe183.241
assign (resid 56 and name HN) (resid 55 and name HA) 2.36 0.56 0.56  !seq!     nnoe183.229
assign (resid 57 and name HN) (resid 56 and name HA) 2.23 0.43 0.43  !seq!     nnoe183.228
assign (resid 23 and name HN) (resid 22 and name HA) 3.11 1.31 1.31  !seq!     nnoe183.231
assign (resid 56 and name HN) (resid 56 and name HA) 2.60 0.80 0.80  !intra!     nnoe183.230
assign (resid 51 and name HN) (resid 51 and name HB2) 2.54 0.74 0.74  !intra!     nnoe183.37
assign (resid 51 and name HN) (resid 51 and name HB1) 2.84 1.04 1.04  !intra!     nnoe183.36
assign (resid 14 and name HN) (resid 15 and name HN) 3.49 1.69 1.69  !seq!     nnoe183.42
assign (resid 51 and name HN) (resid 29 and name HB2) 3.68 1.88 1.88  !long!     nnoe183.41
assign (resid 51 and name HN) (resid 51 and name HA) 2.66 0.86 0.86  !intra!     nnoe183.28
assign (resid 51 and name HN) (resid 52 and name HA) 3.62 1.82 1.82  !seq!     nnoe183.27
assign (resid 51 and name HN) (resid 50 and name HB1) 3.20 1.40 1.40  !seq!     nnoe183.35
assign (resid 51 and name HN) (resid 50 and name HA) 2.22 0.42 0.42  !seq!     nnoe183.33
assign (resid 14 and name HN) (resid 45 and name HA) 2.86 1.06 1.06  !long!     nnoe183.52
assign (resid 14 and name HN) (resid 13 and name HA) 2.16 0.36 0.36  !seq!     nnoe183.48
assign (resid 14 and name HN) (resid 45 and name HB1) 2.62 0.82 0.82  !long!     nnoe183.54
assign (resid 14 and name HN) (resid 14 and name HB2) 2.91 1.11 1.11  !intra!     nnoe183.53
assign (resid 14 and name HN) (resid 46 and name HN) 3.30 1.50 1.50  !long!     nnoe183.44
assign (resid 14 and name HN) (resid 35 and name HN) 3.90 2.10 2.10  !long!     nnoe183.43
assign (resid 14 and name HN) (resid 45 and name HN) 3.80 2.00 2.00  !long!     nnoe183.46
assign (resid 14 and name HN) (resid 13 and name HN) 3.34 1.54 1.54  !seq!     nnoe183.45
assign (resid 51 and name HN) (resid 27 and name HN) 3.71 1.91 1.91  !long!     nnoe183.26
assign (resid 35 and name HN) (resid 34 and name HD1) 2.99 1.19 1.19  !seq!     nnoe183.11
assign (resid 35 and name HN) (resid 33 and name HA) 3.08 1.28 1.28  !medium!     nnoe183.9
assign (resid 35 and name HN) (resid 14 and name HB1) 2.88 1.08 1.08  !long!     nnoe183.13
assign (resid 35 and name HN) (resid 35 and name HA) 2.59 0.79 0.79  !intra!     nnoe183.12
assign (resid 35 and name HN) (resid 36 and name HN) 2.48 0.68 0.68  !seq!     nnoe183.2
assign (resid 35 and name HN) (resid 14 and name HN) 3.90 2.10 2.10  !long!     nnoe183.0
assign (resid 35 and name HN) (resid 14 and name HA) 3.88 2.08 2.08  !long!     nnoe183.7
assign (resid 35 and name HN) (resid 38 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.6
assign (resid 51 and name HN) (resid 28 and name HN) 3.90 2.10 2.10  !long!     nnoe183.23
assign (resid 35 and name HN) (resid 34 and name HB1) 3.15 1.35 1.35  !seq!     nnoe183.18
assign (resid 51 and name HN) (resid 50 and name HN) 3.30 1.50 1.50  !seq!     nnoe183.25
assign (resid 51 and name HN) (resid 52 and name HN) 3.23 1.43 1.43  !seq!     nnoe183.24
assign (resid 35 and name HN) (resid 33 and name HB1) 3.39 1.59 1.59  !medium!     nnoe183.15
assign (resid 35 and name HN) (resid 36 and name HB2) 3.73 1.93 1.93  !seq!     nnoe183.14
assign (resid 35 and name HN) (resid 40 and name HB2) 3.69 1.89 1.89  !long!     nnoe183.17
assign (resid 35 and name HN) (resid 35 and name HB2) 2.61 0.81 0.81  !intra!     nnoe183.16
assign (resid 14 and name HN) (resid 14 and name HB1) 2.70 0.90 0.90  !intra!     nnoe183.55
assign (resid 55 and name HN) (resid 55 and name HB2) 2.88 1.08 1.08  !intra!     nnoe183.106
assign (resid 11 and name HN) (resid 10 and name HB2) 2.91 1.11 1.11  !seq!     nnoe183.102
assign (resid 11 and name HN) (resid 11 and name HG1) 2.90 1.10 1.10  !intra!     nnoe183.109
assign (resid 11 and name HN) (resid 11 and name HG2) 2.84 1.04 1.04  !intra!     nnoe183.108
assign (resid 11 and name HN) (resid 11 and name HA) 2.70 0.90 0.90  !intra!     nnoe183.93
assign (resid 55 and name HN) (resid 54 and name HD2) 3.90 2.10 2.10  !seq!     nnoe183.91
assign (resid 11 and name HN) (resid 12 and name HD2) 3.78 1.98 1.98  !seq!     nnoe183.99
assign (resid 11 and name HN) (resid 10 and name HA) 2.21 0.41 0.41  !seq!     nnoe183.95
assign (resid 43 and name HN) (resid 45 and name HN) 3.47 1.67 1.67  !medium!     nnoe183.116
assign (resid 36 and name HN) (resid 35 and name HN) 2.57 0.77 0.77  !seq!     nnoe183.115
assign (resid 36 and name HN) (resid 38 and name HN) 3.32 1.52 1.52  !medium!     nnoe183.119
assign (resid 36 and name HN) (resid 39 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.118
assign (resid 43 and name HN) (resid 44 and name HN) 3.42 1.62 1.62  !seq!     nnoe183.112
assign (resid 55 and name HN) (resid 55 and name HB1) 3.03 1.23 1.23  !intra!     nnoe183.110
assign (resid 36 and name HN) (resid 37 and name HN) 2.84 1.04 1.04  !seq!     nnoe183.114
assign (resid 43 and name HN) (resid 42 and name HN) 2.63 0.83 0.83  !seq!     nnoe183.113
assign (resid 55 and name HN) (resid 54 and name HN) 3.55 1.75 1.75  !seq!     nnoe183.89
assign (resid 52 and name HN) (resid 52 and name HD21) 3.53 1.73 1.73  !intra!     nnoe183.70
assign (resid 52 and name HN) (resid 51 and name HN) 3.18 1.38 1.38  !seq!     nnoe183.69
assign (resid 52 and name HN) (resid 52 and name HA) 2.71 0.91 0.91  !intra!     nnoe183.72
assign (resid 52 and name HN) (resid 50 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.71
assign (resid 14 and name HN) (resid 13 and name HG1) 3.64 1.84 1.84  !seq!     nnoe183.64
assign (resid 14 and name HN) (resid 45 and name HB2) 3.06 1.26 1.26  !long!     nnoe183.56
assign (resid 52 and name HN) (resid 52 and name HD22) 3.90 2.10 2.10  !intra!     nnoe183.67
assign (resid 14 and name HN) (resid 13 and name HG2) 3.63 1.83 1.83  !seq!     nnoe183.65
assign (resid 52 and name HN) (resid 52 and name HB2) 2.42 0.62 0.62  !intra!     nnoe183.79
assign (resid 52 and name HN) (resid 52 and name HB1) 2.48 0.68 0.68  !intra!     nnoe183.78
assign (resid 52 and name HN) (resid 51 and name HB2) 3.34 1.54 1.54  !seq!     nnoe183.83
assign (resid 52 and name HN) (resid 51 and name HB1) 3.27 1.47 1.47  !seq!     nnoe183.82
assign (resid 52 and name HN) (resid 53 and name HA) 3.86 2.06 2.06  !seq!     nnoe183.74
assign (resid 52 and name HN) (resid 51 and name HA) 2.74 0.94 0.94  !seq!     nnoe183.73
assign (resid 52 and name HN) (resid 53 and name HD1) 3.10 1.30 1.30  !seq!     nnoe183.76
assign (resid 52 and name HN) (resid 53 and name HD2) 3.79 1.99 1.99  !seq!     nnoe183.75
assign (resid 18 and name HN) (resid 18 and name HG12) 2.58 0.78 0.78  !intra!     nnoe183.447
assign (resid 18 and name HN) (resid 48 and name HB) 3.54 1.74 1.74  !long!     nnoe183.446
assign (resid 15 and name HN) (resid 14 and name HN) 3.54 1.74 1.74  !seq!     nnoe183.453
assign (resid 18 and name HN) (resid 18 and name HG11) 2.58 0.78 0.78  !intra!     nnoe183.449
assign (resid 47 and name HN) (resid 45 and name HA) 3.17 1.37 1.37  !medium!     nnoe183.433
assign (resid 18 and name HN) (resid 18 and name HA) 2.44 0.64 0.64  !intra!     nnoe183.432
assign (resid 18 and name HN) (resid 18 and name HB) 2.34 0.54 0.54  !intra!     nnoe183.444
assign (resid 18 and name HN) (resid 17 and name HA2) 2.77 0.97 0.97  !seq!     nnoe183.434
assign (resid 15 and name HN) (resid 14 and name HB1) 2.89 1.09 1.09  !seq!     nnoe183.461
assign (resid 15 and name HN) (resid 14 and name HB2) 2.57 0.77 0.77  !seq!     nnoe183.460
assign (resid 40 and name HN) (resid 41 and name HN) 3.45 1.65 1.65  !seq!     nnoe183.469
assign (resid 15 and name HN) (resid 15 and name HB1) 3.04 1.24 1.24  !intra!     nnoe183.466
assign (resid 15 and name HN) (resid 14 and name HA) 2.41 0.61 0.61  !seq!     nnoe183.455
assign (resid 15 and name HN) (resid 16 and name HN) 2.59 0.79 0.79  !seq!     nnoe183.454
assign (resid 15 and name HN) (resid 34 and name HD2) 3.78 1.98 1.98  !long!     nnoe183.458
assign (resid 15 and name HN) (resid 15 and name HA) 2.87 1.07 1.07  !intra!     nnoe183.457
assign (resid 47 and name HN) (resid 48 and name HA) 3.90 2.10 2.10  !seq!     nnoe183.431
assign (resid 48 and name HN) (resid 27 and name HG2#) 3.26 1.46 1.46  !long!     nnoe183.413
assign (resid 13 and name HN) (resid 13 and name HG1) 3.02 1.22 1.22  !intra!     nnoe183.411
assign (resid 47 and name HN) (resid 14 and name HN) 3.90 2.10 2.10  !long!     nnoe183.417
assign (resid 13 and name HN) (resid 13 and name HG2) 3.07 1.27 1.27  !intra!     nnoe183.414
assign (resid 32 and name HN) (resid 32 and name HG2) 2.82 1.02 1.02  !intra!     nnoe183.405
assign (resid 13 and name HN) (resid 12 and name HB1) 2.59 0.79 0.79  !seq!     nnoe183.403
assign (resid 48 and name HN) (resid 18 and name HG12) 3.54 1.74 1.74  !long!     nnoe183.409
assign (resid 48 and name HN) (resid 48 and name HB) 2.43 0.63 0.63  !intra!     nnoe183.408
assign (resid 18 and name HN) (resid 47 and name HA) 3.49 1.69 1.69  !long!     nnoe183.426
assign (resid 47 and name HN) (resid 47 and name HA) 2.81 1.01 1.01  !intra!     nnoe183.425
assign (resid 47 and name HN) (resid 15 and name HA) 2.93 1.13 1.13  !long!     nnoe183.430
assign (resid 18 and name HN) (resid 17 and name HA1) 2.69 0.89 0.89  !seq!     nnoe183.427
assign (resid 18 and name HN) (resid 19 and name HN) 2.89 1.09 1.09  !seq!     nnoe183.420
assign (resid 18 and name HN) (resid 17 and name HN) 2.63 0.83 0.83  !seq!     nnoe183.418
assign (resid 47 and name HN) (resid 46 and name HA) 2.57 0.77 0.77  !seq!     nnoe183.424
assign (resid 18 and name HN) (resid 48 and name HN) 3.39 1.59 1.59  !long!     nnoe183.421
assign (resid 37 and name HN) (resid 36 and name HN) 2.71 0.91 0.91  !seq!     nnoe183.471
assign (resid 46 and name HN) (resid 45 and name HN) 3.35 1.55 1.55  !seq!     nnoe183.507
assign (resid 37 and name HN) (resid 37 and name HG1) 3.25 1.45 1.45  !intra!     nnoe183.506
assign (resid 46 and name HN) (resid 46 and name HA) 2.76 0.96 0.96  !intra!     nnoe183.510
assign (resid 46 and name HN) (resid 47 and name HN) 2.50 0.70 0.70  !seq!     nnoe183.508
assign (resid 37 and name HN) (resid 37 and name HB2) 2.39 0.59 0.59  !intra!     nnoe183.503
assign (resid 40 and name HN) (resid 40 and name HB2) 2.49 0.69 0.69  !intra!     nnoe183.500
assign (resid 37 and name HN) (resid 37 and name HG2) 3.21 1.41 1.41  !intra!     nnoe183.505
assign (resid 37 and name HN) (resid 37 and name HB1) 2.49 0.69 0.69  !intra!     nnoe183.504
assign (resid 46 and name HN) (resid 46 and name HB2) 2.55 0.75 0.75  !intra!     nnoe183.520
assign (resid 46 and name HN) (resid 45 and name HB2) 2.78 0.98 0.98  !seq!     nnoe183.518
assign (resid 46 and name HN) (resid 15 and name HB1) 3.90 2.10 2.10  !long!     nnoe183.522
assign (resid 40 and name HN) (resid 35 and name HB1) 3.78 1.98 1.98  !long!     nnoe183.521
assign (resid 40 and name HN) (resid 38 and name HB1) 3.55 1.75 1.75  !medium!     nnoe183.514
assign (resid 40 and name HN) (resid 41 and name HA) 3.90 2.10 2.10  !seq!     nnoe183.513
assign (resid 40 and name HN) (resid 35 and name HA) 3.49 1.69 1.69  !long!     nnoe183.517
assign (resid 46 and name HN) (resid 45 and name HA) 2.34 0.54 0.54  !seq!     nnoe183.515
assign (resid 37 and name HN) (resid 33 and name HB1) 3.21 1.41 1.41  !medium!     nnoe183.493
assign (resid 40 and name HN) (resid 38 and name HN) 3.08 1.28 1.28  !medium!     nnoe183.478
assign (resid 37 and name HN) (resid 38 and name HN) 2.64 0.84 0.84  !seq!     nnoe183.477
assign (resid 40 and name HN) (resid 40 and name HA) 2.62 0.82 0.82  !intra!     nnoe183.482
assign (resid 40 and name HN) (resid 40 and name HD22) 3.80 2.00 2.00  !intra!     nnoe183.479
assign (resid 40 and name HN) (resid 40 and name HD21) 3.06 1.26 1.26  !intra!     nnoe183.473
assign (resid 37 and name HN) (resid 33 and name HN) 3.45 1.65 1.65  !medium!     nnoe183.472
assign (resid 40 and name HN) (resid 39 and name HN) 2.53 0.73 0.73  !seq!     nnoe183.476
assign (resid 37 and name HN) (resid 39 and name HN) 3.48 1.68 1.68  !medium!     nnoe183.475
assign (resid 37 and name HN) (resid 35 and name HA) 3.90 2.10 2.10  !medium!     nnoe183.490
assign (resid 37 and name HN) (resid 37 and name HA) 2.49 0.69 0.69  !intra!     nnoe183.489
assign (resid 37 and name HN) (resid 36 and name HB2) 2.88 1.08 1.08  !seq!     nnoe183.492
assign (resid 40 and name HN) (resid 38 and name HB2) 3.55 1.75 1.75  !medium!     nnoe183.491
assign (resid 40 and name HN) (resid 38 and name HA) 3.71 1.91 1.91  !medium!     nnoe183.486
assign (resid 37 and name HN) (resid 33 and name HA) 3.90 2.10 2.10  !medium!     nnoe183.483
assign (resid 40 and name HN) (resid 36 and name HA) 3.11 1.31 1.31  !medium!     nnoe183.488
assign (resid 37 and name HN) (resid 36 and name HA) 3.04 1.24 1.24  !seq!     nnoe183.487
assign (resid 45 and name HN) (resid 44 and name HA2) 2.74 0.94 0.94  !seq!     nnoe183.317
assign (resid 50 and name HN) (resid 49 and name HA1) 2.74 0.94 0.94  !seq!     nnoe183.316
assign (resid 45 and name HN) (resid 45 and name HB2) 2.40 0.60 0.60  !intra!     nnoe183.320
assign (resid 45 and name HN) (resid 45 and name HB1) 2.81 1.01 1.01  !intra!     nnoe183.318
assign (resid 45 and name HN) (resid 43 and name HA) 2.83 1.03 1.03  !medium!     nnoe183.312
assign (resid 50 and name HN) (resid 51 and name HA) 3.90 2.10 2.10  !seq!     nnoe183.311
assign (resid 45 and name HN) (resid 45 and name HA) 2.40 0.60 0.60  !intra!     nnoe183.314
assign (resid 50 and name HN) (resid 48 and name HA) 2.93 1.13 1.13  !medium!     nnoe183.313
assign (resid 27 and name HN) (resid 26 and name HN) 2.53 0.73 0.73  !seq!     nnoe183.335
assign (resid 27 and name HN) (resid 25 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.334
assign (resid 27 and name HN) (resid 27 and name HA) 2.44 0.64 0.64  !intra!     nnoe183.340
assign (resid 27 and name HN) (resid 26 and name HA) 2.60 0.80 0.80  !seq!     nnoe183.339
assign (resid 50 and name HN) (resid 47 and name HB2) 3.52 1.72 1.72  !medium!     nnoe183.324
assign (resid 50 and name HN) (resid 50 and name HA) 2.54 0.74 0.74  !intra!     nnoe183.321
assign (resid 27 and name HN) (resid 28 and name HN) 3.27 1.47 1.47  !seq!     nnoe183.333
assign (resid 50 and name HN) (resid 50 and name HB1) 2.40 0.60 0.60  !intra!     nnoe183.325
assign (resid 45 and name HN) (resid 46 and name HA) 3.90 2.10 2.10  !seq!     nnoe183.310
assign (resid 25 and name HN) (resid 24 and name HG2#) 3.32 1.52 1.52  !seq!     nnoe183.296
assign (resid 25 and name HN) (resid 25 and name HG) 3.01 1.21 1.21  !intra!     nnoe183.294
assign (resid 25 and name HN) (resid 25 and name HD1#) 3.34 1.54 1.54  !intra!     nnoe183.298
assign (resid 25 and name HN) (resid 26 and name HG2#) 3.82 2.02 2.02  !seq!     nnoe183.297
assign (resid 58 and name HN) (resid 57 and name HB2) 3.31 1.51 1.51  !seq!     nnoe183.285
assign (resid 58 and name HN) (resid 57 and name HB1) 2.90 1.10 1.10  !seq!     nnoe183.284
assign (resid 25 and name HN) (resid 25 and name HB1) 2.86 1.06 1.06  !intra!     nnoe183.290
assign (resid 54 and name HN) (resid 53 and name HB1) 3.12 1.32 1.32  !seq!     nnoe183.289
assign (resid 50 and name HN) (resid 51 and name HN) 3.50 1.70 1.70  !seq!     nnoe183.305
assign (resid 50 and name HN) (resid 48 and name HN) 3.69 1.89 1.89  !medium!     nnoe183.304
assign (resid 45 and name HN) (resid 13 and name HA) 3.87 2.07 2.07  !long!     nnoe183.309
assign (resid 45 and name HN) (resid 42 and name HA) 3.28 1.48 1.48  !medium!     nnoe183.308
assign (resid 45 and name HN) (resid 44 and name HN) 2.68 0.88 0.88  !seq!     nnoe183.300
assign (resid 45 and name HN) (resid 14 and name HN) 3.73 1.93 1.93  !long!     nnoe183.299
assign (resid 45 and name HN) (resid 46 and name HN) 3.38 1.58 1.58  !seq!     nnoe183.302
assign (resid 50 and name HN) (resid 49 and name HN) 2.47 0.67 0.67  !seq!     nnoe183.301
assign (resid 27 and name HN) (resid 27 and name HB) 2.59 0.79 0.79  !intra!     nnoe183.341
assign (resid 48 and name HN) (resid 15 and name HA) 3.66 1.86 1.86  !long!     nnoe183.378
assign (resid 46 and name HN) (resid 47 and name HA) 3.90 2.10 2.10  !seq!     nnoe183.376
assign (resid 13 and name HN) (resid 12 and name HA) 2.19 0.39 0.39  !seq!     nnoe183.380
assign (resid 48 and name HN) (resid 48 and name HA) 2.66 0.86 0.86  !intra!     nnoe183.379
assign (resid 32 and name HN) (resid 33 and name HA) 3.66 1.86 1.86  !seq!     nnoe183.372
assign (resid 13 and name HN) (resid 13 and name HA) 2.67 0.87 0.87  !intra!     nnoe183.370
assign (resid 48 and name HN) (resid 17 and name HA1) 2.77 0.97 0.97  !long!     nnoe183.374
assign (resid 32 and name HN) (resid 30 and name HA) 3.43 1.63 1.63  !medium!     nnoe183.373
assign (resid 48 and name HN) (resid 47 and name HB2) 2.51 0.71 0.71  !seq!     nnoe183.395
assign (resid 32 and name HN) (resid 30 and name HB1) 3.20 1.40 1.40  !medium!     nnoe183.393
assign (resid 32 and name HN) (resid 32 and name HB2) 2.36 0.56 0.56  !intra!     nnoe183.402
assign (resid 13 and name HN) (resid 12 and name HB2) 2.64 0.84 0.84  !seq!     nnoe183.400
assign (resid 13 and name HN) (resid 12 and name HD1) 3.90 2.10 2.10  !seq!     nnoe183.383
assign (resid 46 and name HN) (resid 15 and name HA) 3.00 1.20 1.20  !long!     nnoe183.381
assign (resid 48 and name HN) (resid 47 and name HB1) 2.82 1.02 1.02  !seq!     nnoe183.391
assign (resid 13 and name HN) (resid 12 and name HD2) 3.90 2.10 2.10  !seq!     nnoe183.389
assign (resid 48 and name HN) (resid 47 and name HA) 2.48 0.68 0.68  !seq!     nnoe183.369
assign (resid 13 and name HN) (resid 14 and name HN) 3.27 1.47 1.47  !seq!     nnoe183.355
assign (resid 22 and name HN) (resid 22 and name HA) 3.90 2.10 2.10  !intra!     nnoe183.353
assign (resid 32 and name HN) (resid 31 and name HN) 3.77 1.97 1.97  !seq!     nnoe183.357
assign (resid 46 and name HN) (resid 14 and name HN) 3.31 1.51 1.51  !long!     nnoe183.356
assign (resid 27 and name HN) (resid 27 and name HG2#) 3.17 1.37 1.37  !intra!     nnoe183.347
assign (resid 27 and name HN) (resid 50 and name HA) 3.60 1.80 1.80  !long!     nnoe183.342
assign (resid 22 and name HN) (resid 21 and name HA) 3.52 1.72 1.72  !seq!     nnoe183.352
assign (resid 27 and name HN) (resid 26 and name HG2#) 3.42 1.62 1.62  !seq!     nnoe183.349
assign (resid 48 and name HN) (resid 18 and name HN) 3.46 1.66 1.66  !long!     nnoe183.365
assign (resid 32 and name HN) (resid 30 and name HD21) 3.83 2.03 2.03  !medium!     nnoe183.364
assign (resid 32 and name HN) (resid 30 and name HN) 3.61 1.81 1.81  !medium!     nnoe183.368
assign (resid 32 and name HN) (resid 30 and name HD22) 3.52 1.72 1.72  !medium!     nnoe183.367
assign (resid 48 and name HN) (resid 49 and name HN) 3.42 1.62 1.62  !seq!     nnoe183.359
assign (resid 48 and name HN) (resid 17 and name HN) 3.65 1.85 1.85  !long!     nnoe183.358
assign (resid 48 and name HN) (resid 50 and name HN) 3.90 2.10 2.10  !medium!     nnoe183.363
assign (resid 32 and name HN) (resid 33 and name HN) 2.44 0.64 0.64  !seq!     nnoe183.362
assign (resid    9 and name C    ) (resid   10 and name N    )
       (resid   10 and name CA   ) (resid   10 and name C    )    1.0  -65.0   22.6 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name C    ) (resid   11 and name N    )    1.0  147.4   20.0 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0  -90.6   41.7 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  131.7   48.3 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0  -71.7   22.0 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  148.7   25.9 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0 -115.3   35.8 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name C    ) (resid   14 and name N    )    1.0  116.0   36.0 2
!assign (resid   16 and name C    ) (resid   17 and name N    )
!       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -87.5   46.7 2
!assign (resid   17 and name N    ) (resid   17 and name CA   )
!       (resid   17 and name C    ) (resid   18 and name N    )    1.0  -20.2   51.8 2
assign (resid   17 and name C    ) (resid   18 and name N    )
       (resid   18 and name CA   ) (resid   18 and name C    )    1.0  -80.6   30.7 2
assign (resid   18 and name N    ) (resid   18 and name CA   )
       (resid   18 and name C    ) (resid   19 and name N    )    1.0  -22.1   32.8 2
assign (resid   23 and name C    ) (resid   24 and name N    )
       (resid   24 and name CA   ) (resid   24 and name C    )    1.0  -75.6   34.5 2
assign (resid   24 and name N    ) (resid   24 and name CA   )
       (resid   24 and name C    ) (resid   25 and name N    )    1.0  -29.8   30.4 2
assign (resid   24 and name C    ) (resid   25 and name N    )
       (resid   25 and name CA   ) (resid   25 and name C    )    1.0  -88.2   34.8 2
assign (resid   25 and name N    ) (resid   25 and name CA   )
       (resid   25 and name C    ) (resid   26 and name N    )    1.0  -17.9   39.5 2
assign (resid   26 and name C    ) (resid   27 and name N    )
       (resid   27 and name CA   ) (resid   27 and name C    )    1.0  -59.0   20.0 2
assign (resid   27 and name N    ) (resid   27 and name CA   )
       (resid   27 and name C    ) (resid   28 and name N    )    1.0  -44.2   20.0 2
assign (resid   27 and name C    ) (resid   28 and name N    )
       (resid   28 and name CA   ) (resid   28 and name C    )    1.0  -65.7   20.0 2
assign (resid   28 and name N    ) (resid   28 and name CA   )
       (resid   28 and name C    ) (resid   29 and name N    )    1.0  -26.4   20.0 2
assign (resid   28 and name C    ) (resid   29 and name N    )
       (resid   29 and name CA   ) (resid   29 and name C    )    1.0 -102.0   26.7 2
assign (resid   29 and name N    ) (resid   29 and name CA   )
       (resid   29 and name C    ) (resid   30 and name N    )    1.0   -1.6   31.0 2
assign (resid   29 and name C    ) (resid   30 and name N    )
       (resid   30 and name CA   ) (resid   30 and name C    )    1.0 -102.9   66.4 2
assign (resid   30 and name N    ) (resid   30 and name CA   )
       (resid   30 and name C    ) (resid   31 and name N    )    1.0  159.5   22.1 2
assign (resid   30 and name C    ) (resid   31 and name N    )
       (resid   31 and name CA   ) (resid   31 and name C    )    1.0  -57.9   22.6 2
assign (resid   31 and name N    ) (resid   31 and name CA   )
       (resid   31 and name C    ) (resid   32 and name N    )    1.0  -28.8   27.3 2
assign (resid   31 and name C    ) (resid   32 and name N    )
       (resid   32 and name CA   ) (resid   32 and name C    )    1.0  -89.5   20.0 2
assign (resid   32 and name N    ) (resid   32 and name CA   )
       (resid   32 and name C    ) (resid   33 and name N    )    1.0   -5.9   20.0 2
assign (resid   34 and name C    ) (resid   35 and name N    )
       (resid   35 and name CA   ) (resid   35 and name C    )    1.0  -65.3   23.9 2
assign (resid   35 and name N    ) (resid   35 and name CA   )
       (resid   35 and name C    ) (resid   36 and name N    )    1.0  -36.5   31.4 2
assign (resid   35 and name C    ) (resid   36 and name N    )
       (resid   36 and name CA   ) (resid   36 and name C    )    1.0  -66.8   38.6 2
assign (resid   36 and name N    ) (resid   36 and name CA   )
       (resid   36 and name C    ) (resid   37 and name N    )    1.0  -46.6   20.0 2
assign (resid   36 and name C    ) (resid   37 and name N    )
       (resid   37 and name CA   ) (resid   37 and name C    )    1.0  -71.0   23.5 2
assign (resid   37 and name N    ) (resid   37 and name CA   )
       (resid   37 and name C    ) (resid   38 and name N    )    1.0  -29.8   22.9 2
assign (resid   38 and name C    ) (resid   39 and name N    )
       (resid   39 and name CA   ) (resid   39 and name C    )    1.0   57.3   20.0 2
assign (resid   39 and name N    ) (resid   39 and name CA   )
       (resid   39 and name C    ) (resid   40 and name N    )    1.0   37.7   25.2 2
assign (resid   39 and name C    ) (resid   40 and name N    )
       (resid   40 and name CA   ) (resid   40 and name C    )    1.0 -115.3   43.8 2
assign (resid   40 and name N    ) (resid   40 and name CA   )
       (resid   40 and name C    ) (resid   41 and name N    )    1.0  150.7   30.2 2
assign (resid   40 and name C    ) (resid   41 and name N    )
       (resid   41 and name CA   ) (resid   41 and name C    )    1.0  -92.5   34.8 2
assign (resid   41 and name N    ) (resid   41 and name CA   )
       (resid   41 and name C    ) (resid   42 and name N    )    1.0  166.0   23.1 2
assign (resid   43 and name C    ) (resid   44 and name N    )
       (resid   44 and name CA   ) (resid   44 and name C    )    1.0   87.1   20.0 2
assign (resid   44 and name N    ) (resid   44 and name CA   )
       (resid   44 and name C    ) (resid   45 and name N    )    1.0   -6.7   20.0 2
assign (resid   45 and name C    ) (resid   46 and name N    )
       (resid   46 and name CA   ) (resid   46 and name C    )    1.0  -91.3   28.2 2
assign (resid   46 and name N    ) (resid   46 and name CA   )
       (resid   46 and name C    ) (resid   47 and name N    )    1.0    2.0   42.2 2
assign (resid   47 and name C    ) (resid   48 and name N    )
       (resid   48 and name CA   ) (resid   48 and name C    )    1.0 -117.3   55.2 2
assign (resid   48 and name N    ) (resid   48 and name CA   )
       (resid   48 and name C    ) (resid   49 and name N    )    1.0  137.7   26.2 2
assign (resid   49 and name C    ) (resid   50 and name N    )
       (resid   50 and name CA   ) (resid   50 and name C    )    1.0  -76.4   55.6 2
assign (resid   50 and name N    ) (resid   50 and name CA   )
       (resid   50 and name C    ) (resid   51 and name N    )    1.0  135.3   25.0 2
assign (resid   50 and name C    ) (resid   51 and name N    )
       (resid   51 and name CA   ) (resid   51 and name C    )    1.0 -113.9   35.7 2
assign (resid   51 and name N    ) (resid   51 and name CA   )
       (resid   51 and name C    ) (resid   52 and name N    )    1.0  120.7   24.2 2
assign (resid   51 and name C    ) (resid   52 and name N    )
       (resid   52 and name CA   ) (resid   52 and name C    )    1.0  -70.5   38.8 2
assign (resid   52 and name N    ) (resid   52 and name CA   )
       (resid   52 and name C    ) (resid   53 and name N    )    1.0  122.1   22.4 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )    1.0  -97.7   35.2 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )    1.0  119.6   38.9 2
assign (resid   55 and name C    ) (resid   56 and name N    )
       (resid   56 and name CA   ) (resid   56 and name C    )    1.0  -82.7   38.1 2
assign (resid   56 and name N    ) (resid   56 and name CA   )
       (resid   56 and name C    ) (resid   57 and name N    )    1.0  132.3   46.9 2
assign (resid   57 and name C    ) (resid   58 and name N    )
       (resid   58 and name CA   ) (resid   58 and name C    )    1.0  -95.6   51.1 2
assign (resid   58 and name N    ) (resid   58 and name CA   )
       (resid   58 and name C    ) (resid   59 and name N    )    1.0  121.8   50.4 2

presidue cysdh                
    delete    atom 1HG               end
    modify    atom 1CB  charge= 0.00 end
    modify    atom 1SG  charge= 0.00 end
end

presidue zf
    add bond 1SG 5ZN
    add bond 2SG 5ZN
    add bond 3SG 5ZN
    add bond 4SG 5ZN
    
    add angle 1SG 5ZN 2SG
    add angle 1SG 5ZN 3SG
    add angle 1SG 5ZN 4SG
    add angle 2SG 5ZN 3SG
    add angle 2SG 5ZN 4SG
    add angle 3SG 5ZN 4SG

!    add angle 1CB 1SG 5ZN
!    add angle 2CB 2SG 5ZN
!    add angle 3CB 2SG 5ZN
!    add angle 4CB 2SG 5ZN

end

bond SH1E ZN 1000.000 {sd=     0.001} 2.30
!angle CH2E SH1E ZN 500.00 {sd=     0.031} 109.5
angle SH1E ZN SH1E 500.00 {sd=     0.031} 109.5


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   8           1HT      SER   8 -17.743   5.616   0.298
    2    H2   SER   8           2HT      SER   8 -17.955   4.656   1.677
    3    H3   SER   8           3HT      SER   8 -18.034   3.976   0.130
    4    HA   SER   8           HA       SER   8 -15.630   5.178   1.298
    5    HB2  SER   8           2HB      SER   8 -16.257   2.251   0.731
    6    HB3  SER   8           1HB      SER   8 -14.807   2.892   1.483
    7    HG   SER   8           HG       SER   8 -17.408   2.657   2.539
    8    HA   PRO   9           HA       PRO   9 -14.456   5.376  -3.024
    9    HB2  PRO   9           2HB      PRO   9 -11.768   5.552  -2.759
   10    HB3  PRO   9           1HB      PRO   9 -12.830   6.890  -2.311
   11    HG2  PRO   9           2HG      PRO   9 -11.561   4.816  -0.568
   12    HG3  PRO   9           1HG      PRO   9 -11.671   6.568  -0.317
   13    HD2  PRO   9           2HD      PRO   9 -13.343   4.822   0.899
   14    HD3  PRO   9           1HD      PRO   9 -13.860   6.450   0.420
   15    HA   PRO  10           HA       PRO  10 -13.244   1.287  -4.369
   16    HB2  PRO  10           2HB      PRO  10 -11.246   2.447  -6.219
   17    HB3  PRO  10           1HB      PRO  10 -12.661   1.463  -6.591
   18    HG2  PRO  10           2HG      PRO  10 -12.595   4.080  -7.163
   19    HG3  PRO  10           1HG      PRO  10 -14.083   3.284  -6.631
   20    HD2  PRO  10           2HD      PRO  10 -12.212   5.020  -5.090
   21    HD3  PRO  10           1HD      PRO  10 -13.986   4.949  -5.048
   22    H    LYS  11           H        LYS  11 -11.888  -0.067  -3.353
   23    HA   LYS  11           HA       LYS  11  -9.385   1.045  -2.319
   24    HB2  LYS  11           2HB      LYS  11 -10.812  -1.441  -1.405
   25    HB3  LYS  11           1HB      LYS  11  -9.463  -0.667  -0.626
   26    HG2  LYS  11           2HG      LYS  11 -12.232   0.518  -0.860
   27    HG3  LYS  11           1HG      LYS  11 -11.569  -0.253   0.575
   28    HD2  LYS  11           2HD      LYS  11 -10.482   2.247  -0.739
   29    HD3  LYS  11           1HD      LYS  11 -11.493   2.211   0.700
   30    HE2  LYS  11           2HE      LYS  11  -9.744   0.904   1.863
   31    HE3  LYS  11           1HE      LYS  11  -8.729   1.023   0.428
   32    HZ1  LYS  11           3HZ      LYS  11  -8.145   2.721   2.061
   33    HZ2  LYS  11           1HZ      LYS  11  -9.722   3.292   2.046
   34    HZ3  LYS  11           2HZ      LYS  11  -8.816   3.460   0.667
   35    HA   PRO  12           HA       PRO  12  -7.574  -1.917  -5.222
   36    HB2  PRO  12           2HB      PRO  12  -5.054  -0.639  -4.569
   37    HB3  PRO  12           1HB      PRO  12  -5.912  -0.627  -6.110
   38    HG2  PRO  12           2HG      PRO  12  -5.612   1.580  -4.507
   39    HG3  PRO  12           1HG      PRO  12  -6.921   1.358  -5.674
   40    HD2  PRO  12           2HD      PRO  12  -6.987   1.009  -2.693
   41    HD3  PRO  12           1HD      PRO  12  -8.217   1.623  -3.819
   42    H    LYS  13           H        LYS  13  -6.252  -3.698  -4.798
   43    HA   LYS  13           HA       LYS  13  -5.274  -3.907  -2.067
   44    HB2  LYS  13           2HB      LYS  13  -5.958  -6.279  -2.037
   45    HB3  LYS  13           1HB      LYS  13  -7.318  -5.185  -2.205
   46    HG2  LYS  13           2HG      LYS  13  -7.251  -5.659  -4.684
   47    HG3  LYS  13           1HG      LYS  13  -6.079  -6.925  -4.326
   48    HD2  LYS  13           2HD      LYS  13  -8.252  -7.932  -4.471
   49    HD3  LYS  13           1HD      LYS  13  -7.757  -7.945  -2.780
   50    HE2  LYS  13           2HE      LYS  13  -9.130  -5.939  -2.359
   51    HE3  LYS  13           1HE      LYS  13  -9.604  -5.921  -4.054
   52    HZ1  LYS  13           3HZ      LYS  13 -10.231  -8.042  -2.079
   53    HZ2  LYS  13           1HZ      LYS  13 -10.702  -8.060  -3.709
   54    HZ3  LYS  13           2HZ      LYS  13 -11.280  -6.869  -2.675
   55    H    CYS  14           H        CYS  14  -3.387  -5.091  -1.803
   56    HA   CYS  14           HA       CYS  14  -1.953  -5.700  -4.273
   57    HB2  CYS  14           2HB      CYS  14   0.000  -4.468  -3.464
   58    HB3  CYS  14           1HB      CYS  14  -1.387  -3.405  -3.640
   59    H    ARG  15           H        ARG  15   0.074  -6.839  -3.778
   60    HA   ARG  15           HA       ARG  15  -0.092  -8.488  -1.336
   61    HB2  ARG  15           2HB      ARG  15   0.793  -9.355  -4.096
   62    HB3  ARG  15           1HB      ARG  15   0.728 -10.362  -2.664
   63    HG2  ARG  15           2HG      ARG  15  -1.706 -10.128  -2.614
   64    HG3  ARG  15           1HG      ARG  15  -1.625  -9.139  -4.075
   65    HD2  ARG  15           2HD      ARG  15  -0.588 -11.010  -5.267
   66    HD3  ARG  15           1HD      ARG  15  -0.706 -11.994  -3.812
   67    HE   ARG  15           HE       ARG  15  -3.149 -10.848  -4.899
   68   HH11  ARG  15          1HH1      ARG  15  -1.116 -13.736  -4.517
   69   HH12  ARG  15          2HH1      ARG  15  -2.380 -14.813  -4.847
   70   HH21  ARG  15          1HH2      ARG  15  -4.844 -12.336  -5.380
   71   HH22  ARG  15          2HH2      ARG  15  -4.536 -14.019  -5.368
   72    H    CYS  16           H        CYS  16   1.365  -6.047  -1.836
   73    HA   CYS  16           HA       CYS  16   4.030  -6.335  -2.610
   74    HB2  CYS  16           2HB      CYS  16   2.898  -4.453  -0.525
   75    HB3  CYS  16           1HB      CYS  16   4.469  -4.299  -1.296
   76    H    GLY  17           H        GLY  17   5.291  -7.856  -1.831
   77    HA2  GLY  17           2HA      GLY  17   6.843  -8.127   0.143
   78    HA3  GLY  17           1HA      GLY  17   5.354  -8.318   1.079
   79    H    ILE  18           H        ILE  18   3.818  -9.752  -0.612
   80    HA   ILE  18           HA       ILE  18   4.907 -12.403  -0.496
   81    HB   ILE  18           HB       ILE  18   2.374 -11.342  -1.775
   82   HG12  ILE  18          2HG1      ILE  18   2.616 -10.811   0.637
   83   HG13  ILE  18          1HG1      ILE  18   1.211 -11.779   0.260
   84   HG21  ILE  18          1HG2      ILE  18   1.516 -13.626  -1.538
   85   HG22  ILE  18          2HG2      ILE  18   3.079 -14.143  -0.901
   86   HG23  ILE  18          3HG2      ILE  18   2.950 -13.569  -2.563
   87   HD11  ILE  18          3HD1      ILE  18   2.447 -13.773   1.072
   88   HD12  ILE  18          1HD1      ILE  18   2.272 -12.530   2.310
   89   HD13  ILE  18          2HD1      ILE  18   3.815 -12.729   1.476
   90    H    SER  19           H        SER  19   4.227  -9.901  -2.811
   91    HA   SER  19           HA       SER  19   5.981 -11.077  -4.762
   92    HB2  SER  19           2HB      SER  19   4.187 -10.644  -6.548
   93    HB3  SER  19           1HB      SER  19   3.930 -12.057  -5.522
   94    HG   SER  19           HG       SER  19   2.691 -10.553  -4.181
   95    H    GLY  20           H        GLY  20   5.946  -9.337  -6.721
   96    HA2  GLY  20           2HA      GLY  20   6.019  -7.169  -7.399
   97    HA3  GLY  20           1HA      GLY  20   5.400  -6.659  -5.832
   98    H    SER  21           H        SER  21   6.790  -6.106  -4.246
   99    HA   SER  21           HA       SER  21   9.619  -6.521  -4.601
  100    HB2  SER  21           2HB      SER  21   9.074  -4.439  -5.893
  101    HB3  SER  21           1HB      SER  21   8.435  -3.730  -4.412
  102    HG   SER  21           HG       SER  21  11.032  -4.315  -5.178
  103    H    SER  22           H        SER  22   9.993  -7.432  -2.647
  104    HA   SER  22           HA       SER  22   8.653  -6.528  -0.265
  105    HB2  SER  22           2HB      SER  22  10.960  -8.458  -0.560
  106    HB3  SER  22           1HB      SER  22   9.815  -8.355   0.777
  107    HG   SER  22           HG       SER  22   8.469  -9.559  -0.299
  108    H    ASN  23           H        ASN  23   9.560  -5.077   1.164
  109    HA   ASN  23           HA       ASN  23  12.355  -4.295   0.835
  110    HB2  ASN  23           2HB      ASN  23   9.992  -2.401   0.599
  111    HB3  ASN  23           1HB      ASN  23  11.634  -1.862   0.896
  112   HD21  ASN  23          1HD2      ASN  23   9.451  -3.245  -1.442
  113   HD22  ASN  23          2HD2      ASN  23  10.454  -3.010  -2.818
  114    H    THR  24           H        THR  24  12.319  -2.125   2.618
  115    HA   THR  24           HA       THR  24  11.456  -3.454   5.064
  116    HB   THR  24           HB       THR  24  13.269  -1.050   4.726
  117    HG1  THR  24           1HG      THR  24  13.798  -3.844   4.835
  118   HG21  THR  24          3HG2      THR  24  12.253  -1.259   6.950
  119   HG22  THR  24          1HG2      THR  24  13.981  -1.606   7.020
  120   HG23  THR  24          2HG2      THR  24  12.815  -2.929   7.055
  121    H    LEU  25           H        LEU  25  11.627  -0.137   3.752
  122    HA   LEU  25           HA       LEU  25   9.143   0.520   5.189
  123    HB2  LEU  25           2HB      LEU  25  11.218   2.344   3.984
  124    HB3  LEU  25           1HB      LEU  25   9.793   2.851   4.862
  125    HG   LEU  25           HG       LEU  25  12.158   1.372   5.997
  126   HD11  LEU  25          1HD1      LEU  25  11.186   4.196   6.375
  127   HD12  LEU  25          2HD1      LEU  25  12.609   3.699   5.461
  128   HD13  LEU  25          3HD1      LEU  25  12.552   3.453   7.206
  129   HD21  LEU  25          3HD2      LEU  25   9.650   2.386   7.329
  130   HD22  LEU  25          1HD2      LEU  25  11.071   1.765   8.168
  131   HD23  LEU  25          2HD2      LEU  25  10.126   0.698   7.133
  132    H    THR  26           H        THR  26  10.767   0.582   2.072
  133    HA   THR  26           HA       THR  26   8.709   2.103   0.866
  134    HB   THR  26           HB       THR  26  10.085   1.668  -1.213
  135    HG1  THR  26           1HG      THR  26  11.907   0.617  -1.017
  136   HG21  THR  26          3HG2      THR  26  11.860   3.209  -0.493
  137   HG22  THR  26          1HG2      THR  26  11.426   2.922   1.190
  138   HG23  THR  26          2HG2      THR  26  10.283   3.720   0.110
  139    H    THR  27           H        THR  27   8.301  -0.887   1.831
  140    HA   THR  27           HA       THR  27   7.869  -2.524  -0.362
  141    HB   THR  27           HB       THR  27   6.133  -2.535   2.104
  142    HG1  THR  27           1HG      THR  27   7.793  -3.309   3.249
  143   HG21  THR  27          3HG2      THR  27   7.409  -4.726   0.451
  144   HG22  THR  27          1HG2      THR  27   5.713  -4.246   0.383
  145   HG23  THR  27          2HG2      THR  27   6.361  -4.971   1.851
  146    H    CYS  28           H        CYS  28   5.263  -0.899   1.490
  147    HA   CYS  28           HA       CYS  28   3.725  -0.793  -0.935
  148    HB2  CYS  28           2HB      CYS  28   2.915  -0.414   1.929
  149    HB3  CYS  28           1HB      CYS  28   1.859   0.106   0.631
  150    H    ARG  29           H        ARG  29   5.940   1.147   0.326
  151    HA   ARG  29           HA       ARG  29   4.502   3.638  -0.182
  152    HB2  ARG  29           2HB      ARG  29   6.068   3.241   1.840
  153    HB3  ARG  29           1HB      ARG  29   7.372   3.452   0.678
  154    HG2  ARG  29           2HG      ARG  29   6.512   5.668   0.116
  155    HG3  ARG  29           1HG      ARG  29   5.256   5.484   1.334
  156    HD2  ARG  29           2HD      ARG  29   6.946   6.728   2.394
  157    HD3  ARG  29           1HD      ARG  29   7.144   5.073   2.975
  158    HE   ARG  29           HE       ARG  29   8.725   5.606   0.675
  159   HH11  ARG  29          1HH1      ARG  29   8.672   5.983   4.204
  160   HH12  ARG  29          2HH1      ARG  29  10.354   6.231   4.326
  161   HH21  ARG  29          1HH2      ARG  29  11.026   5.924   0.860
  162   HH22  ARG  29          2HH2      ARG  29  11.731   6.181   2.385
  163    H    ASN  30           H        ASN  30   5.984   1.521  -2.119
  164    HA   ASN  30           HA       ASN  30   7.207   3.656  -3.698
  165    HB2  ASN  30           2HB      ASN  30   8.572   2.082  -4.858
  166    HB3  ASN  30           1HB      ASN  30   8.658   1.599  -3.171
  167   HD21  ASN  30          1HD2      ASN  30   7.739  -0.363  -2.586
  168   HD22  ASN  30          2HD2      ASN  30   7.213  -1.523  -3.752
  169    H    SER  31           H        SER  31   6.934   3.249  -6.161
  170    HA   SER  31           HA       SER  31   4.147   3.543  -6.508
  171    HB2  SER  31           2HB      SER  31   6.373   3.678  -8.532
  172    HB3  SER  31           1HB      SER  31   4.701   4.185  -8.794
  173    HG   SER  31           HG       SER  31   6.057   5.898  -8.233
  174    H    ARG  32           H        ARG  32   5.856   0.679  -6.498
  175    HA   ARG  32           HA       ARG  32   4.329  -0.602  -8.598
  176    HB2  ARG  32           2HB      ARG  32   5.974  -1.847  -6.373
  177    HB3  ARG  32           1HB      ARG  32   5.265  -2.717  -7.719
  178    HG2  ARG  32           2HG      ARG  32   7.405  -0.609  -7.923
  179    HG3  ARG  32           1HG      ARG  32   7.675  -2.348  -7.977
  180    HD2  ARG  32           2HD      ARG  32   6.273  -2.477  -9.996
  181    HD3  ARG  32           1HD      ARG  32   6.068  -0.723  -9.951
  182    HE   ARG  32           HE       ARG  32   8.788  -1.292  -9.905
  183   HH11  ARG  32          1HH1      ARG  32   6.093  -1.558 -12.142
  184   HH12  ARG  32          2HH1      ARG  32   7.029  -1.405 -13.556
  185   HH21  ARG  32          1HH2      ARG  32  10.098  -1.085 -11.803
  186   HH22  ARG  32          2HH2      ARG  32   9.368  -1.122 -13.361
  187    H    CYS  33           H        CYS  33   3.615   0.549  -5.598
  188    HA   CYS  33           HA       CYS  33   1.700  -1.547  -5.008
  189    HB2  CYS  33           2HB      CYS  33   3.048  -0.729  -3.136
  190    HB3  CYS  33           1HB      CYS  33   2.473   0.907  -3.426
  191    HA   PRO  34           HA       PRO  34  -1.263   0.880  -7.409
  192    HB2  PRO  34           2HB      PRO  34  -3.434  -0.682  -6.633
  193    HB3  PRO  34           1HB      PRO  34  -2.396  -0.992  -8.026
  194    HG2  PRO  34           2HG      PRO  34  -2.347  -2.204  -5.307
  195    HG3  PRO  34           1HG      PRO  34  -2.031  -2.961  -6.877
  196    HD2  PRO  34           2HD      PRO  34  -0.072  -2.321  -5.189
  197    HD3  PRO  34           1HD      PRO  34   0.153  -2.190  -6.943
  198    H    CYS  35           H        CYS  35  -1.767  -0.094  -4.101
  199    HA   CYS  35           HA       CYS  35  -3.923   1.563  -3.359
  200    HB2  CYS  35           2HB      CYS  35  -1.596   0.631  -1.706
  201    HB3  CYS  35           1HB      CYS  35  -3.130   1.213  -1.079
  202    H    TYR  36           H        TYR  36  -0.501   1.955  -2.829
  203    HA   TYR  36           HA       TYR  36  -0.343   4.478  -1.754
  204    HB2  TYR  36           2HB      TYR  36   1.557   3.036  -1.805
  205    HB3  TYR  36           1HB      TYR  36   1.505   2.928  -3.556
  206    HD1  TYR  36           2HD      TYR  36   2.364   5.111  -0.716
  207    HD2  TYR  36           1HD      TYR  36   2.569   4.548  -4.919
  208    HE1  TYR  36           2HE      TYR  36   3.983   6.942  -0.878
  209    HE2  TYR  36           1HE      TYR  36   4.168   6.347  -5.119
  210    HH   TYR  36           HH       TYR  36   4.784   8.397  -3.785
  211    H    LYS  37           H        LYS  37  -0.040   3.562  -5.138
  212    HA   LYS  37           HA       LYS  37   0.309   6.154  -6.141
  213    HB2  LYS  37           2HB      LYS  37   1.028   3.990  -7.182
  214    HB3  LYS  37           1HB      LYS  37  -0.639   3.677  -7.600
  215    HG2  LYS  37           2HG      LYS  37   0.833   6.104  -8.550
  216    HG3  LYS  37           1HG      LYS  37   0.947   4.577  -9.404
  217    HD2  LYS  37           2HD      LYS  37  -1.634   6.091  -8.883
  218    HD3  LYS  37           1HD      LYS  37  -0.752   6.107 -10.411
  219    HE2  LYS  37           2HE      LYS  37  -2.018   3.681  -9.102
  220    HE3  LYS  37           1HE      LYS  37  -2.648   4.557 -10.491
  221    HZ1  LYS  37           3HZ      LYS  37  -0.670   3.920 -11.740
  222    HZ2  LYS  37           1HZ      LYS  37  -1.454   2.548 -11.153
  223    HZ3  LYS  37           2HZ      LYS  37  -0.054   3.117 -10.413
  224    H    SER  38           H        SER  38  -2.582   4.216  -5.605
  225    HA   SER  38           HA       SER  38  -4.219   6.244  -6.880
  226    HB2  SER  38           2HB      SER  38  -4.905   3.493  -5.851
  227    HB3  SER  38           1HB      SER  38  -6.040   4.586  -6.646
  228    HG   SER  38           HG       SER  38  -4.128   2.976  -7.744
  229    H    TYR  39           H        TYR  39  -2.890   6.404  -4.093
  230    HA   TYR  39           HA       TYR  39  -3.327   7.536  -2.170
  231    HB2  TYR  39           2HB      TYR  39  -5.687   8.461  -3.808
  232    HB3  TYR  39           1HB      TYR  39  -5.379   9.071  -2.189
  233    HD1  TYR  39           1HD      TYR  39  -3.923   8.820  -5.602
  234    HD2  TYR  39           2HD      TYR  39  -3.793  10.756  -1.819
  235    HE1  TYR  39           1HE      TYR  39  -2.343  10.473  -6.505
  236    HE2  TYR  39           2HE      TYR  39  -2.222  12.411  -2.712
  237    HH   TYR  39           HH       TYR  39  -1.638  12.782  -5.991
  238    H    ASN  40           H        ASN  40  -4.062   4.845  -2.129
  239    HA   ASN  40           HA       ASN  40  -6.193   5.024  -0.162
  240    HB2  ASN  40           2HB      ASN  40  -6.039   3.108  -2.418
  241    HB3  ASN  40           1HB      ASN  40  -6.698   2.557  -0.882
  242   HD21  ASN  40          1HD2      ASN  40  -7.197   4.652  -3.610
  243   HD22  ASN  40          2HD2      ASN  40  -8.819   5.057  -3.191
  244    H    SER  41           H        SER  41  -6.226   3.669   1.496
  245    HA   SER  41           HA       SER  41  -3.737   2.809   2.519
  246    HB2  SER  41           2HB      SER  41  -5.311   2.143   4.383
  247    HB3  SER  41           1HB      SER  41  -5.280   3.862   3.966
  248    HG   SER  41           HG       SER  41  -7.374   2.929   4.229
  249    H    CYS  42           H        CYS  42  -3.531   0.650   3.446
  250    HA   CYS  42           HA       CYS  42  -4.377  -1.301   1.522
  251    HB2  CYS  42           2HB      CYS  42  -2.204  -1.292   3.591
  252    HB3  CYS  42           1HB      CYS  42  -2.677  -2.775   2.740
  253    H    ALA  43           H        ALA  43  -6.400  -1.104   2.273
  254    HA   ALA  43           HA       ALA  43  -7.008  -2.725   4.666
  255    HB1  ALA  43           1HB      ALA  43  -8.893  -1.045   3.003
  256    HB2  ALA  43           2HB      ALA  43  -8.144  -0.547   4.520
  257    HB3  ALA  43           3HB      ALA  43  -9.297  -1.883   4.504
  258    H    GLY  44           H        GLY  44  -6.912  -4.853   4.101
  259    HA2  GLY  44           2HA      GLY  44  -8.149  -6.703   3.261
  260    HA3  GLY  44           1HA      GLY  44  -8.680  -5.692   1.921
  261    H    CYS  45           H        CYS  45  -5.398  -5.412   2.706
  262    HA   CYS  45           HA       CYS  45  -4.724  -6.679   0.160
  263    HB2  CYS  45           2HB      CYS  45  -3.032  -4.973   1.985
  264    HB3  CYS  45           1HB      CYS  45  -2.597  -5.531   0.375
  265    H    HIS  46           H        HIS  46  -2.554  -7.785   0.147
  266    HA   HIS  46           HA       HIS  46  -2.117  -9.318   2.599
  267    HB2  HIS  46           2HB      HIS  46  -1.991 -10.282  -0.272
  268    HB3  HIS  46           1HB      HIS  46  -1.166 -11.127   1.026
  269    HD1  HIS  46           1HD      HIS  46  -2.668 -12.302   2.816
  270    HD2  HIS  46           2HD      HIS  46  -4.737 -10.717  -0.411
  271    HE1  HIS  46           1HE      HIS  46  -4.933 -13.340   2.900
  272    HE2  HIS  46           2HE      HIS  46  -6.231 -12.046   1.213
  273    H    CYS  47           H        CYS  47  -1.016  -6.979   2.301
  274    HA   CYS  47           HA       CYS  47   1.610  -7.325   1.162
  275    HB2  CYS  47           2HB      CYS  47   1.925  -4.931   1.829
  276    HB3  CYS  47           1HB      CYS  47   0.645  -5.222   0.668
  277    H    VAL  48           H        VAL  48   3.434  -7.311   2.287
  278    HA   VAL  48           HA       VAL  48   3.195  -7.789   5.183
  279    HB   VAL  48           HB       VAL  48   5.118  -9.149   3.256
  280   HG11  VAL  48          1HG1      VAL  48   4.734  -9.554   6.225
  281   HG12  VAL  48          2HG1      VAL  48   6.121  -8.791   5.455
  282   HG13  VAL  48          3HG1      VAL  48   5.795 -10.503   5.183
  283   HG21  VAL  48          3HG2      VAL  48   2.849 -10.011   3.030
  284   HG22  VAL  48          1HG2      VAL  48   2.769 -10.279   4.771
  285   HG23  VAL  48          2HG2      VAL  48   3.899 -11.211   3.788
  286    H    GLY  49           H        GLY  49   4.160  -6.243   6.249
  287    HA2  GLY  49           2HA      GLY  49   5.917  -4.854   6.886
  288    HA3  GLY  49           1HA      GLY  49   6.748  -5.302   5.390
  289    H    CYS  50           H        CYS  50   3.512  -4.088   5.865
  290    HA   CYS  50           HA       CYS  50   3.786  -2.306   3.679
  291    HB2  CYS  50           2HB      CYS  50   1.728  -3.430   3.859
  292    HB3  CYS  50           1HB      CYS  50   1.554  -2.990   5.555
  293    H    LYS  51           H        LYS  51   4.953  -0.546   4.081
  294    HA   LYS  51           HA       LYS  51   3.852   1.132   6.179
  295    HB2  LYS  51           2HB      LYS  51   6.539   1.323   4.739
  296    HB3  LYS  51           1HB      LYS  51   5.899   2.617   5.716
  297    HG2  LYS  51           2HG      LYS  51   7.546   1.437   6.998
  298    HG3  LYS  51           1HG      LYS  51   5.966   1.109   7.696
  299    HD2  LYS  51           2HD      LYS  51   5.920  -1.064   6.572
  300    HD3  LYS  51           1HD      LYS  51   7.487  -0.738   5.845
  301    HE2  LYS  51           2HE      LYS  51   8.514  -0.651   8.063
  302    HE3  LYS  51           1HE      LYS  51   6.942  -0.927   8.812
  303    HZ1  LYS  51           3HZ      LYS  51   8.309  -2.831   6.982
  304    HZ2  LYS  51           1HZ      LYS  51   6.847  -3.096   7.787
  305    HZ3  LYS  51           2HZ      LYS  51   8.278  -2.978   8.653
  306    H    ASN  52           H        ASN  52   2.103   1.731   5.112
  307    HA   ASN  52           HA       ASN  52   2.470   3.102   2.545
  308    HB2  ASN  52           2HB      ASN  52   0.885   1.207   2.514
  309    HB3  ASN  52           1HB      ASN  52  -0.102   1.924   3.751
  310   HD21  ASN  52          1HD2      ASN  52  -1.098   1.154   1.329
  311   HD22  ASN  52          2HD2      ASN  52  -1.607   2.560   0.456
  312    HA   PRO  53           HA       PRO  53   1.850   6.686   5.194
  313    HB2  PRO  53           2HB      PRO  53   2.392   8.568   3.338
  314    HB3  PRO  53           1HB      PRO  53   3.659   7.578   4.076
  315    HG2  PRO  53           2HG      PRO  53   2.329   7.262   1.415
  316    HG3  PRO  53           1HG      PRO  53   4.044   7.122   1.827
  317    HD2  PRO  53           2HD      PRO  53   2.392   4.964   1.523
  318    HD3  PRO  53           1HD      PRO  53   3.800   4.945   2.602
  319    H    HIS  54           H        HIS  54  -0.023   5.671   2.569
  320    HA   HIS  54           HA       HIS  54  -1.814   7.946   2.717
  321    HB2  HIS  54           2HB      HIS  54  -1.936   5.459   0.994
  322    HB3  HIS  54           1HB      HIS  54  -3.176   6.702   0.999
  323    HD1  HIS  54           1HD      HIS  54  -2.675   8.855  -0.233
  324    HD2  HIS  54           2HD      HIS  54   0.480   6.179  -0.266
  325    HE1  HIS  54           1HE      HIS  54  -1.071   9.727  -1.968
  326    HE2  HIS  54           2HE      HIS  54   0.603   7.912  -2.199
  327    H    LYS  55           H        LYS  55  -2.299   7.690   4.785
  328    HA   LYS  55           HA       LYS  55  -3.837   5.386   5.682
  329    HB2  LYS  55           2HB      LYS  55  -2.086   7.042   6.948
  330    HB3  LYS  55           1HB      LYS  55  -3.564   7.936   7.238
  331    HG2  LYS  55           2HG      LYS  55  -3.015   5.091   8.076
  332    HG3  LYS  55           1HG      LYS  55  -2.982   6.508   9.119
  333    HD2  LYS  55           2HD      LYS  55  -5.332   6.862   8.773
  334    HD3  LYS  55           1HD      LYS  55  -5.392   5.556   7.600
  335    HE2  LYS  55           2HE      LYS  55  -4.647   3.993   9.412
  336    HE3  LYS  55           1HE      LYS  55  -4.814   5.328  10.545
  337    HZ1  LYS  55           3HZ      LYS  55  -7.126   5.456  10.101
  338    HZ2  LYS  55           1HZ      LYS  55  -6.774   3.836  10.409
  339    HZ3  LYS  55           2HZ      LYS  55  -7.003   4.360   8.816
  340    H    GLU  56           H        GLU  56  -6.160   5.532   5.692
  341    HA   GLU  56           HA       GLU  56  -7.201   7.478   3.965
  342    HB2  GLU  56           2HB      GLU  56  -9.490   6.664   4.536
  343    HB3  GLU  56           1HB      GLU  56  -8.395   5.401   4.013
  344    HG2  GLU  56           2HG      GLU  56  -8.982   5.939   6.913
  345    HG3  GLU  56           1HG      GLU  56  -9.977   4.870   5.927
  346    H    ASP  57           H        ASP  57  -7.932   9.343   4.175
  347    HA   ASP  57           HA       ASP  57  -7.601  10.755   6.630
  348    HB2  ASP  57           2HB      ASP  57  -8.912  11.690   4.062
  349    HB3  ASP  57           1HB      ASP  57  -8.406  12.725   5.389
  350    H    TYR  58           H        TYR  58  -8.963  10.204   8.177
  351    HA   TYR  58           HA       TYR  58 -11.817  10.419   7.579
  352    HB2  TYR  58           2HB      TYR  58 -11.172   8.049   7.915
  353    HB3  TYR  58           1HB      TYR  58 -10.492   8.460   9.480
  354    HD1  TYR  58           2HD      TYR  58 -13.655   8.256   7.566
  355    HD2  TYR  58           1HD      TYR  58 -11.859   8.548  11.396
  356    HE1  TYR  58           2HE      TYR  58 -15.842   7.828   8.618
  357    HE2  TYR  58           1HE      TYR  58 -14.030   8.122  12.453
  358    HH   TYR  58           HH       TYR  58 -16.698   6.974  10.793
  359    H    VAL  59           H        VAL  59 -11.968  12.476   8.261
  360    HA   VAL  59           HA       VAL  59 -11.128  13.025  10.983
  361    HB   VAL  59           HB       VAL  59 -11.514  15.493  10.338
  362   HG11  VAL  59          1HG1      VAL  59  -9.284  14.508  10.554
  363   HG12  VAL  59          2HG1      VAL  59  -9.330  15.654   9.213
  364   HG13  VAL  59          3HG1      VAL  59  -9.375  13.921   8.894
  365   HG21  VAL  59          3HG2      VAL  59 -11.367  16.007   7.924
  366   HG22  VAL  59          1HG2      VAL  59 -12.847  15.123   8.306
  367   HG23  VAL  59          2HG2      VAL  59 -11.482  14.289   7.558
  Start of MODEL    2
    1    H1   SER   8           1HT      SER   8 -18.945   3.486  -7.222
    2    H2   SER   8           2HT      SER   8 -18.449   4.873  -8.061
    3    H3   SER   8           3HT      SER   8 -19.743   4.965  -7.010
    4    HA   SER   8           HA       SER   8 -17.763   5.921  -6.071
    5    HB2  SER   8           2HB      SER   8 -18.524   3.293  -4.758
    6    HB3  SER   8           1HB      SER   8 -17.809   4.687  -3.957
    7    HG   SER   8           HG       SER   8 -19.816   5.810  -4.871
    8    HA   PRO   9           HA       PRO   9 -13.949   4.125  -7.475
    9    HB2  PRO   9           2HB      PRO   9 -12.315   5.195  -5.506
   10    HB3  PRO   9           1HB      PRO   9 -12.757   6.006  -7.007
   11    HG2  PRO   9           2HG      PRO   9 -13.857   6.344  -4.270
   12    HG3  PRO   9           1HG      PRO   9 -13.650   7.534  -5.563
   13    HD2  PRO   9           2HD      PRO   9 -16.051   6.480  -4.916
   14    HD3  PRO   9           1HD      PRO   9 -15.637   6.982  -6.568
   15    HA   PRO  10           HA       PRO  10 -13.684   0.607  -4.615
   16    HB2  PRO  10           2HB      PRO  10 -12.024  -0.555  -6.745
   17    HB3  PRO  10           1HB      PRO  10 -13.560  -1.137  -6.104
   18    HG2  PRO  10           2HG      PRO  10 -13.334  -0.105  -8.582
   19    HG3  PRO  10           1HG      PRO  10 -14.805   0.065  -7.610
   20    HD2  PRO  10           2HD      PRO  10 -12.627   2.052  -8.114
   21    HD3  PRO  10           1HD      PRO  10 -14.392   2.276  -8.037
   22    H    LYS  11           H        LYS  11 -11.960  -0.060  -3.297
   23    HA   LYS  11           HA       LYS  11  -9.594   1.550  -3.717
   24    HB2  LYS  11           2HB      LYS  11  -9.075   1.220  -1.335
   25    HB3  LYS  11           1HB      LYS  11 -10.621   2.000  -1.587
   26    HG2  LYS  11           2HG      LYS  11 -11.704  -0.198  -1.153
   27    HG3  LYS  11           1HG      LYS  11 -10.113  -0.841  -0.758
   28    HD2  LYS  11           2HD      LYS  11 -11.485   1.458   0.668
   29    HD3  LYS  11           1HD      LYS  11 -11.395  -0.196   1.257
   30    HE2  LYS  11           2HE      LYS  11  -9.722   0.934   2.461
   31    HE3  LYS  11           1HE      LYS  11  -8.838   0.125   1.179
   32    HZ1  LYS  11           3HZ      LYS  11  -8.081   2.382   1.538
   33    HZ2  LYS  11           1HZ      LYS  11  -9.590   3.025   1.241
   34    HZ3  LYS  11           2HZ      LYS  11  -8.752   2.317  -0.017
   35    HA   PRO  12           HA       PRO  12  -7.505  -2.027  -5.279
   36    HB2  PRO  12           2HB      PRO  12  -5.141  -0.351  -4.649
   37    HB3  PRO  12           1HB      PRO  12  -5.579  -1.159  -6.156
   38    HG2  PRO  12           2HG      PRO  12  -5.864   1.458  -5.921
   39    HG3  PRO  12           1HG      PRO  12  -7.083   0.480  -6.760
   40    HD2  PRO  12           2HD      PRO  12  -7.174   1.675  -4.026
   41    HD3  PRO  12           1HD      PRO  12  -8.446   1.520  -5.262
   42    H    LYS  13           H        LYS  13  -6.262  -3.650  -4.578
   43    HA   LYS  13           HA       LYS  13  -5.272  -3.618  -1.827
   44    HB2  LYS  13           2HB      LYS  13  -6.690  -5.866  -3.280
   45    HB3  LYS  13           1HB      LYS  13  -6.013  -5.978  -1.661
   46    HG2  LYS  13           2HG      LYS  13  -7.608  -4.374  -0.824
   47    HG3  LYS  13           1HG      LYS  13  -8.223  -4.083  -2.447
   48    HD2  LYS  13           2HD      LYS  13  -8.417  -6.657  -0.884
   49    HD3  LYS  13           1HD      LYS  13  -9.727  -5.521  -1.203
   50    HE2  LYS  13           2HE      LYS  13  -9.357  -5.927  -3.657
   51    HE3  LYS  13           1HE      LYS  13  -8.233  -7.202  -3.199
   52    HZ1  LYS  13           3HZ      LYS  13 -10.374  -8.114  -3.670
   53    HZ2  LYS  13           1HZ      LYS  13 -11.113  -7.105  -2.542
   54    HZ3  LYS  13           2HZ      LYS  13 -10.060  -8.314  -2.033
   55    H    CYS  14           H        CYS  14  -3.422  -5.082  -1.590
   56    HA   CYS  14           HA       CYS  14  -2.156  -5.765  -4.143
   57    HB2  CYS  14           2HB      CYS  14  -0.083  -4.687  -3.460
   58    HB3  CYS  14           1HB      CYS  14  -1.399  -3.517  -3.543
   59    H    ARG  15           H        ARG  15  -0.118  -6.952  -3.774
   60    HA   ARG  15           HA       ARG  15  -0.198  -8.677  -1.394
   61    HB2  ARG  15           2HB      ARG  15   0.500  -9.392  -4.259
   62    HB3  ARG  15           1HB      ARG  15   0.658 -10.476  -2.887
   63    HG2  ARG  15           2HG      ARG  15  -1.742 -10.453  -2.554
   64    HG3  ARG  15           1HG      ARG  15  -1.934  -9.293  -3.868
   65    HD2  ARG  15           2HD      ARG  15  -2.459 -11.521  -4.658
   66    HD3  ARG  15           1HD      ARG  15  -0.990 -10.928  -5.431
   67    HE   ARG  15           HE       ARG  15  -0.870 -12.742  -3.115
   68   HH11  ARG  15          1HH1      ARG  15  -0.028 -12.037  -6.482
   69   HH12  ARG  15          2HH1      ARG  15   0.974 -13.405  -6.665
   70   HH21  ARG  15          1HH2      ARG  15   0.465 -14.657  -3.379
   71   HH22  ARG  15          2HH2      ARG  15   1.232 -14.942  -4.861
   72    H    CYS  16           H        CYS  16   1.200  -6.182  -1.996
   73    HA   CYS  16           HA       CYS  16   3.870  -6.427  -2.695
   74    HB2  CYS  16           2HB      CYS  16   2.598  -4.602  -0.654
   75    HB3  CYS  16           1HB      CYS  16   4.263  -4.451  -1.186
   76    H    GLY  17           H        GLY  17   5.669  -7.177  -1.736
   77    HA2  GLY  17           2HA      GLY  17   6.942  -7.717   0.217
   78    HA3  GLY  17           1HA      GLY  17   5.429  -8.178   1.013
   79    H    ILE  18           H        ILE  18   4.196  -9.455  -1.018
   80    HA   ILE  18           HA       ILE  18   5.648 -11.953  -1.222
   81    HB   ILE  18           HB       ILE  18   2.893 -11.212  -2.283
   82   HG12  ILE  18          2HG1      ILE  18   3.660 -12.475   0.359
   83   HG13  ILE  18          1HG1      ILE  18   2.991 -10.878   0.128
   84   HG21  ILE  18          1HG2      ILE  18   2.489 -13.632  -2.303
   85   HG22  ILE  18          2HG2      ILE  18   4.133 -13.905  -1.734
   86   HG23  ILE  18          3HG2      ILE  18   3.861 -13.204  -3.331
   87   HD11  ILE  18          3HD1      ILE  18   0.898 -11.830  -0.692
   88   HD12  ILE  18          1HD1      ILE  18   1.288 -12.423   0.924
   89   HD13  ILE  18          2HD1      ILE  18   1.554 -13.456  -0.481
   90    H    SER  19           H        SER  19   4.218  -9.411  -3.165
   91    HA   SER  19           HA       SER  19   6.245  -9.656  -5.193
   92    HB2  SER  19           2HB      SER  19   3.292  -9.929  -5.841
   93    HB3  SER  19           1HB      SER  19   4.574  -9.717  -7.036
   94    HG   SER  19           HG       SER  19   5.106 -11.711  -5.288
   95    H    GLY  20           H        GLY  20   6.970  -7.617  -5.118
   96    HA2  GLY  20           2HA      GLY  20   5.387  -5.459  -6.036
   97    HA3  GLY  20           1HA      GLY  20   5.636  -5.343  -4.297
   98    H    SER  21           H        SER  21   8.015  -5.923  -3.705
   99    HA   SER  21           HA       SER  21  10.084  -5.290  -5.478
  100    HB2  SER  21           2HB      SER  21  10.787  -3.149  -4.278
  101    HB3  SER  21           1HB      SER  21   9.354  -2.983  -5.292
  102    HG   SER  21           HG       SER  21   9.419  -2.118  -3.015
  103    H    SER  22           H        SER  22  12.191  -5.363  -4.264
  104    HA   SER  22           HA       SER  22  11.854  -7.087  -1.960
  105    HB2  SER  22           2HB      SER  22  13.412  -7.797  -3.780
  106    HB3  SER  22           1HB      SER  22  14.397  -6.369  -3.462
  107    HG   SER  22           HG       SER  22  14.525  -8.730  -2.303
  108    H    ASN  23           H        ASN  23  11.099  -5.486  -0.608
  109    HA   ASN  23           HA       ASN  23  13.119  -3.950   0.730
  110    HB2  ASN  23           2HB      ASN  23  12.293  -2.521  -1.204
  111    HB3  ASN  23           1HB      ASN  23  10.685  -2.607  -0.511
  112   HD21  ASN  23          1HD2      ASN  23  12.503  -0.368  -1.078
  113   HD22  ASN  23          2HD2      ASN  23  12.641   0.512   0.396
  114    H    THR  24           H        THR  24  12.344  -3.487   2.863
  115    HA   THR  24           HA       THR  24  10.028  -5.100   3.569
  116    HB   THR  24           HB       THR  24  11.173  -4.851   5.872
  117    HG1  THR  24           1HG      THR  24  12.841  -3.599   5.729
  118   HG21  THR  24          3HG2      THR  24  12.452  -6.432   3.630
  119   HG22  THR  24          1HG2      THR  24  11.062  -6.950   4.586
  120   HG23  THR  24          2HG2      THR  24  12.641  -6.760   5.352
  121    H    LEU  25           H        LEU  25  10.953  -1.859   3.268
  122    HA   LEU  25           HA       LEU  25   8.807  -1.116   5.085
  123    HB2  LEU  25           2HB      LEU  25   9.952   0.968   5.729
  124    HB3  LEU  25           1HB      LEU  25  10.785  -0.468   6.263
  125    HG   LEU  25           HG       LEU  25  11.672   1.093   3.823
  126   HD11  LEU  25          1HD1      LEU  25  13.296   2.170   5.292
  127   HD12  LEU  25          2HD1      LEU  25  12.562   1.375   6.686
  128   HD13  LEU  25          3HD1      LEU  25  11.645   2.569   5.771
  129   HD21  LEU  25          3HD2      LEU  25  12.564  -1.196   4.051
  130   HD22  LEU  25          1HD2      LEU  25  13.132  -0.805   5.674
  131   HD23  LEU  25          2HD2      LEU  25  13.822   0.018   4.275
  132    H    THR  26           H        THR  26  10.628  -0.015   2.212
  133    HA   THR  26           HA       THR  26   8.597   1.946   1.704
  134    HB   THR  26           HB       THR  26  10.660   1.246  -0.350
  135    HG1  THR  26           1HG      THR  26  11.180   2.588   2.146
  136   HG21  THR  26          3HG2      THR  26   9.103   3.133  -0.697
  137   HG22  THR  26          1HG2      THR  26  10.770   3.697  -0.563
  138   HG23  THR  26          2HG2      THR  26   9.672   3.872   0.801
  139    H    THR  27           H        THR  27   8.322  -1.166   1.534
  140    HA   THR  27           HA       THR  27   7.887  -2.201  -0.928
  141    HB   THR  27           HB       THR  27   6.185  -2.757   1.474
  142    HG1  THR  27           1HG      THR  27   8.558  -4.015   1.570
  143   HG21  THR  27          3HG2      THR  27   6.488  -5.041   0.793
  144   HG22  THR  27          1HG2      THR  27   7.709  -4.578  -0.409
  145   HG23  THR  27          2HG2      THR  27   6.034  -4.104  -0.633
  146    H    CYS  28           H        CYS  28   5.314  -1.039   1.251
  147    HA   CYS  28           HA       CYS  28   3.585  -0.629  -1.020
  148    HB2  CYS  28           2HB      CYS  28   3.053  -0.598   1.930
  149    HB3  CYS  28           1HB      CYS  28   1.828  -0.070   0.783
  150    H    ARG  29           H        ARG  29   5.830   1.136   0.349
  151    HA   ARG  29           HA       ARG  29   4.426   3.703   0.395
  152    HB2  ARG  29           2HB      ARG  29   6.041   2.892   2.198
  153    HB3  ARG  29           1HB      ARG  29   7.302   3.134   1.000
  154    HG2  ARG  29           2HG      ARG  29   6.824   5.509   0.937
  155    HG3  ARG  29           1HG      ARG  29   5.503   5.290   2.090
  156    HD2  ARG  29           2HD      ARG  29   7.155   4.345   3.698
  157    HD3  ARG  29           1HD      ARG  29   8.434   4.765   2.562
  158    HE   ARG  29           HE       ARG  29   6.872   7.033   3.117
  159   HH11  ARG  29          1HH1      ARG  29   9.403   5.017   4.518
  160   HH12  ARG  29          2HH1      ARG  29   9.883   6.133   5.698
  161   HH21  ARG  29          1HH2      ARG  29   7.524   8.624   4.729
  162   HH22  ARG  29          2HH2      ARG  29   8.745   8.233   5.838
  163    H    ASN  30           H        ASN  30   5.616   1.915  -2.009
  164    HA   ASN  30           HA       ASN  30   6.737   4.258  -3.355
  165    HB2  ASN  30           2HB      ASN  30   8.381   2.961  -4.540
  166    HB3  ASN  30           1HB      ASN  30   8.410   2.349  -2.912
  167   HD21  ASN  30          1HD2      ASN  30   7.799   0.291  -2.510
  168   HD22  ASN  30          2HD2      ASN  30   7.424  -0.861  -3.742
  169    H    SER  31           H        SER  31   6.545   3.907  -5.886
  170    HA   SER  31           HA       SER  31   3.733   4.007  -6.202
  171    HB2  SER  31           2HB      SER  31   5.919   4.409  -8.226
  172    HB3  SER  31           1HB      SER  31   4.225   4.871  -8.408
  173    HG   SER  31           HG       SER  31   4.962   6.677  -7.598
  174    H    ARG  32           H        ARG  32   5.673   1.309  -6.348
  175    HA   ARG  32           HA       ARG  32   4.311   0.109  -8.601
  176    HB2  ARG  32           2HB      ARG  32   6.148  -1.169  -6.559
  177    HB3  ARG  32           1HB      ARG  32   5.579  -1.930  -8.041
  178    HG2  ARG  32           2HG      ARG  32   6.718  -0.280  -9.374
  179    HG3  ARG  32           1HG      ARG  32   7.219   0.579  -7.922
  180    HD2  ARG  32           2HD      ARG  32   8.478  -1.478  -7.252
  181    HD3  ARG  32           1HD      ARG  32   8.095  -2.153  -8.844
  182    HE   ARG  32           HE       ARG  32   9.152   0.440  -9.039
  183   HH11  ARG  32          1HH1      ARG  32  10.206  -2.926  -8.639
  184   HH12  ARG  32          2HH1      ARG  32  11.789  -2.616  -9.166
  185   HH21  ARG  32          1HH2      ARG  32  11.296   0.830  -9.778
  186   HH22  ARG  32          2HH2      ARG  32  12.430  -0.463  -9.827
  187    H    CYS  33           H        CYS  33   3.686   0.668  -5.383
  188    HA   CYS  33           HA       CYS  33   1.915  -1.569  -5.007
  189    HB2  CYS  33           2HB      CYS  33   3.102  -0.645  -3.074
  190    HB3  CYS  33           1HB      CYS  33   2.386   0.933  -3.360
  191    HA   PRO  34           HA       PRO  34  -1.122   0.579  -7.528
  192    HB2  PRO  34           2HB      PRO  34  -3.222  -1.117  -6.928
  193    HB3  PRO  34           1HB      PRO  34  -2.025  -1.418  -8.191
  194    HG2  PRO  34           2HG      PRO  34  -2.154  -2.490  -5.406
  195    HG3  PRO  34           1HG      PRO  34  -1.685  -3.313  -6.901
  196    HD2  PRO  34           2HD      PRO  34   0.128  -2.477  -5.130
  197    HD3  PRO  34           1HD      PRO  34   0.452  -2.411  -6.876
  198    H    CYS  35           H        CYS  35  -1.533  -0.251  -4.220
  199    HA   CYS  35           HA       CYS  35  -3.871   1.255  -3.634
  200    HB2  CYS  35           2HB      CYS  35  -1.579   0.531  -1.815
  201    HB3  CYS  35           1HB      CYS  35  -3.189   1.028  -1.307
  202    H    TYR  36           H        TYR  36  -0.489   1.873  -2.842
  203    HA   TYR  36           HA       TYR  36  -0.635   4.494  -1.994
  204    HB2  TYR  36           2HB      TYR  36   1.346   3.159  -1.659
  205    HB3  TYR  36           1HB      TYR  36   1.564   2.969  -3.386
  206    HD1  TYR  36           2HD      TYR  36   2.426   4.829  -4.740
  207    HD2  TYR  36           1HD      TYR  36   2.133   5.144  -0.513
  208    HE1  TYR  36           2HE      TYR  36   3.930   6.713  -4.822
  209    HE2  TYR  36           1HE      TYR  36   3.669   7.062  -0.544
  210    HH   TYR  36           HH       TYR  36   4.435   8.693  -3.393
  211    H    LYS  37           H        LYS  37  -0.086   3.207  -5.221
  212    HA   LYS  37           HA       LYS  37   0.394   5.679  -6.468
  213    HB2  LYS  37           2HB      LYS  37   0.929   3.256  -7.225
  214    HB3  LYS  37           1HB      LYS  37  -0.692   3.284  -7.900
  215    HG2  LYS  37           2HG      LYS  37  -0.043   5.317  -9.188
  216    HG3  LYS  37           1HG      LYS  37   1.594   5.085  -8.559
  217    HD2  LYS  37           2HD      LYS  37   1.696   2.873  -9.592
  218    HD3  LYS  37           1HD      LYS  37   0.063   3.073 -10.217
  219    HE2  LYS  37           2HE      LYS  37   1.542   3.557 -12.011
  220    HE3  LYS  37           1HE      LYS  37   0.909   5.099 -11.454
  221    HZ1  LYS  37           3HZ      LYS  37   3.255   5.235 -11.847
  222    HZ2  LYS  37           1HZ      LYS  37   3.550   3.949 -10.805
  223    HZ3  LYS  37           2HZ      LYS  37   2.968   5.435 -10.203
  224    H    SER  38           H        SER  38  -2.538   4.003  -5.628
  225    HA   SER  38           HA       SER  38  -4.151   5.879  -7.205
  226    HB2  SER  38           2HB      SER  38  -4.988   3.388  -5.712
  227    HB3  SER  38           1HB      SER  38  -6.027   4.369  -6.741
  228    HG   SER  38           HG       SER  38  -3.882   2.699  -7.418
  229    H    TYR  39           H        TYR  39  -2.655   6.162  -4.496
  230    HA   TYR  39           HA       TYR  39  -2.831   7.445  -2.651
  231    HB2  TYR  39           2HB      TYR  39  -5.479   8.326  -3.832
  232    HB3  TYR  39           1HB      TYR  39  -4.658   9.117  -2.491
  233    HD1  TYR  39           1HD      TYR  39  -4.675   8.549  -6.107
  234    HD2  TYR  39           2HD      TYR  39  -2.679  10.487  -2.894
  235    HE1  TYR  39           1HE      TYR  39  -3.457   9.942  -7.714
  236    HE2  TYR  39           2HE      TYR  39  -1.461  11.892  -4.499
  237    HH   TYR  39           HH       TYR  39  -2.370  12.103  -7.720
  238    H    ASN  40           H        ASN  40  -3.982   4.726  -2.755
  239    HA   ASN  40           HA       ASN  40  -6.010   4.933  -0.667
  240    HB2  ASN  40           2HB      ASN  40  -5.533   2.912  -2.783
  241    HB3  ASN  40           1HB      ASN  40  -6.231   2.376  -1.257
  242   HD21  ASN  40          1HD2      ASN  40  -6.702   4.367  -4.078
  243   HD22  ASN  40          2HD2      ASN  40  -8.384   4.585  -3.871
  244    H    SER  41           H        SER  41  -6.078   3.289   0.919
  245    HA   SER  41           HA       SER  41  -3.540   2.870   2.197
  246    HB2  SER  41           2HB      SER  41  -5.103   2.178   4.006
  247    HB3  SER  41           1HB      SER  41  -5.303   3.845   3.455
  248    HG   SER  41           HG       SER  41  -7.143   2.238   3.726
  249    H    CYS  42           H        CYS  42  -3.355   0.756   3.337
  250    HA   CYS  42           HA       CYS  42  -4.128  -1.357   1.528
  251    HB2  CYS  42           2HB      CYS  42  -1.843  -1.170   3.464
  252    HB3  CYS  42           1HB      CYS  42  -2.326  -2.696   2.713
  253    H    ALA  43           H        ALA  43  -6.163  -1.089   2.472
  254    HA   ALA  43           HA       ALA  43  -6.460  -2.724   4.900
  255    HB1  ALA  43           1HB      ALA  43  -8.400  -0.759   3.662
  256    HB2  ALA  43           2HB      ALA  43  -7.473  -0.520   5.148
  257    HB3  ALA  43           3HB      ALA  43  -8.728  -1.753   5.080
  258    H    GLY  44           H        GLY  44  -6.917  -4.741   4.425
  259    HA2  GLY  44           2HA      GLY  44  -8.251  -6.431   3.463
  260    HA3  GLY  44           1HA      GLY  44  -8.696  -5.313   2.168
  261    H    CYS  45           H        CYS  45  -5.467  -5.238   2.991
  262    HA   CYS  45           HA       CYS  45  -4.757  -6.601   0.505
  263    HB2  CYS  45           2HB      CYS  45  -3.119  -4.849   2.331
  264    HB3  CYS  45           1HB      CYS  45  -2.548  -5.566   0.832
  265    H    HIS  46           H        HIS  46  -2.765  -7.912   0.593
  266    HA   HIS  46           HA       HIS  46  -2.527  -9.260   3.178
  267    HB2  HIS  46           2HB      HIS  46  -2.415 -10.519   0.423
  268    HB3  HIS  46           1HB      HIS  46  -2.031 -11.365   1.920
  269    HD1  HIS  46           1HD      HIS  46  -4.051 -11.872   3.543
  270    HD2  HIS  46           2HD      HIS  46  -5.118 -10.207  -0.100
  271    HE1  HIS  46           1HE      HIS  46  -6.534 -12.130   3.379
  272    HE2  HIS  46           2HE      HIS  46  -7.169 -10.966   1.261
  273    H    CYS  47           H        CYS  47  -1.209  -7.041   2.110
  274    HA   CYS  47           HA       CYS  47   1.339  -7.731   1.116
  275    HB2  CYS  47           2HB      CYS  47   1.858  -5.300   1.579
  276    HB3  CYS  47           1HB      CYS  47   0.524  -5.602   0.480
  277    H    VAL  48           H        VAL  48   3.281  -7.679   2.072
  278    HA   VAL  48           HA       VAL  48   3.333  -8.015   4.995
  279    HB   VAL  48           HB       VAL  48   5.169  -9.237   2.899
  280   HG11  VAL  48          1HG1      VAL  48   6.322  -8.858   5.002
  281   HG12  VAL  48          2HG1      VAL  48   6.079 -10.582   4.716
  282   HG13  VAL  48          3HG1      VAL  48   5.055  -9.731   5.868
  283   HG21  VAL  48          3HG2      VAL  48   2.958 -10.257   2.808
  284   HG22  VAL  48          1HG2      VAL  48   3.015 -10.561   4.545
  285   HG23  VAL  48          2HG2      VAL  48   4.141 -11.388   3.463
  286    H    GLY  49           H        GLY  49   4.570  -6.548   6.028
  287    HA2  GLY  49           2HA      GLY  49   6.254  -4.977   6.409
  288    HA3  GLY  49           1HA      GLY  49   6.927  -5.382   4.827
  289    H    CYS  50           H        CYS  50   3.768  -4.162   5.851
  290    HA   CYS  50           HA       CYS  50   3.862  -2.400   3.600
  291    HB2  CYS  50           2HB      CYS  50   1.866  -3.628   3.749
  292    HB3  CYS  50           1HB      CYS  50   1.664  -3.238   5.455
  293    H    LYS  51           H        LYS  51   4.913  -0.562   4.060
  294    HA   LYS  51           HA       LYS  51   3.796   0.964   6.293
  295    HB2  LYS  51           2HB      LYS  51   6.352   1.440   4.722
  296    HB3  LYS  51           1HB      LYS  51   5.758   2.476   6.001
  297    HG2  LYS  51           2HG      LYS  51   6.400  -0.403   6.506
  298    HG3  LYS  51           1HG      LYS  51   7.664   0.813   6.470
  299    HD2  LYS  51           2HD      LYS  51   6.972   0.323   8.770
  300    HD3  LYS  51           1HD      LYS  51   6.599   1.983   8.354
  301    HE2  LYS  51           2HE      LYS  51   4.441  -0.034   8.001
  302    HE3  LYS  51           1HE      LYS  51   4.905   0.358   9.647
  303    HZ1  LYS  51           3HZ      LYS  51   3.078   1.732   8.858
  304    HZ2  LYS  51           1HZ      LYS  51   4.010   2.389   7.624
  305    HZ3  LYS  51           2HZ      LYS  51   4.403   2.664   9.235
  306    H    ASN  52           H        ASN  52   1.972   1.559   5.276
  307    HA   ASN  52           HA       ASN  52   2.316   3.056   2.793
  308    HB2  ASN  52           2HB      ASN  52   0.671   1.170   2.782
  309    HB3  ASN  52           1HB      ASN  52  -0.262   1.980   4.021
  310   HD21  ASN  52          1HD2      ASN  52  -1.160   1.212   1.436
  311   HD22  ASN  52          2HD2      ASN  52  -1.641   2.654   0.602
  312    HA   PRO  53           HA       PRO  53   1.998   6.682   5.457
  313    HB2  PRO  53           2HB      PRO  53   1.668   7.987   2.811
  314    HB3  PRO  53           1HB      PRO  53   2.817   8.352   4.104
  315    HG2  PRO  53           2HG      PRO  53   3.595   7.132   1.868
  316    HG3  PRO  53           1HG      PRO  53   4.280   6.691   3.438
  317    HD2  PRO  53           2HD      PRO  53   2.249   5.252   1.786
  318    HD3  PRO  53           1HD      PRO  53   3.563   4.612   2.802
  319    H    HIS  54           H        HIS  54  -0.248   5.590   3.059
  320    HA   HIS  54           HA       HIS  54  -2.221   7.622   3.700
  321    HB2  HIS  54           2HB      HIS  54  -2.471   5.205   1.886
  322    HB3  HIS  54           1HB      HIS  54  -3.682   6.463   2.076
  323    HD1  HIS  54           1HD      HIS  54  -3.351   8.600   0.718
  324    HD2  HIS  54           2HD      HIS  54  -0.188   5.942   0.438
  325    HE1  HIS  54           1HE      HIS  54  -1.929   9.451  -1.156
  326    HE2  HIS  54           2HE      HIS  54   0.122   8.072  -1.000
  327    H    LYS  55           H        LYS  55  -2.674   7.238   5.770
  328    HA   LYS  55           HA       LYS  55  -3.759   4.627   6.449
  329    HB2  LYS  55           2HB      LYS  55  -2.108   5.724   7.998
  330    HB3  LYS  55           1HB      LYS  55  -3.214   7.052   8.219
  331    HG2  LYS  55           2HG      LYS  55  -3.931   4.222   9.005
  332    HG3  LYS  55           1HG      LYS  55  -3.027   5.281  10.076
  333    HD2  LYS  55           2HD      LYS  55  -5.798   5.805   8.982
  334    HD3  LYS  55           1HD      LYS  55  -5.423   5.266  10.620
  335    HE2  LYS  55           2HE      LYS  55  -4.139   7.353  10.971
  336    HE3  LYS  55           1HE      LYS  55  -4.596   7.876   9.350
  337    HZ1  LYS  55           3HZ      LYS  55  -6.377   7.501  11.692
  338    HZ2  LYS  55           1HZ      LYS  55  -6.939   7.679  10.097
  339    HZ3  LYS  55           2HZ      LYS  55  -6.050   8.902  10.804
  340    H    GLU  56           H        GLU  56  -5.564   4.658   5.285
  341    HA   GLU  56           HA       GLU  56  -7.408   6.911   5.472
  342    HB2  GLU  56           2HB      GLU  56  -6.828   5.977   3.260
  343    HB3  GLU  56           1HB      GLU  56  -7.494   4.435   3.756
  344    HG2  GLU  56           2HG      GLU  56  -9.698   5.556   4.015
  345    HG3  GLU  56           1HG      GLU  56  -8.967   7.011   3.329
  346    H    ASP  57           H        ASP  57  -8.048   6.567   7.537
  347    HA   ASP  57           HA       ASP  57 -10.271   4.888   8.028
  348    HB2  ASP  57           2HB      ASP  57  -8.308   3.244   8.245
  349    HB3  ASP  57           1HB      ASP  57  -7.736   4.351   9.497
  350    H    TYR  58           H        TYR  58 -11.298   6.355   9.208
  351    HA   TYR  58           HA       TYR  58  -9.695   8.434  10.335
  352    HB2  TYR  58           2HB      TYR  58 -11.912   9.624  10.864
  353    HB3  TYR  58           1HB      TYR  58 -11.426   9.457   9.188
  354    HD1  TYR  58           2HD      TYR  58 -13.827   8.370  11.753
  355    HD2  TYR  58           1HD      TYR  58 -12.685   8.078   7.667
  356    HE1  TYR  58           2HE      TYR  58 -16.009   7.367  11.218
  357    HE2  TYR  58           1HE      TYR  58 -14.859   7.084   7.123
  358    HH   TYR  58           HH       TYR  58 -17.467   7.108   9.279
  359    H    VAL  59           H        VAL  59  -8.763   7.073  11.719
  360    HA   VAL  59           HA       VAL  59  -9.849   7.387  14.394
  361    HB   VAL  59           HB       VAL  59  -8.119   5.060  13.430
  362   HG11  VAL  59          1HG1      VAL  59  -8.466   4.136  15.679
  363   HG12  VAL  59          2HG1      VAL  59  -9.352   5.591  16.131
  364   HG13  VAL  59          3HG1      VAL  59  -7.640   5.694  15.722
  365   HG21  VAL  59          3HG2      VAL  59 -10.042   3.597  13.900
  366   HG22  VAL  59          1HG2      VAL  59 -10.417   4.766  12.632
  367   HG23  VAL  59          2HG2      VAL  59 -11.026   5.006  14.272
  Start of MODEL    3
    1    H1   SER   8           1HT      SER   8 -15.381   8.740  -0.799
    2    H2   SER   8           2HT      SER   8 -15.996   7.164  -0.739
    3    H3   SER   8           3HT      SER   8 -15.933   7.988  -2.217
    4    HA   SER   8           HA       SER   8 -13.573   8.010  -2.120
    5    HB2  SER   8           2HB      SER   8 -14.024   6.380   0.394
    6    HB3  SER   8           1HB      SER   8 -12.453   6.763  -0.323
    7    HG   SER   8           HG       SER   8 -13.414   8.201   1.477
    8    HA   PRO   9           HA       PRO   9 -14.275   4.337  -4.496
    9    HB2  PRO   9           2HB      PRO   9 -11.785   3.750  -5.339
   10    HB3  PRO   9           1HB      PRO   9 -12.625   5.204  -5.893
   11    HG2  PRO   9           2HG      PRO   9 -10.557   4.922  -3.745
   12    HG3  PRO   9           1HG      PRO   9 -10.673   6.139  -5.031
   13    HD2  PRO   9           2HD      PRO   9 -11.499   6.597  -2.481
   14    HD3  PRO   9           1HD      PRO   9 -12.245   7.372  -3.887
   15    HA   PRO  10           HA       PRO  10 -13.466   0.621  -2.097
   16    HB2  PRO  10           2HB      PRO  10 -12.704  -0.733  -4.629
   17    HB3  PRO  10           1HB      PRO  10 -13.961  -1.168  -3.465
   18    HG2  PRO  10           2HG      PRO  10 -14.602  -0.110  -5.824
   19    HG3  PRO  10           1HG      PRO  10 -15.485   0.342  -4.352
   20    HD2  PRO  10           2HD      PRO  10 -13.356   1.845  -5.820
   21    HD3  PRO  10           1HD      PRO  10 -14.859   2.435  -5.076
   22    H    LYS  11           H        LYS  11 -11.745  -0.596  -1.327
   23    HA   LYS  11           HA       LYS  11  -9.180   0.623  -1.588
   24    HB2  LYS  11           2HB      LYS  11  -9.945  -1.909  -0.155
   25    HB3  LYS  11           1HB      LYS  11  -8.477  -0.980   0.081
   26    HG2  LYS  11           2HG      LYS  11 -11.235   0.072   0.622
   27    HG3  LYS  11           1HG      LYS  11 -10.202  -0.653   1.849
   28    HD2  LYS  11           2HD      LYS  11  -8.542   1.105   1.451
   29    HD3  LYS  11           1HD      LYS  11  -9.582   1.796   0.199
   30    HE2  LYS  11           2HE      LYS  11 -11.314   2.214   1.824
   31    HE3  LYS  11           1HE      LYS  11 -10.354   1.439   3.082
   32    HZ1  LYS  11           3HZ      LYS  11  -9.598   3.906   1.623
   33    HZ2  LYS  11           1HZ      LYS  11  -8.703   3.158   2.840
   34    HZ3  LYS  11           2HZ      LYS  11 -10.215   3.845   3.171
   35    HA   PRO  12           HA       PRO  12  -7.714  -2.308  -4.736
   36    HB2  PRO  12           2HB      PRO  12  -5.171  -0.887  -4.371
   37    HB3  PRO  12           1HB      PRO  12  -6.146  -1.042  -5.833
   38    HG2  PRO  12           2HG      PRO  12  -5.898   1.302  -4.495
   39    HG3  PRO  12           1HG      PRO  12  -7.372   0.856  -5.371
   40    HD2  PRO  12           2HD      PRO  12  -6.811   0.730  -2.427
   41    HD3  PRO  12           1HD      PRO  12  -8.288   1.221  -3.295
   42    H    LYS  13           H        LYS  13  -6.424  -4.124  -4.435
   43    HA   LYS  13           HA       LYS  13  -5.330  -4.358  -1.718
   44    HB2  LYS  13           2HB      LYS  13  -6.212  -6.679  -3.467
   45    HB3  LYS  13           1HB      LYS  13  -5.843  -6.667  -1.742
   46    HG2  LYS  13           2HG      LYS  13  -8.202  -5.266  -2.990
   47    HG3  LYS  13           1HG      LYS  13  -8.263  -6.834  -2.192
   48    HD2  LYS  13           2HD      LYS  13  -7.574  -5.828  -0.093
   49    HD3  LYS  13           1HD      LYS  13  -7.364  -4.267  -0.884
   50    HE2  LYS  13           2HE      LYS  13  -9.453  -4.379   0.379
   51    HE3  LYS  13           1HE      LYS  13  -9.740  -4.145  -1.340
   52    HZ1  LYS  13           3HZ      LYS  13  -9.988  -6.729   0.118
   53    HZ2  LYS  13           1HZ      LYS  13 -10.280  -6.516  -1.518
   54    HZ3  LYS  13           2HZ      LYS  13 -11.256  -5.760  -0.371
   55    H    CYS  14           H        CYS  14  -3.241  -4.884  -1.510
   56    HA   CYS  14           HA       CYS  14  -1.801  -5.521  -3.975
   57    HB2  CYS  14           2HB      CYS  14   0.136  -4.251  -3.046
   58    HB3  CYS  14           1HB      CYS  14  -1.266  -3.255  -3.398
   59    H    ARG  15           H        ARG  15   0.276  -6.588  -3.614
   60    HA   ARG  15           HA       ARG  15   0.194  -8.476  -1.354
   61    HB2  ARG  15           2HB      ARG  15   0.737  -9.040  -4.282
   62    HB3  ARG  15           1HB      ARG  15   0.974 -10.207  -2.989
   63    HG2  ARG  15           2HG      ARG  15  -1.378 -10.196  -2.483
   64    HG3  ARG  15           1HG      ARG  15  -1.661  -8.914  -3.660
   65    HD2  ARG  15           2HD      ARG  15  -0.973 -10.401  -5.447
   66    HD3  ARG  15           1HD      ARG  15  -0.646 -11.686  -4.284
   67    HE   ARG  15           HE       ARG  15  -3.285 -10.742  -4.007
   68   HH11  ARG  15          1HH1      ARG  15  -1.311 -12.673  -6.203
   69   HH12  ARG  15          2HH1      ARG  15  -2.588 -13.675  -6.711
   70   HH21  ARG  15          1HH2      ARG  15  -5.064 -12.103  -4.716
   71   HH22  ARG  15          2HH2      ARG  15  -4.782 -13.303  -5.888
   72    H    CYS  16           H        CYS  16   1.579  -6.062  -1.654
   73    HA   CYS  16           HA       CYS  16   4.194  -6.153  -2.565
   74    HB2  CYS  16           2HB      CYS  16   3.125  -4.612  -0.196
   75    HB3  CYS  16           1HB      CYS  16   4.618  -4.284  -1.066
   76    H    GLY  17           H        GLY  17   5.936  -7.114  -1.889
   77    HA2  GLY  17           2HA      GLY  17   7.481  -7.593  -0.082
   78    HA3  GLY  17           1HA      GLY  17   6.091  -7.987   0.915
   79    H    ILE  18           H        ILE  18   4.743  -9.492  -1.137
   80    HA   ILE  18           HA       ILE  18   6.219 -11.945  -0.704
   81    HB   ILE  18           HB       ILE  18   3.488 -11.605  -1.979
   82   HG12  ILE  18          2HG1      ILE  18   4.283 -12.173   0.886
   83   HG13  ILE  18          1HG1      ILE  18   3.529 -10.713   0.289
   84   HG21  ILE  18          1HG2      ILE  18   3.222 -13.999  -1.420
   85   HG22  ILE  18          2HG2      ILE  18   4.867 -14.034  -0.799
   86   HG23  ILE  18          3HG2      ILE  18   4.582 -13.747  -2.516
   87   HD11  ILE  18          3HD1      ILE  18   2.263 -13.437   0.290
   88   HD12  ILE  18          1HD1      ILE  18   1.515 -11.943  -0.276
   89   HD13  ILE  18          2HD1      ILE  18   1.929 -12.133   1.430
   90    H    SER  19           H        SER  19   4.696 -10.321  -3.445
   91    HA   SER  19           HA       SER  19   6.797 -11.402  -5.166
   92    HB2  SER  19           2HB      SER  19   5.005 -11.831  -6.904
   93    HB3  SER  19           1HB      SER  19   4.941 -12.890  -5.491
   94    HG   SER  19           HG       SER  19   2.981 -12.245  -5.304
   95    H    GLY  20           H        GLY  20   4.053  -9.173  -4.902
   96    HA2  GLY  20           2HA      GLY  20   5.051  -7.424  -6.939
   97    HA3  GLY  20           1HA      GLY  20   3.679  -7.133  -5.871
   98    H    SER  21           H        SER  21   6.003  -5.483  -6.676
   99    HA   SER  21           HA       SER  21   7.300  -3.890  -5.843
  100    HB2  SER  21           2HB      SER  21   6.046  -4.555  -3.170
  101    HB3  SER  21           1HB      SER  21   7.031  -3.128  -3.505
  102    HG   SER  21           HG       SER  21   4.728  -3.792  -4.981
  103    H    SER  22           H        SER  22   9.359  -4.043  -5.836
  104    HA   SER  22           HA       SER  22  10.683  -6.339  -4.770
  105    HB2  SER  22           2HB      SER  22  11.791  -3.844  -6.057
  106    HB3  SER  22           1HB      SER  22  12.623  -5.394  -5.864
  107    HG   SER  22           HG       SER  22  10.374  -5.979  -6.981
  108    H    ASN  23           H        ASN  23  10.172  -2.988  -3.963
  109    HA   ASN  23           HA       ASN  23  12.021  -2.846  -1.827
  110    HB2  ASN  23           2HB      ASN  23   9.463  -1.318  -2.328
  111    HB3  ASN  23           1HB      ASN  23  10.516  -1.038  -0.952
  112   HD21  ASN  23          1HD2      ASN  23  12.504  -0.023  -1.292
  113   HD22  ASN  23          2HD2      ASN  23  12.868   0.806  -2.757
  114    H    THR  24           H        THR  24  11.959  -4.186  -0.194
  115    HA   THR  24           HA       THR  24   9.445  -5.455   0.489
  116    HB   THR  24           HB       THR  24  12.152  -6.047   1.675
  117    HG1  THR  24           1HG      THR  24  11.447  -6.094  -0.894
  118   HG21  THR  24          3HG2      THR  24   9.723  -7.767   1.069
  119   HG22  THR  24          1HG2      THR  24  10.171  -7.170   2.668
  120   HG23  THR  24          2HG2      THR  24  11.209  -8.328   1.833
  121    H    LEU  25           H        LEU  25  11.432  -2.927   1.593
  122    HA   LEU  25           HA       LEU  25  10.081  -2.895   4.202
  123    HB2  LEU  25           2HB      LEU  25  12.468  -1.299   3.257
  124    HB3  LEU  25           1HB      LEU  25  11.790  -1.272   4.872
  125    HG   LEU  25           HG       LEU  25  13.114  -3.654   3.573
  126   HD11  LEU  25          1HD1      LEU  25  14.702  -1.897   4.113
  127   HD12  LEU  25          2HD1      LEU  25  14.898  -3.287   5.179
  128   HD13  LEU  25          3HD1      LEU  25  14.084  -1.835   5.764
  129   HD21  LEU  25          3HD2      LEU  25  12.975  -4.669   5.810
  130   HD22  LEU  25          1HD2      LEU  25  11.376  -4.343   5.140
  131   HD23  LEU  25          2HD2      LEU  25  12.046  -3.280   6.375
  132    H    THR  26           H        THR  26  10.670  -1.126   1.269
  133    HA   THR  26           HA       THR  26   8.887   1.061   2.055
  134    HB   THR  26           HB       THR  26  10.395   0.801  -0.563
  135    HG1  THR  26           1HG      THR  26  11.369   1.566   1.993
  136   HG21  THR  26          3HG2      THR  26  10.527   3.254  -0.310
  137   HG22  THR  26          1HG2      THR  26   9.615   3.130   1.191
  138   HG23  THR  26          2HG2      THR  26   8.857   2.678  -0.335
  139    H    THR  27           H        THR  27   7.848  -1.540   1.712
  140    HA   THR  27           HA       THR  27   7.070  -2.622  -0.633
  141    HB   THR  27           HB       THR  27   4.990  -3.172   0.871
  142    HG1  THR  27           1HG      THR  27   6.202  -2.969   3.137
  143   HG21  THR  27          3HG2      THR  27   6.774  -4.774   0.276
  144   HG22  THR  27          1HG2      THR  27   6.319  -4.927   1.973
  145   HG23  THR  27          2HG2      THR  27   7.800  -4.079   1.534
  146    H    CYS  28           H        CYS  28   4.950  -0.696   1.337
  147    HA   CYS  28           HA       CYS  28   3.293  -0.245  -0.956
  148    HB2  CYS  28           2HB      CYS  28   2.750   0.234   1.943
  149    HB3  CYS  28           1HB      CYS  28   1.616   0.597   0.643
  150    H    ARG  29           H        ARG  29   5.799   1.355   0.181
  151    HA   ARG  29           HA       ARG  29   4.587   3.973  -0.381
  152    HB2  ARG  29           2HB      ARG  29   5.701   3.525   1.893
  153    HB3  ARG  29           1HB      ARG  29   7.227   3.582   1.023
  154    HG2  ARG  29           2HG      ARG  29   6.781   5.865   0.325
  155    HG3  ARG  29           1HG      ARG  29   5.196   5.795   1.067
  156    HD2  ARG  29           2HD      ARG  29   6.240   5.460   3.268
  157    HD3  ARG  29           1HD      ARG  29   7.832   5.610   2.523
  158    HE   ARG  29           HE       ARG  29   6.597   7.873   1.752
  159   HH11  ARG  29          1HH1      ARG  29   7.142   6.424   4.930
  160   HH12  ARG  29          2HH1      ARG  29   7.074   7.895   5.771
  161   HH21  ARG  29          1HH2      ARG  29   6.500   9.887   2.896
  162   HH22  ARG  29          2HH2      ARG  29   6.684   9.916   4.595
  163    H    ASN  30           H        ASN  30   5.505   2.045  -2.372
  164    HA   ASN  30           HA       ASN  30   7.332   3.872  -3.712
  165    HB2  ASN  30           2HB      ASN  30   8.627   2.134  -4.742
  166    HB3  ASN  30           1HB      ASN  30   8.580   1.758  -3.024
  167   HD21  ASN  30          1HD2      ASN  30   7.432  -0.041  -2.360
  168   HD22  ASN  30          2HD2      ASN  30   6.860  -1.234  -3.462
  169    H    SER  31           H        SER  31   7.312   3.414  -6.149
  170    HA   SER  31           HA       SER  31   4.782   4.163  -6.975
  171    HB2  SER  31           2HB      SER  31   7.131   3.273  -8.626
  172    HB3  SER  31           1HB      SER  31   5.793   4.306  -9.143
  173    HG   SER  31           HG       SER  31   6.419   5.833  -7.671
  174    H    ARG  32           H        ARG  32   5.968   0.937  -6.577
  175    HA   ARG  32           HA       ARG  32   4.312  -0.073  -8.741
  176    HB2  ARG  32           2HB      ARG  32   6.008  -1.620  -6.779
  177    HB3  ARG  32           1HB      ARG  32   5.226  -2.265  -8.212
  178    HG2  ARG  32           2HG      ARG  32   7.426  -0.216  -8.180
  179    HG3  ARG  32           1HG      ARG  32   7.624  -1.927  -8.536
  180    HD2  ARG  32           2HD      ARG  32   6.207  -1.684 -10.520
  181    HD3  ARG  32           1HD      ARG  32   5.968   0.024 -10.141
  182    HE   ARG  32           HE       ARG  32   8.705  -0.509 -10.264
  183   HH11  ARG  32          1HH1      ARG  32   5.974  -0.386 -12.541
  184   HH12  ARG  32          2HH1      ARG  32   6.908   0.144 -13.851
  185   HH21  ARG  32          1HH2      ARG  32   9.986   0.194 -12.110
  186   HH22  ARG  32          2HH2      ARG  32   9.236   0.450 -13.613
  187    H    CYS  33           H        CYS  33   3.664   0.893  -5.673
  188    HA   CYS  33           HA       CYS  33   1.891  -1.328  -5.094
  189    HB2  CYS  33           2HB      CYS  33   3.159  -0.442  -3.209
  190    HB3  CYS  33           1HB      CYS  33   2.484   1.161  -3.471
  191    HA   PRO  34           HA       PRO  34  -1.373   0.743  -7.328
  192    HB2  PRO  34           2HB      PRO  34  -3.408  -0.925  -6.460
  193    HB3  PRO  34           1HB      PRO  34  -2.348  -1.265  -7.831
  194    HG2  PRO  34           2HG      PRO  34  -2.211  -2.267  -5.029
  195    HG3  PRO  34           1HG      PRO  34  -1.868  -3.124  -6.542
  196    HD2  PRO  34           2HD      PRO  34   0.081  -2.213  -4.926
  197    HD3  PRO  34           1HD      PRO  34   0.277  -2.250  -6.690
  198    H    CYS  35           H        CYS  35  -1.582  -0.041  -3.916
  199    HA   CYS  35           HA       CYS  35  -3.796   1.611  -3.269
  200    HB2  CYS  35           2HB      CYS  35  -1.454   0.730  -1.587
  201    HB3  CYS  35           1HB      CYS  35  -2.844   1.596  -0.950
  202    H    TYR  36           H        TYR  36  -0.356   2.098  -2.937
  203    HA   TYR  36           HA       TYR  36  -0.254   4.690  -2.012
  204    HB2  TYR  36           2HB      TYR  36   1.657   3.220  -2.041
  205    HB3  TYR  36           1HB      TYR  36   1.622   3.157  -3.795
  206    HD1  TYR  36           2HD      TYR  36   2.389   5.283  -0.890
  207    HD2  TYR  36           1HD      TYR  36   2.644   4.845  -5.110
  208    HE1  TYR  36           2HE      TYR  36   3.958   7.139  -0.968
  209    HE2  TYR  36           1HE      TYR  36   4.214   6.683  -5.240
  210    HH   TYR  36           HH       TYR  36   4.822   8.689  -3.859
  211    H    LYS  37           H        LYS  37  -0.077   3.557  -5.359
  212    HA   LYS  37           HA       LYS  37   0.254   6.148  -6.442
  213    HB2  LYS  37           2HB      LYS  37   0.984   3.900  -7.392
  214    HB3  LYS  37           1HB      LYS  37  -0.674   3.708  -7.928
  215    HG2  LYS  37           2HG      LYS  37  -0.468   5.759  -9.262
  216    HG3  LYS  37           1HG      LYS  37   1.209   5.899  -8.707
  217    HD2  LYS  37           2HD      LYS  37   1.742   3.748  -9.716
  218    HD3  LYS  37           1HD      LYS  37   0.077   3.574 -10.267
  219    HE2  LYS  37           2HE      LYS  37   0.334   5.581 -11.640
  220    HE3  LYS  37           1HE      LYS  37   2.003   5.740 -11.098
  221    HZ1  LYS  37           3HZ      LYS  37   1.868   4.678 -13.256
  222    HZ2  LYS  37           1HZ      LYS  37   0.884   3.462 -12.635
  223    HZ3  LYS  37           2HZ      LYS  37   2.490   3.588 -12.131
  224    H    SER  38           H        SER  38  -2.549   4.217  -5.696
  225    HA   SER  38           HA       SER  38  -4.329   6.024  -7.137
  226    HB2  SER  38           2HB      SER  38  -4.686   3.542  -7.229
  227    HB3  SER  38           1HB      SER  38  -4.963   3.543  -5.498
  228    HG   SER  38           HG       SER  38  -6.741   3.730  -7.255
  229    H    TYR  39           H        TYR  39  -2.726   6.076  -4.332
  230    HA   TYR  39           HA       TYR  39  -2.782   7.248  -2.440
  231    HB2  TYR  39           2HB      TYR  39  -5.133   8.699  -3.690
  232    HB3  TYR  39           1HB      TYR  39  -4.175   9.272  -2.323
  233    HD1  TYR  39           1HD      TYR  39  -1.593   9.465  -2.780
  234    HD2  TYR  39           2HD      TYR  39  -4.563   9.393  -5.813
  235    HE1  TYR  39           1HE      TYR  39  -0.012  10.500  -4.348
  236    HE2  TYR  39           2HE      TYR  39  -2.995  10.430  -7.385
  237    HH   TYR  39           HH       TYR  39  -1.001  11.842  -7.237
  238    H    ASN  40           H        ASN  40  -4.140   4.786  -2.474
  239    HA   ASN  40           HA       ASN  40  -6.239   5.240  -0.469
  240    HB2  ASN  40           2HB      ASN  40  -5.989   3.094  -2.547
  241    HB3  ASN  40           1HB      ASN  40  -6.856   2.778  -1.048
  242   HD21  ASN  40          1HD2      ASN  40  -6.860   4.592  -4.048
  243   HD22  ASN  40          2HD2      ASN  40  -8.480   5.120  -3.914
  244    H    SER  41           H        SER  41  -6.474   3.469   1.136
  245    HA   SER  41           HA       SER  41  -3.891   2.840   2.277
  246    HB2  SER  41           2HB      SER  41  -5.598   2.318   4.196
  247    HB3  SER  41           1HB      SER  41  -5.126   3.976   3.819
  248    HG   SER  41           HG       SER  41  -7.243   4.035   3.864
  249    H    CYS  42           H        CYS  42  -3.825   0.848   3.619
  250    HA   CYS  42           HA       CYS  42  -4.479  -1.335   1.853
  251    HB2  CYS  42           2HB      CYS  42  -2.452  -1.091   4.042
  252    HB3  CYS  42           1HB      CYS  42  -2.835  -2.628   3.263
  253    H    ALA  43           H        ALA  43  -6.564  -1.120   2.572
  254    HA   ALA  43           HA       ALA  43  -7.053  -2.754   4.987
  255    HB1  ALA  43           1HB      ALA  43  -9.431  -2.100   4.779
  256    HB2  ALA  43           2HB      ALA  43  -9.015  -1.123   3.365
  257    HB3  ALA  43           3HB      ALA  43  -8.354  -0.718   4.951
  258    H    GLY  44           H        GLY  44  -6.974  -4.849   4.533
  259    HA2  GLY  44           2HA      GLY  44  -8.036  -6.815   3.756
  260    HA3  GLY  44           1HA      GLY  44  -8.747  -5.883   2.448
  261    H    CYS  45           H        CYS  45  -5.485  -5.283   2.914
  262    HA   CYS  45           HA       CYS  45  -4.849  -6.482   0.368
  263    HB2  CYS  45           2HB      CYS  45  -3.149  -4.880   2.274
  264    HB3  CYS  45           1HB      CYS  45  -2.653  -5.404   0.669
  265    H    HIS  46           H        HIS  46  -2.682  -7.648   0.181
  266    HA   HIS  46           HA       HIS  46  -2.580  -9.683   2.320
  267    HB2  HIS  46           2HB      HIS  46  -3.396 -10.163  -0.145
  268    HB3  HIS  46           1HB      HIS  46  -1.683 -10.108  -0.513
  269    HD1  HIS  46           1HD      HIS  46  -4.238 -12.414   0.230
  270    HD2  HIS  46           2HD      HIS  46  -0.249 -12.116   1.294
  271    HE1  HIS  46           1HE      HIS  46  -3.558 -14.718   0.924
  272    HE2  HIS  46           2HE      HIS  46  -1.103 -14.549   1.372
  273    H    CYS  47           H        CYS  47  -1.157  -7.050   1.560
  274    HA   CYS  47           HA       CYS  47   1.537  -7.754   0.963
  275    HB2  CYS  47           2HB      CYS  47   1.981  -5.328   1.475
  276    HB3  CYS  47           1HB      CYS  47   0.836  -5.642   0.181
  277    H    VAL  48           H        VAL  48   3.319  -7.682   2.242
  278    HA   VAL  48           HA       VAL  48   2.752  -8.085   5.108
  279    HB   VAL  48           HB       VAL  48   5.053  -9.246   3.515
  280   HG11  VAL  48          1HG1      VAL  48   4.052  -9.888   6.284
  281   HG12  VAL  48          2HG1      VAL  48   5.537  -9.027   5.879
  282   HG13  VAL  48          3HG1      VAL  48   5.357 -10.726   5.444
  283   HG21  VAL  48          3HG2      VAL  48   2.982 -10.205   2.695
  284   HG22  VAL  48          1HG2      VAL  48   2.494 -10.592   4.345
  285   HG23  VAL  48          2HG2      VAL  48   3.886 -11.406   3.623
  286    H    GLY  49           H        GLY  49   3.628  -6.696   6.441
  287    HA2  GLY  49           2HA      GLY  49   4.905  -5.017   7.300
  288    HA3  GLY  49           1HA      GLY  49   6.214  -5.638   6.300
  289    H    CYS  50           H        CYS  50   3.118  -4.047   5.688
  290    HA   CYS  50           HA       CYS  50   4.429  -2.600   3.558
  291    HB2  CYS  50           2HB      CYS  50   2.348  -1.979   2.742
  292    HB3  CYS  50           1HB      CYS  50   2.143  -3.645   3.266
  293    H    LYS  51           H        LYS  51   5.071  -0.609   3.652
  294    HA   LYS  51           HA       LYS  51   4.096   1.074   5.847
  295    HB2  LYS  51           2HB      LYS  51   6.510   1.393   4.045
  296    HB3  LYS  51           1HB      LYS  51   6.003   2.576   5.239
  297    HG2  LYS  51           2HG      LYS  51   6.844  -0.245   5.837
  298    HG3  LYS  51           1HG      LYS  51   7.859   1.193   6.000
  299    HD2  LYS  51           2HD      LYS  51   6.306   2.105   7.663
  300    HD3  LYS  51           1HD      LYS  51   5.285   0.674   7.499
  301    HE2  LYS  51           2HE      LYS  51   8.151   0.668   8.422
  302    HE3  LYS  51           1HE      LYS  51   6.748   0.599   9.483
  303    HZ1  LYS  51           3HZ      LYS  51   7.723  -1.576   9.045
  304    HZ2  LYS  51           1HZ      LYS  51   7.415  -1.429   7.408
  305    HZ3  LYS  51           2HZ      LYS  51   6.139  -1.516   8.517
  306    H    ASN  52           H        ASN  52   2.182   1.738   5.018
  307    HA   ASN  52           HA       ASN  52   2.302   3.126   2.445
  308    HB2  ASN  52           2HB      ASN  52   0.639   1.241   2.661
  309    HB3  ASN  52           1HB      ASN  52  -0.164   2.135   3.936
  310   HD21  ASN  52          1HD2      ASN  52  -1.357   1.283   1.538
  311   HD22  ASN  52          2HD2      ASN  52  -1.870   2.696   0.675
  312    HA   PRO  53           HA       PRO  53   2.187   6.858   5.025
  313    HB2  PRO  53           2HB      PRO  53   1.331   7.938   2.384
  314    HB3  PRO  53           1HB      PRO  53   2.578   8.539   3.476
  315    HG2  PRO  53           2HG      PRO  53   3.234   7.246   1.257
  316    HG3  PRO  53           1HG      PRO  53   4.138   6.994   2.758
  317    HD2  PRO  53           2HD      PRO  53   2.172   5.205   1.417
  318    HD3  PRO  53           1HD      PRO  53   3.604   4.804   2.384
  319    H    HIS  54           H        HIS  54  -0.213   5.702   2.792
  320    HA   HIS  54           HA       HIS  54  -2.288   7.461   3.809
  321    HB2  HIS  54           2HB      HIS  54  -2.488   5.257   1.752
  322    HB3  HIS  54           1HB      HIS  54  -3.753   6.394   2.176
  323    HD1  HIS  54           1HD      HIS  54  -3.591   8.727   1.219
  324    HD2  HIS  54           2HD      HIS  54  -0.418   6.277   0.225
  325    HE1  HIS  54           1HE      HIS  54  -2.408   9.909  -0.669
  326    HE2  HIS  54           2HE      HIS  54  -0.330   8.560  -1.023
  327    H    LYS  55           H        LYS  55  -2.702   6.851   5.802
  328    HA   LYS  55           HA       LYS  55  -3.818   4.141   6.121
  329    HB2  LYS  55           2HB      LYS  55  -1.826   4.788   7.560
  330    HB3  LYS  55           1HB      LYS  55  -2.889   5.926   8.377
  331    HG2  LYS  55           2HG      LYS  55  -4.327   4.134   9.122
  332    HG3  LYS  55           1HG      LYS  55  -3.404   2.960   8.190
  333    HD2  LYS  55           2HD      LYS  55  -2.340   4.608  10.448
  334    HD3  LYS  55           1HD      LYS  55  -2.902   2.935  10.595
  335    HE2  LYS  55           2HE      LYS  55  -1.172   2.244   8.970
  336    HE3  LYS  55           1HE      LYS  55  -0.595   3.905   8.889
  337    HZ1  LYS  55           3HZ      LYS  55  -0.538   2.150  11.291
  338    HZ2  LYS  55           1HZ      LYS  55  -0.013   3.759  11.255
  339    HZ3  LYS  55           2HZ      LYS  55   0.762   2.605  10.338
  340    H    GLU  56           H        GLU  56  -4.869   6.667   5.075
  341    HA   GLU  56           HA       GLU  56  -6.866   7.822   6.680
  342    HB2  GLU  56           2HB      GLU  56  -6.781   7.360   3.700
  343    HB3  GLU  56           1HB      GLU  56  -7.818   8.513   4.524
  344    HG2  GLU  56           2HG      GLU  56  -6.035   9.915   5.065
  345    HG3  GLU  56           1HG      GLU  56  -4.835   8.657   4.770
  346    H    ASP  57           H        ASP  57  -9.009   7.213   6.999
  347    HA   ASP  57           HA       ASP  57 -10.839   5.942   7.180
  348    HB2  ASP  57           2HB      ASP  57 -11.125   5.630   4.854
  349    HB3  ASP  57           1HB      ASP  57  -9.739   4.552   4.746
  350    H    TYR  58           H        TYR  58  -7.877   4.435   7.185
  351    HA   TYR  58           HA       TYR  58  -8.873   2.168   8.706
  352    HB2  TYR  58           2HB      TYR  58  -7.018   1.970   6.930
  353    HB3  TYR  58           1HB      TYR  58  -5.966   2.737   8.106
  354    HD1  TYR  58           2HD      TYR  58  -8.052  -0.242   7.462
  355    HD2  TYR  58           1HD      TYR  58  -4.996   1.466   9.874
  356    HE1  TYR  58           2HE      TYR  58  -7.607  -2.448   8.443
  357    HE2  TYR  58           1HE      TYR  58  -4.545  -0.739  10.860
  358    HH   TYR  58           HH       TYR  58  -5.714  -2.796  11.222
  359    H    VAL  59           H        VAL  59  -9.656   3.481  10.369
  360    HA   VAL  59           HA       VAL  59  -7.627   4.530  12.157
  361    HB   VAL  59           HB       VAL  59  -9.545   5.730  13.328
  362   HG11  VAL  59          1HG1      VAL  59  -9.011   6.410  10.445
  363   HG12  VAL  59          2HG1      VAL  59  -8.043   6.908  11.832
  364   HG13  VAL  59          3HG1      VAL  59  -9.690   7.513  11.635
  365   HG21  VAL  59          3HG2      VAL  59 -11.415   4.401  12.467
  366   HG22  VAL  59          1HG2      VAL  59 -11.055   4.936  10.826
  367   HG23  VAL  59          2HG2      VAL  59 -11.610   6.101  12.032
  Start of MODEL    4
    1    H1   SER   8           1HT      SER   8 -18.140   1.651   1.928
    2    H2   SER   8           2HT      SER   8 -18.374   3.290   1.569
    3    H3   SER   8           3HT      SER   8 -17.636   2.794   3.042
    4    HA   SER   8           HA       SER   8 -16.030   3.601   1.480
    5    HB2  SER   8           2HB      SER   8 -15.943   0.655   2.107
    6    HB3  SER   8           1HB      SER   8 -14.557   1.714   1.809
    7    HG   SER   8           HG       SER   8 -14.818   1.520   3.954
    8    HA   PRO   9           HA       PRO   9 -16.759   2.224  -2.702
    9    HB2  PRO   9           2HB      PRO   9 -14.715   3.439  -3.903
   10    HB3  PRO   9           1HB      PRO   9 -16.004   4.394  -3.159
   11    HG2  PRO   9           2HG      PRO   9 -13.280   3.753  -2.103
   12    HG3  PRO   9           1HG      PRO   9 -14.154   5.293  -2.075
   13    HD2  PRO   9           2HD      PRO   9 -14.039   3.548   0.049
   14    HD3  PRO   9           1HD      PRO   9 -15.339   4.729  -0.213
   15    HA   PRO  10           HA       PRO  10 -14.261  -1.420  -3.599
   16    HB2  PRO  10           2HB      PRO  10 -14.026  -0.206  -6.328
   17    HB3  PRO  10           1HB      PRO  10 -14.482  -1.854  -5.882
   18    HG2  PRO  10           2HG      PRO  10 -16.332  -0.130  -6.649
   19    HG3  PRO  10           1HG      PRO  10 -16.641  -1.243  -5.304
   20    HD2  PRO  10           2HD      PRO  10 -16.053   1.679  -5.242
   21    HD3  PRO  10           1HD      PRO  10 -17.099   0.705  -4.188
   22    H    LYS  11           H        LYS  11 -12.140  -1.768  -3.312
   23    HA   LYS  11           HA       LYS  11 -10.256   0.362  -3.967
   24    HB2  LYS  11           2HB      LYS  11  -9.163   0.039  -1.781
   25    HB3  LYS  11           1HB      LYS  11 -10.820   0.604  -1.613
   26    HG2  LYS  11           2HG      LYS  11 -11.528  -1.717  -1.122
   27    HG3  LYS  11           1HG      LYS  11  -9.846  -2.228  -1.229
   28    HD2  LYS  11           2HD      LYS  11 -10.993  -0.264   0.762
   29    HD3  LYS  11           1HD      LYS  11 -10.540  -1.932   1.097
   30    HE2  LYS  11           2HE      LYS  11  -8.203  -1.396   0.534
   31    HE3  LYS  11           1HE      LYS  11  -8.668   0.280   0.233
   32    HZ1  LYS  11           3HZ      LYS  11  -9.485   0.296   2.588
   33    HZ2  LYS  11           1HZ      LYS  11  -7.828   0.196   2.387
   34    HZ3  LYS  11           2HZ      LYS  11  -8.701  -1.177   2.804
   35    HA   PRO  12           HA       PRO  12  -7.945  -3.154  -5.546
   36    HB2  PRO  12           2HB      PRO  12  -5.511  -1.568  -5.367
   37    HB3  PRO  12           1HB      PRO  12  -6.355  -2.136  -6.804
   38    HG2  PRO  12           2HG      PRO  12  -6.275   0.488  -6.082
   39    HG3  PRO  12           1HG      PRO  12  -7.626  -0.236  -6.972
   40    HD2  PRO  12           2HD      PRO  12  -7.410   0.448  -4.070
   41    HD3  PRO  12           1HD      PRO  12  -8.783   0.607  -5.187
   42    H    LYS  13           H        LYS  13  -6.755  -4.770  -4.700
   43    HA   LYS  13           HA       LYS  13  -5.517  -4.255  -2.107
   44    HB2  LYS  13           2HB      LYS  13  -5.904  -6.620  -1.507
   45    HB3  LYS  13           1HB      LYS  13  -7.402  -5.759  -1.808
   46    HG2  LYS  13           2HG      LYS  13  -7.588  -6.834  -4.001
   47    HG3  LYS  13           1HG      LYS  13  -6.051  -7.644  -3.746
   48    HD2  LYS  13           2HD      LYS  13  -7.853  -9.189  -3.283
   49    HD3  LYS  13           1HD      LYS  13  -7.025  -8.796  -1.780
   50    HE2  LYS  13           2HE      LYS  13  -9.418  -8.809  -1.423
   51    HE3  LYS  13           1HE      LYS  13  -8.815  -7.167  -1.253
   52    HZ1  LYS  13           3HZ      LYS  13  -9.569  -6.754  -3.556
   53    HZ2  LYS  13           1HZ      LYS  13 -10.836  -7.192  -2.535
   54    HZ3  LYS  13           2HZ      LYS  13 -10.203  -8.304  -3.615
   55    H    CYS  14           H        CYS  14  -3.463  -4.374  -2.057
   56    HA   CYS  14           HA       CYS  14  -2.023  -5.511  -4.321
   57    HB2  CYS  14           2HB      CYS  14  -0.067  -4.383  -3.422
   58    HB3  CYS  14           1HB      CYS  14  -1.413  -3.251  -3.527
   59    H    ARG  15           H        ARG  15  -0.218  -6.877  -3.946
   60    HA   ARG  15           HA       ARG  15  -0.377  -8.478  -1.490
   61    HB2  ARG  15           2HB      ARG  15  -1.463  -9.505  -3.569
   62    HB3  ARG  15           1HB      ARG  15   0.114  -9.483  -4.320
   63    HG2  ARG  15           2HG      ARG  15  -0.061 -10.928  -1.753
   64    HG3  ARG  15           1HG      ARG  15  -0.943 -11.638  -3.103
   65    HD2  ARG  15           2HD      ARG  15   1.979 -10.889  -3.109
   66    HD3  ARG  15           1HD      ARG  15   1.345 -12.524  -2.907
   67    HE   ARG  15           HE       ARG  15   0.551 -12.463  -5.132
   68   HH11  ARG  15          1HH1      ARG  15   2.601  -9.642  -4.364
   69   HH12  ARG  15          2HH1      ARG  15   3.080  -9.408  -5.993
   70   HH21  ARG  15          1HH2      ARG  15   1.228 -12.077  -7.336
   71   HH22  ARG  15          2HH2      ARG  15   2.275 -10.802  -7.710
   72    H    CYS  16           H        CYS  16   1.129  -6.295  -1.810
   73    HA   CYS  16           HA       CYS  16   3.769  -6.611  -2.784
   74    HB2  CYS  16           2HB      CYS  16   2.721  -4.770  -0.614
   75    HB3  CYS  16           1HB      CYS  16   4.302  -4.659  -1.365
   76    H    GLY  17           H        GLY  17   5.574  -7.483  -1.826
   77    HA2  GLY  17           2HA      GLY  17   6.965  -7.762   0.099
   78    HA3  GLY  17           1HA      GLY  17   5.510  -7.990   1.063
   79    H    ILE  18           H        ILE  18   4.135  -9.769  -0.339
   80    HA   ILE  18           HA       ILE  18   5.399 -12.214   0.352
   81    HB   ILE  18           HB       ILE  18   2.964 -11.871  -1.415
   82   HG12  ILE  18          2HG1      ILE  18   3.234 -11.920   1.592
   83   HG13  ILE  18          1HG1      ILE  18   2.589 -10.653   0.590
   84   HG21  ILE  18          1HG2      ILE  18   2.352 -14.120  -0.596
   85   HG22  ILE  18          2HG2      ILE  18   3.874 -14.199   0.291
   86   HG23  ILE  18          3HG2      ILE  18   3.885 -14.129  -1.469
   87   HD11  ILE  18          3HD1      ILE  18   1.290 -13.347   0.927
   88   HD12  ILE  18          1HD1      ILE  18   0.675 -12.002  -0.034
   89   HD13  ILE  18          2HD1      ILE  18   0.790 -11.852   1.719
   90    H    SER  19           H        SER  19   4.903 -10.508  -2.657
   91    HA   SER  19           HA       SER  19   6.845 -12.201  -3.934
   92    HB2  SER  19           2HB      SER  19   4.604 -13.242  -4.362
   93    HB3  SER  19           1HB      SER  19   4.074 -11.724  -5.073
   94    HG   SER  19           HG       SER  19   6.240 -13.300  -5.977
   95    H    GLY  20           H        GLY  20   7.432 -11.164  -6.049
   96    HA2  GLY  20           2HA      GLY  20   7.598  -9.277  -7.445
   97    HA3  GLY  20           1HA      GLY  20   6.848  -8.304  -6.180
   98    H    SER  21           H        SER  21   8.151  -8.389  -4.076
   99    HA   SER  21           HA       SER  21  10.982  -8.534  -4.401
  100    HB2  SER  21           2HB      SER  21  10.458  -6.276  -5.319
  101    HB3  SER  21           1HB      SER  21   9.655  -5.869  -3.806
  102    HG   SER  21           HG       SER  21  11.676  -5.088  -3.644
  103    H    SER  22           H        SER  22  11.836  -9.084  -2.489
  104    HA   SER  22           HA       SER  22  10.059  -9.288  -0.226
  105    HB2  SER  22           2HB      SER  22  12.938 -10.149  -0.545
  106    HB3  SER  22           1HB      SER  22  11.832 -10.647   0.737
  107    HG   SER  22           HG       SER  22  10.823 -11.029  -1.754
  108    H    ASN  23           H        ASN  23   9.815  -7.225   0.513
  109    HA   ASN  23           HA       ASN  23  12.100  -6.068   1.825
  110    HB2  ASN  23           2HB      ASN  23  12.131  -5.040  -0.438
  111    HB3  ASN  23           1HB      ASN  23  10.471  -4.511  -0.207
  112   HD21  ASN  23          1HD2      ASN  23  13.776  -4.060   0.774
  113   HD22  ASN  23          2HD2      ASN  23  13.557  -2.501   1.471
  114    H    THR  24           H        THR  24  11.480  -5.080   3.663
  115    HA   THR  24           HA       THR  24   8.601  -4.998   4.247
  116    HB   THR  24           HB       THR  24  10.934  -5.156   6.181
  117    HG1  THR  24           1HG      THR  24   9.980  -6.962   4.457
  118   HG21  THR  24          3HG2      THR  24   8.009  -5.913   6.515
  119   HG22  THR  24          1HG2      THR  24   8.750  -4.450   7.167
  120   HG23  THR  24          2HG2      THR  24   9.255  -6.036   7.750
  121    H    LEU  25           H        LEU  25  10.850  -2.918   3.221
  122    HA   LEU  25           HA       LEU  25  10.683  -0.936   5.374
  123    HB2  LEU  25           2HB      LEU  25  12.500  -1.039   2.983
  124    HB3  LEU  25           1HB      LEU  25  12.583   0.116   4.297
  125    HG   LEU  25           HG       LEU  25  13.030  -2.859   4.596
  126   HD11  LEU  25          1HD1      LEU  25  14.790  -1.832   3.268
  127   HD12  LEU  25          2HD1      LEU  25  15.381  -2.291   4.865
  128   HD13  LEU  25          3HD1      LEU  25  15.017  -0.603   4.512
  129   HD21  LEU  25          3HD2      LEU  25  13.916  -2.229   6.807
  130   HD22  LEU  25          1HD2      LEU  25  12.204  -1.834   6.638
  131   HD23  LEU  25          2HD2      LEU  25  13.418  -0.564   6.513
  132    H    THR  26           H        THR  26  10.557  -0.928   1.782
  133    HA   THR  26           HA       THR  26   8.918   1.519   1.970
  134    HB   THR  26           HB       THR  26   9.995   2.083  -0.283
  135    HG1  THR  26           1HG      THR  26  11.163   0.435  -0.986
  136   HG21  THR  26          3HG2      THR  26  12.005   3.054   0.780
  137   HG22  THR  26          1HG2      THR  26  11.752   2.020   2.183
  138   HG23  THR  26          2HG2      THR  26  10.577   3.273   1.793
  139    H    THR  27           H        THR  27   8.381  -1.463   1.594
  140    HA   THR  27           HA       THR  27   7.776  -2.361  -0.837
  141    HB   THR  27           HB       THR  27   5.966  -2.835   1.472
  142    HG1  THR  27           1HG      THR  27   8.058  -4.203   1.973
  143   HG21  THR  27          3HG2      THR  27   6.216  -5.115   0.760
  144   HG22  THR  27          1HG2      THR  27   7.576  -4.685  -0.297
  145   HG23  THR  27          2HG2      THR  27   5.964  -4.125  -0.690
  146    H    CYS  28           H        CYS  28   5.246  -1.007   1.317
  147    HA   CYS  28           HA       CYS  28   3.603  -0.565  -1.009
  148    HB2  CYS  28           2HB      CYS  28   2.912  -0.449   1.923
  149    HB3  CYS  28           1HB      CYS  28   1.781   0.057   0.680
  150    H    ARG  29           H        ARG  29   5.858   1.208   0.400
  151    HA   ARG  29           HA       ARG  29   4.446   3.757   0.304
  152    HB2  ARG  29           2HB      ARG  29   5.894   3.285   2.216
  153    HB3  ARG  29           1HB      ARG  29   7.282   3.115   1.149
  154    HG2  ARG  29           2HG      ARG  29   7.201   5.475   0.638
  155    HG3  ARG  29           1HG      ARG  29   5.695   5.648   1.539
  156    HD2  ARG  29           2HD      ARG  29   6.852   4.993   3.594
  157    HD3  ARG  29           1HD      ARG  29   8.356   4.820   2.698
  158    HE   ARG  29           HE       ARG  29   8.058   7.266   2.179
  159   HH11  ARG  29          1HH1      ARG  29   6.775   5.866   5.217
  160   HH12  ARG  29          2HH1      ARG  29   6.989   7.283   6.112
  161   HH21  ARG  29          1HH2      ARG  29   8.317   9.215   3.440
  162   HH22  ARG  29          2HH2      ARG  29   7.891   9.249   5.072
  163    H    ASN  30           H        ASN  30   6.002   1.878  -1.870
  164    HA   ASN  30           HA       ASN  30   7.008   4.242  -3.293
  165    HB2  ASN  30           2HB      ASN  30   8.634   2.953  -4.466
  166    HB3  ASN  30           1HB      ASN  30   8.728   2.427  -2.797
  167   HD21  ASN  30          1HD2      ASN  30   8.000   0.336  -2.283
  168   HD22  ASN  30          2HD2      ASN  30   7.744  -0.846  -3.510
  169    H    SER  31           H        SER  31   7.041   3.776  -5.794
  170    HA   SER  31           HA       SER  31   4.369   4.038  -6.550
  171    HB2  SER  31           2HB      SER  31   6.785   3.664  -8.287
  172    HB3  SER  31           1HB      SER  31   5.253   4.425  -8.725
  173    HG   SER  31           HG       SER  31   5.892   6.168  -7.865
  174    H    ARG  32           H        ARG  32   6.001   1.111  -6.056
  175    HA   ARG  32           HA       ARG  32   4.643  -0.220  -8.241
  176    HB2  ARG  32           2HB      ARG  32   6.388  -1.406  -6.082
  177    HB3  ARG  32           1HB      ARG  32   5.713  -2.289  -7.438
  178    HG2  ARG  32           2HG      ARG  32   7.790  -0.116  -7.503
  179    HG3  ARG  32           1HG      ARG  32   7.983  -1.813  -7.947
  180    HD2  ARG  32           2HD      ARG  32   6.340   0.266  -9.381
  181    HD3  ARG  32           1HD      ARG  32   7.840  -0.454  -9.948
  182    HE   ARG  32           HE       ARG  32   6.176  -2.567  -9.573
  183   HH11  ARG  32          1HH1      ARG  32   5.965   0.438 -11.495
  184   HH12  ARG  32          2HH1      ARG  32   4.950  -0.235 -12.664
  185   HH21  ARG  32          1HH2      ARG  32   4.781  -3.472 -11.192
  186   HH22  ARG  32          2HH2      ARG  32   4.278  -2.511 -12.511
  187    H    CYS  33           H        CYS  33   3.689   0.869  -5.344
  188    HA   CYS  33           HA       CYS  33   1.927  -1.387  -4.951
  189    HB2  CYS  33           2HB      CYS  33   3.092  -0.555  -2.967
  190    HB3  CYS  33           1HB      CYS  33   2.373   1.038  -3.206
  191    HA   PRO  34           HA       PRO  34  -0.916   0.986  -7.475
  192    HB2  PRO  34           2HB      PRO  34  -3.064  -0.710  -7.105
  193    HB3  PRO  34           1HB      PRO  34  -1.797  -0.956  -8.306
  194    HG2  PRO  34           2HG      PRO  34  -2.102  -2.188  -5.605
  195    HG3  PRO  34           1HG      PRO  34  -1.577  -2.934  -7.124
  196    HD2  PRO  34           2HD      PRO  34   0.156  -2.236  -5.210
  197    HD3  PRO  34           1HD      PRO  34   0.579  -2.095  -6.931
  198    H    CYS  35           H        CYS  35  -1.389   0.004  -4.220
  199    HA   CYS  35           HA       CYS  35  -3.783   1.443  -3.689
  200    HB2  CYS  35           2HB      CYS  35  -1.614   0.549  -1.799
  201    HB3  CYS  35           1HB      CYS  35  -3.218   1.096  -1.326
  202    H    TYR  36           H        TYR  36  -0.448   2.035  -2.678
  203    HA   TYR  36           HA       TYR  36  -0.686   4.561  -1.642
  204    HB2  TYR  36           2HB      TYR  36   1.314   3.263  -1.355
  205    HB3  TYR  36           1HB      TYR  36   1.625   3.270  -3.086
  206    HD1  TYR  36           2HD      TYR  36   1.393   5.472  -0.131
  207    HD2  TYR  36           1HD      TYR  36   2.933   4.975  -4.056
  208    HE1  TYR  36           2HE      TYR  36   2.742   7.500   0.152
  209    HE2  TYR  36           1HE      TYR  36   4.274   7.002  -3.814
  210    HH   TYR  36           HH       TYR  36   4.370   9.005  -2.484
  211    H    LYS  37           H        LYS  37   0.085   3.641  -4.948
  212    HA   LYS  37           HA       LYS  37   0.525   6.278  -5.848
  213    HB2  LYS  37           2HB      LYS  37   1.256   3.932  -6.797
  214    HB3  LYS  37           1HB      LYS  37  -0.237   4.046  -7.705
  215    HG2  LYS  37           2HG      LYS  37   1.963   6.103  -7.767
  216    HG3  LYS  37           1HG      LYS  37   1.833   4.790  -8.920
  217    HD2  LYS  37           2HD      LYS  37  -0.300   6.902  -8.523
  218    HD3  LYS  37           1HD      LYS  37   0.993   7.048  -9.703
  219    HE2  LYS  37           2HE      LYS  37  -0.941   6.284 -10.871
  220    HE3  LYS  37           1HE      LYS  37   0.144   4.913 -10.751
  221    HZ1  LYS  37           3HZ      LYS  37  -2.166   4.358 -10.345
  222    HZ2  LYS  37           1HZ      LYS  37  -2.250   5.369  -9.023
  223    HZ3  LYS  37           2HZ      LYS  37  -1.270   3.965  -9.035
  224    H    SER  38           H        SER  38  -2.368   4.226  -5.736
  225    HA   SER  38           HA       SER  38  -3.859   6.273  -7.179
  226    HB2  SER  38           2HB      SER  38  -4.649   3.487  -6.336
  227    HB3  SER  38           1HB      SER  38  -5.672   4.593  -7.259
  228    HG   SER  38           HG       SER  38  -4.305   2.957  -8.393
  229    H    TYR  39           H        TYR  39  -2.887   6.284  -4.284
  230    HA   TYR  39           HA       TYR  39  -3.450   7.450  -2.452
  231    HB2  TYR  39           2HB      TYR  39  -6.050   8.093  -3.838
  232    HB3  TYR  39           1HB      TYR  39  -5.410   8.912  -2.421
  233    HD1  TYR  39           1HD      TYR  39  -2.973   9.963  -2.798
  234    HD2  TYR  39           2HD      TYR  39  -5.729   9.045  -5.906
  235    HE1  TYR  39           1HE      TYR  39  -1.852  11.580  -4.268
  236    HE2  TYR  39           2HE      TYR  39  -4.606  10.652  -7.386
  237    HH   TYR  39           HH       TYR  39  -1.584  12.021  -6.683
  238    H    ASN  40           H        ASN  40  -4.394   4.595  -2.869
  239    HA   ASN  40           HA       ASN  40  -6.646   4.528  -1.003
  240    HB2  ASN  40           2HB      ASN  40  -5.491   2.400  -2.799
  241    HB3  ASN  40           1HB      ASN  40  -6.616   2.002  -1.507
  242   HD21  ASN  40          1HD2      ASN  40  -6.236   3.462  -4.630
  243   HD22  ASN  40          2HD2      ASN  40  -7.924   3.686  -4.931
  244    H    SER  41           H        SER  41  -6.615   2.642   0.575
  245    HA   SER  41           HA       SER  41  -4.164   2.824   2.132
  246    HB2  SER  41           2HB      SER  41  -5.714   2.019   3.934
  247    HB3  SER  41           1HB      SER  41  -6.150   3.585   3.243
  248    HG   SER  41           HG       SER  41  -8.014   2.637   3.013
  249    H    CYS  42           H        CYS  42  -3.640   0.775   3.376
  250    HA   CYS  42           HA       CYS  42  -4.053  -1.496   1.608
  251    HB2  CYS  42           2HB      CYS  42  -1.733  -0.818   3.367
  252    HB3  CYS  42           1HB      CYS  42  -1.987  -2.445   2.739
  253    H    ALA  43           H        ALA  43  -5.569  -0.496   4.028
  254    HA   ALA  43           HA       ALA  43  -5.565  -2.771   5.760
  255    HB1  ALA  43           1HB      ALA  43  -7.653  -1.799   6.645
  256    HB2  ALA  43           2HB      ALA  43  -7.652  -0.639   5.316
  257    HB3  ALA  43           3HB      ALA  43  -6.377  -0.578   6.536
  258    H    GLY  44           H        GLY  44  -6.115  -4.682   4.967
  259    HA2  GLY  44           2HA      GLY  44  -7.880  -6.146   4.236
  260    HA3  GLY  44           1HA      GLY  44  -8.454  -4.848   3.196
  261    H    CYS  45           H        CYS  45  -5.096  -5.097   3.171
  262    HA   CYS  45           HA       CYS  45  -5.187  -6.304   0.501
  263    HB2  CYS  45           2HB      CYS  45  -2.959  -4.826   1.909
  264    HB3  CYS  45           1HB      CYS  45  -2.870  -5.459   0.275
  265    H    HIS  46           H        HIS  46  -2.841  -7.404   0.092
  266    HA   HIS  46           HA       HIS  46  -2.404  -9.374   2.226
  267    HB2  HIS  46           2HB      HIS  46  -2.238  -9.714  -0.795
  268    HB3  HIS  46           1HB      HIS  46  -1.639 -10.899   0.354
  269    HD1  HIS  46           1HD      HIS  46  -3.304 -12.592   1.182
  270    HD2  HIS  46           2HD      HIS  46  -5.118  -9.346  -0.661
  271    HE1  HIS  46           1HE      HIS  46  -5.736 -13.152   1.062
  272    HE2  HIS  46           2HE      HIS  46  -6.806 -11.026   0.256
  273    H    CYS  47           H        CYS  47  -1.280  -6.878   2.099
  274    HA   CYS  47           HA       CYS  47   1.364  -7.250   0.993
  275    HB2  CYS  47           2HB      CYS  47   1.692  -4.858   1.677
  276    HB3  CYS  47           1HB      CYS  47   0.525  -5.170   0.406
  277    H    VAL  48           H        VAL  48   3.021  -7.589   2.078
  278    HA   VAL  48           HA       VAL  48   2.880  -7.639   5.016
  279    HB   VAL  48           HB       VAL  48   4.641  -9.339   3.206
  280   HG11  VAL  48          1HG1      VAL  48   5.243 -10.546   5.254
  281   HG12  VAL  48          2HG1      VAL  48   4.279  -9.415   6.202
  282   HG13  VAL  48          3HG1      VAL  48   5.705  -8.847   5.337
  283   HG21  VAL  48          3HG2      VAL  48   2.225 -10.122   4.834
  284   HG22  VAL  48          1HG2      VAL  48   3.279 -11.240   3.968
  285   HG23  VAL  48          2HG2      VAL  48   2.324 -10.058   3.073
  286    H    GLY  49           H        GLY  49   4.167  -6.221   5.964
  287    HA2  GLY  49           2HA      GLY  49   6.077  -4.898   6.278
  288    HA3  GLY  49           1HA      GLY  49   6.625  -5.385   4.666
  289    H    CYS  50           H        CYS  50   3.494  -4.182   5.548
  290    HA   CYS  50           HA       CYS  50   3.565  -2.365   3.381
  291    HB2  CYS  50           2HB      CYS  50   1.517  -3.518   3.752
  292    HB3  CYS  50           1HB      CYS  50   1.491  -3.043   5.446
  293    H    LYS  51           H        LYS  51   4.735  -0.615   3.734
  294    HA   LYS  51           HA       LYS  51   3.972   0.970   6.073
  295    HB2  LYS  51           2HB      LYS  51   6.343   1.385   4.215
  296    HB3  LYS  51           1HB      LYS  51   6.023   2.243   5.709
  297    HG2  LYS  51           2HG      LYS  51   6.725  -0.680   5.485
  298    HG3  LYS  51           1HG      LYS  51   7.835   0.608   5.933
  299    HD2  LYS  51           2HD      LYS  51   6.488   1.076   7.920
  300    HD3  LYS  51           1HD      LYS  51   5.353  -0.189   7.454
  301    HE2  LYS  51           2HE      LYS  51   7.176  -1.846   7.592
  302    HE3  LYS  51           1HE      LYS  51   8.274  -0.572   8.114
  303    HZ1  LYS  51           3HZ      LYS  51   5.839  -1.461   9.553
  304    HZ2  LYS  51           1HZ      LYS  51   6.884  -0.238  10.070
  305    HZ3  LYS  51           2HZ      LYS  51   7.423  -1.821   9.983
  306    H    ASN  52           H        ASN  52   2.101   1.675   5.136
  307    HA   ASN  52           HA       ASN  52   2.409   3.143   2.623
  308    HB2  ASN  52           2HB      ASN  52   0.808   1.325   2.396
  309    HB3  ASN  52           1HB      ASN  52  -0.100   1.910   3.775
  310   HD21  ASN  52          1HD2      ASN  52  -1.868   1.904   2.380
  311   HD22  ASN  52          2HD2      ASN  52  -2.207   3.173   1.243
  312    HA   PRO  53           HA       PRO  53   2.076   6.855   5.126
  313    HB2  PRO  53           2HB      PRO  53   1.907   7.938   2.360
  314    HB3  PRO  53           1HB      PRO  53   2.917   8.459   3.713
  315    HG2  PRO  53           2HG      PRO  53   4.021   7.075   1.782
  316    HG3  PRO  53           1HG      PRO  53   4.393   6.666   3.466
  317    HD2  PRO  53           2HD      PRO  53   2.530   5.296   1.562
  318    HD3  PRO  53           1HD      PRO  53   3.723   4.610   2.693
  319    H    HIS  54           H        HIS  54  -0.271   5.510   3.125
  320    HA   HIS  54           HA       HIS  54  -2.195   7.649   3.670
  321    HB2  HIS  54           2HB      HIS  54  -2.487   5.075   2.115
  322    HB3  HIS  54           1HB      HIS  54  -3.849   6.115   2.506
  323    HD1  HIS  54           1HD      HIS  54  -3.832   8.486   1.414
  324    HD2  HIS  54           2HD      HIS  54  -0.973   5.850   0.021
  325    HE1  HIS  54           1HE      HIS  54  -3.066   9.457  -0.753
  326    HE2  HIS  54           2HE      HIS  54  -1.062   8.061  -1.318
  327    H    LYS  55           H        LYS  55  -3.785   7.459   5.108
  328    HA   LYS  55           HA       LYS  55  -3.340   5.554   7.200
  329    HB2  LYS  55           2HB      LYS  55  -5.521   7.605   6.889
  330    HB3  LYS  55           1HB      LYS  55  -5.311   6.589   8.303
  331    HG2  LYS  55           2HG      LYS  55  -3.041   7.590   8.577
  332    HG3  LYS  55           1HG      LYS  55  -3.465   8.703   7.268
  333    HD2  LYS  55           2HD      LYS  55  -5.380   9.483   8.528
  334    HD3  LYS  55           1HD      LYS  55  -4.982   8.376   9.842
  335    HE2  LYS  55           2HE      LYS  55  -2.828   9.535  10.124
  336    HE3  LYS  55           1HE      LYS  55  -3.295  10.673   8.864
  337    HZ1  LYS  55           3HZ      LYS  55  -3.744  11.597  11.035
  338    HZ2  LYS  55           1HZ      LYS  55  -4.686  10.258  11.447
  339    HZ3  LYS  55           2HZ      LYS  55  -5.205  11.306  10.240
  340    H    GLU  56           H        GLU  56  -5.476   4.652   8.193
  341    HA   GLU  56           HA       GLU  56  -6.308   2.615   6.363
  342    HB2  GLU  56           2HB      GLU  56  -7.320   3.193   9.139
  343    HB3  GLU  56           1HB      GLU  56  -7.468   1.696   8.242
  344    HG2  GLU  56           2HG      GLU  56  -5.136   1.271   8.414
  345    HG3  GLU  56           1HG      GLU  56  -4.852   2.875   9.096
  346    H    ASP  57           H        ASP  57  -8.637   2.069   6.219
  347    HA   ASP  57           HA       ASP  57 -10.192   4.120   5.113
  348    HB2  ASP  57           2HB      ASP  57 -11.189   1.493   6.235
  349    HB3  ASP  57           1HB      ASP  57 -11.930   2.464   4.974
  350    H    TYR  58           H        TYR  58 -11.854   5.282   6.000
  351    HA   TYR  58           HA       TYR  58 -11.971   5.278   8.872
  352    HB2  TYR  58           2HB      TYR  58 -13.429   7.361   8.559
  353    HB3  TYR  58           1HB      TYR  58 -11.766   7.496   8.014
  354    HD1  TYR  58           1HD      TYR  58 -11.307   7.322   5.524
  355    HD2  TYR  58           2HD      TYR  58 -15.232   7.759   7.097
  356    HE1  TYR  58           1HE      TYR  58 -12.088   8.073   3.337
  357    HE2  TYR  58           2HE      TYR  58 -16.031   8.511   4.906
  358    HH   TYR  58           HH       TYR  58 -15.149   9.497   2.892
  359    H    VAL  59           H        VAL  59 -12.880   3.311   9.113
  360    HA   VAL  59           HA       VAL  59 -15.691   3.163   8.429
  361    HB   VAL  59           HB       VAL  59 -15.367   0.607   8.622
  362   HG11  VAL  59          1HG1      VAL  59 -13.981   2.098   6.390
  363   HG12  VAL  59          2HG1      VAL  59 -15.713   1.773   6.492
  364   HG13  VAL  59          3HG1      VAL  59 -14.577   0.438   6.307
  365   HG21  VAL  59          3HG2      VAL  59 -13.140   0.656   9.684
  366   HG22  VAL  59          1HG2      VAL  59 -12.475   1.412   8.238
  367   HG23  VAL  59          2HG2      VAL  59 -13.109  -0.234   8.160
  Start of MODEL    5
    1    H1   SER   8           1HT      SER   8 -18.501   5.216  -2.178
    2    H2   SER   8           2HT      SER   8 -17.092   6.086  -2.424
    3    H3   SER   8           3HT      SER   8 -17.857   6.137  -0.913
    4    HA   SER   8           HA       SER   8 -15.943   4.760  -0.815
    5    HB2  SER   8           2HB      SER   8 -18.484   3.120  -0.783
    6    HB3  SER   8           1HB      SER   8 -17.041   2.878   0.206
    7    HG   SER   8           HG       SER   8 -18.274   4.010   1.556
    8    HA   PRO   9           HA       PRO   9 -15.629   2.895  -4.965
    9    HB2  PRO   9           2HB      PRO   9 -13.043   3.408  -5.399
   10    HB3  PRO   9           1HB      PRO   9 -14.251   4.694  -5.477
   11    HG2  PRO   9           2HG      PRO   9 -12.315   4.048  -3.299
   12    HG3  PRO   9           1HG      PRO   9 -12.846   5.630  -3.896
   13    HD2  PRO   9           2HD      PRO   9 -13.828   4.336  -1.623
   14    HD3  PRO   9           1HD      PRO   9 -14.633   5.669  -2.474
   15    HA   PRO  10           HA       PRO  10 -13.809  -1.081  -3.835
   16    HB2  PRO  10           2HB      PRO  10 -13.046  -1.493  -6.642
   17    HB3  PRO  10           1HB      PRO  10 -14.229  -2.377  -5.677
   18    HG2  PRO  10           2HG      PRO  10 -14.963  -0.731  -7.688
   19    HG3  PRO  10           1HG      PRO  10 -15.952  -0.957  -6.235
   20    HD2  PRO  10           2HD      PRO  10 -14.104   1.291  -6.941
   21    HD3  PRO  10           1HD      PRO  10 -15.716   1.333  -6.185
   22    H    LYS  11           H        LYS  11 -11.817  -1.458  -3.042
   23    HA   LYS  11           HA       LYS  11  -9.612   0.200  -3.989
   24    HB2  LYS  11           2HB      LYS  11  -9.901  -1.588  -1.595
   25    HB3  LYS  11           1HB      LYS  11  -8.497  -0.608  -1.948
   26    HG2  LYS  11           2HG      LYS  11  -9.764   1.422  -1.632
   27    HG3  LYS  11           1HG      LYS  11 -11.256   0.495  -1.436
   28    HD2  LYS  11           2HD      LYS  11  -8.846   0.187   0.361
   29    HD3  LYS  11           1HD      LYS  11 -10.202   1.259   0.719
   30    HE2  LYS  11           2HE      LYS  11 -11.723  -0.595   0.804
   31    HE3  LYS  11           1HE      LYS  11 -10.495  -1.713   0.230
   32    HZ1  LYS  11           3HZ      LYS  11  -9.360  -1.591   2.254
   33    HZ2  LYS  11           1HZ      LYS  11 -10.972  -1.752   2.633
   34    HZ3  LYS  11           2HZ      LYS  11 -10.223  -0.245   2.809
   35    HA   PRO  12           HA       PRO  12  -7.662  -3.537  -5.633
   36    HB2  PRO  12           2HB      PRO  12  -5.234  -1.989  -5.749
   37    HB3  PRO  12           1HB      PRO  12  -6.155  -2.727  -7.061
   38    HG2  PRO  12           2HG      PRO  12  -6.007  -0.002  -6.685
   39    HG3  PRO  12           1HG      PRO  12  -7.382  -0.807  -7.459
   40    HD2  PRO  12           2HD      PRO  12  -7.112   0.240  -4.676
   41    HD3  PRO  12           1HD      PRO  12  -8.529   0.204  -5.749
   42    H    LYS  13           H        LYS  13  -6.633  -4.965  -4.488
   43    HA   LYS  13           HA       LYS  13  -5.406  -4.057  -2.000
   44    HB2  LYS  13           2HB      LYS  13  -5.961  -6.294  -1.064
   45    HB3  LYS  13           1HB      LYS  13  -7.354  -5.284  -1.406
   46    HG2  LYS  13           2HG      LYS  13  -7.652  -6.577  -3.538
   47    HG3  LYS  13           1HG      LYS  13  -6.365  -7.649  -2.986
   48    HD2  LYS  13           2HD      LYS  13  -7.642  -8.164  -0.982
   49    HD3  LYS  13           1HD      LYS  13  -8.941  -7.104  -1.525
   50    HE2  LYS  13           2HE      LYS  13  -7.972  -9.571  -2.962
   51    HE3  LYS  13           1HE      LYS  13  -9.426  -9.471  -1.972
   52    HZ1  LYS  13           3HZ      LYS  13 -10.234  -7.741  -3.543
   53    HZ2  LYS  13           1HZ      LYS  13 -10.017  -9.257  -4.254
   54    HZ3  LYS  13           2HZ      LYS  13  -8.893  -8.024  -4.505
   55    H    CYS  14           H        CYS  14  -3.413  -4.192  -1.974
   56    HA   CYS  14           HA       CYS  14  -2.041  -5.633  -4.040
   57    HB2  CYS  14           2HB      CYS  14  -0.009  -4.504  -3.207
   58    HB3  CYS  14           1HB      CYS  14  -1.319  -3.384  -3.548
   59    H    ARG  15           H        ARG  15  -0.596  -7.224  -3.814
   60    HA   ARG  15           HA       ARG  15  -0.529  -8.626  -1.239
   61    HB2  ARG  15           2HB      ARG  15  -0.217  -9.705  -4.066
   62    HB3  ARG  15           1HB      ARG  15   0.130 -10.654  -2.632
   63    HG2  ARG  15           2HG      ARG  15  -2.027 -11.314  -3.308
   64    HG3  ARG  15           1HG      ARG  15  -2.286 -10.243  -1.940
   65    HD2  ARG  15           2HD      ARG  15  -3.917  -9.692  -3.601
   66    HD3  ARG  15           1HD      ARG  15  -2.723  -8.395  -3.599
   67    HE   ARG  15           HE       ARG  15  -2.104 -10.428  -5.486
   68   HH11  ARG  15          1HH1      ARG  15  -4.068  -7.467  -5.107
   69   HH12  ARG  15          2HH1      ARG  15  -4.326  -7.269  -6.763
   70   HH21  ARG  15          1HH2      ARG  15  -2.502 -10.139  -7.758
   71   HH22  ARG  15          2HH2      ARG  15  -3.413  -8.814  -8.311
   72    H    CYS  16           H        CYS  16   1.007  -6.414  -1.843
   73    HA   CYS  16           HA       CYS  16   3.631  -6.769  -2.683
   74    HB2  CYS  16           2HB      CYS  16   2.549  -4.981  -0.503
   75    HB3  CYS  16           1HB      CYS  16   4.183  -4.877  -1.133
   76    H    GLY  17           H        GLY  17   5.541  -7.384  -1.655
   77    HA2  GLY  17           2HA      GLY  17   6.813  -8.084   0.176
   78    HA3  GLY  17           1HA      GLY  17   5.321  -8.428   1.056
   79    H    ILE  18           H        ILE  18   3.943  -9.805  -0.837
   80    HA   ILE  18           HA       ILE  18   5.321 -12.358  -0.732
   81    HB   ILE  18           HB       ILE  18   2.543 -11.808  -1.806
   82   HG12  ILE  18          2HG1      ILE  18   3.395 -12.361   1.050
   83   HG13  ILE  18          1HG1      ILE  18   2.704 -10.881   0.432
   84   HG21  ILE  18          1HG2      ILE  18   3.825 -14.284  -0.634
   85   HG22  ILE  18          2HG2      ILE  18   3.501 -14.008  -2.339
   86   HG23  ILE  18          3HG2      ILE  18   2.162 -14.164  -1.203
   87   HD11  ILE  18          3HD1      ILE  18   0.606 -11.965  -0.049
   88   HD12  ILE  18          1HD1      ILE  18   1.043 -12.201   1.645
   89   HD13  ILE  18          2HD1      ILE  18   1.256 -13.517   0.482
   90    H    SER  19           H        SER  19   3.732 -10.259  -3.105
   91    HA   SER  19           HA       SER  19   4.582 -11.827  -5.336
   92    HB2  SER  19           2HB      SER  19   3.323  -9.091  -5.214
   93    HB3  SER  19           1HB      SER  19   3.444 -10.116  -6.644
   94    HG   SER  19           HG       SER  19   1.557 -10.694  -5.953
   95    H    GLY  20           H        GLY  20   6.146  -9.435  -3.489
   96    HA2  GLY  20           2HA      GLY  20   8.480  -9.444  -4.968
   97    HA3  GLY  20           1HA      GLY  20   7.543  -8.062  -5.532
   98    H    SER  21           H        SER  21  10.056  -7.968  -4.169
   99    HA   SER  21           HA       SER  21   9.297  -6.225  -1.991
  100    HB2  SER  21           2HB      SER  21  11.286  -8.476  -1.561
  101    HB3  SER  21           1HB      SER  21  10.791  -7.268  -0.378
  102    HG   SER  21           HG       SER  21   8.573  -8.320  -1.159
  103    H    SER  22           H        SER  22  10.169  -4.493  -3.043
  104    HA   SER  22           HA       SER  22  12.815  -4.598  -4.159
  105    HB2  SER  22           2HB      SER  22  10.884  -3.126  -4.980
  106    HB3  SER  22           1HB      SER  22  11.097  -2.166  -3.522
  107    HG   SER  22           HG       SER  22  13.394  -1.961  -4.352
  108    H    ASN  23           H        ASN  23  11.224  -2.900  -1.485
  109    HA   ASN  23           HA       ASN  23  13.406  -3.442   0.305
  110    HB2  ASN  23           2HB      ASN  23  14.088  -1.260  -0.540
  111    HB3  ASN  23           1HB      ASN  23  12.449  -0.634  -0.385
  112   HD21  ASN  23          1HD2      ASN  23  15.367  -1.516   1.300
  113   HD22  ASN  23          2HD2      ASN  23  14.997  -0.731   2.780
  114    H    THR  24           H        THR  24  12.413  -4.193   2.073
  115    HA   THR  24           HA       THR  24   9.619  -4.353   2.173
  116    HB   THR  24           HB       THR  24  11.557  -4.999   4.407
  117    HG1  THR  24           1HG      THR  24  10.686  -6.816   2.434
  118   HG21  THR  24          3HG2      THR  24   8.905  -6.217   3.574
  119   HG22  THR  24          1HG2      THR  24   9.151  -5.174   4.975
  120   HG23  THR  24          2HG2      THR  24   9.909  -6.769   4.908
  121    H    LEU  25           H        LEU  25  11.585  -1.786   3.186
  122    HA   LEU  25           HA       LEU  25   9.642  -0.965   5.195
  123    HB2  LEU  25           2HB      LEU  25  12.321   0.227   4.454
  124    HB3  LEU  25           1HB      LEU  25  11.226   0.951   5.604
  125    HG   LEU  25           HG       LEU  25  11.466  -1.160   6.989
  126   HD11  LEU  25          1HD1      LEU  25  13.784  -1.684   5.140
  127   HD12  LEU  25          2HD1      LEU  25  12.328  -2.661   5.295
  128   HD13  LEU  25          3HD1      LEU  25  13.450  -2.536   6.648
  129   HD21  LEU  25          3HD2      LEU  25  13.913   0.526   6.513
  130   HD22  LEU  25          1HD2      LEU  25  13.611  -0.466   7.939
  131   HD23  LEU  25          2HD2      LEU  25  12.566   0.908   7.586
  132    H    THR  26           H        THR  26  10.041  -0.742   1.924
  133    HA   THR  26           HA       THR  26   8.466   1.740   1.833
  134    HB   THR  26           HB       THR  26  10.633   1.186  -0.222
  135    HG1  THR  26           1HG      THR  26  11.550   1.291   1.927
  136   HG21  THR  26          3HG2      THR  26  10.523   3.613  -0.542
  137   HG22  THR  26          1HG2      THR  26   9.362   3.752   0.780
  138   HG23  THR  26          2HG2      THR  26   8.912   2.913  -0.704
  139    H    THR  27           H        THR  27   8.107  -1.350   1.483
  140    HA   THR  27           HA       THR  27   7.702  -2.189  -1.078
  141    HB   THR  27           HB       THR  27   5.759  -2.920   1.073
  142    HG1  THR  27           1HG      THR  27   7.299  -3.616   2.353
  143   HG21  THR  27          3HG2      THR  27   6.132  -5.126   0.245
  144   HG22  THR  27          1HG2      THR  27   7.546  -4.594  -0.686
  145   HG23  THR  27          2HG2      THR  27   5.948  -4.057  -1.159
  146    H    CYS  28           H        CYS  28   5.224  -0.940   1.103
  147    HA   CYS  28           HA       CYS  28   3.458  -0.477  -1.113
  148    HB2  CYS  28           2HB      CYS  28   2.986  -0.350   1.848
  149    HB3  CYS  28           1HB      CYS  28   1.771   0.119   0.659
  150    H    ARG  29           H        ARG  29   5.844   1.291   0.135
  151    HA   ARG  29           HA       ARG  29   4.362   3.829   0.048
  152    HB2  ARG  29           2HB      ARG  29   5.778   3.237   2.072
  153    HB3  ARG  29           1HB      ARG  29   7.185   3.391   1.033
  154    HG2  ARG  29           2HG      ARG  29   6.645   5.726   0.626
  155    HG3  ARG  29           1HG      ARG  29   5.212   5.582   1.644
  156    HD2  ARG  29           2HD      ARG  29   6.694   4.969   3.536
  157    HD3  ARG  29           1HD      ARG  29   8.084   5.266   2.490
  158    HE   ARG  29           HE       ARG  29   6.292   7.473   2.575
  159   HH11  ARG  29          1HH1      ARG  29   9.005   5.977   4.275
  160   HH12  ARG  29          2HH1      ARG  29   9.498   7.385   5.061
  161   HH21  ARG  29          1HH2      ARG  29   6.881   9.405   3.681
  162   HH22  ARG  29          2HH2      ARG  29   8.206   9.425   4.733
  163    H    ASN  30           H        ASN  30   5.701   2.021  -2.178
  164    HA   ASN  30           HA       ASN  30   7.043   4.309  -3.383
  165    HB2  ASN  30           2HB      ASN  30   8.639   2.942  -4.507
  166    HB3  ASN  30           1HB      ASN  30   8.505   2.244  -2.913
  167   HD21  ASN  30          1HD2      ASN  30   7.619   0.230  -2.671
  168   HD22  ASN  30          2HD2      ASN  30   7.273  -0.803  -4.011
  169    H    SER  31           H        SER  31   6.985   4.222  -5.844
  170    HA   SER  31           HA       SER  31   4.372   4.697  -6.627
  171    HB2  SER  31           2HB      SER  31   6.758   4.185  -8.390
  172    HB3  SER  31           1HB      SER  31   5.323   5.146  -8.771
  173    HG   SER  31           HG       SER  31   5.890   6.444  -6.930
  174    H    ARG  32           H        ARG  32   6.069   1.683  -6.628
  175    HA   ARG  32           HA       ARG  32   4.496   0.538  -8.730
  176    HB2  ARG  32           2HB      ARG  32   6.644  -0.522  -6.930
  177    HB3  ARG  32           1HB      ARG  32   5.769  -1.530  -8.077
  178    HG2  ARG  32           2HG      ARG  32   6.583  -0.273  -9.922
  179    HG3  ARG  32           1HG      ARG  32   7.248   0.962  -8.861
  180    HD2  ARG  32           2HD      ARG  32   8.182  -1.897  -8.754
  181    HD3  ARG  32           1HD      ARG  32   8.908  -0.714  -9.842
  182    HE   ARG  32           HE       ARG  32   8.934   0.513  -7.432
  183   HH11  ARG  32          1HH1      ARG  32  10.209  -2.639  -8.487
  184   HH12  ARG  32          2HH1      ARG  32  11.529  -2.585  -7.415
  185   HH21  ARG  32          1HH2      ARG  32  10.752   0.585  -6.059
  186   HH22  ARG  32          2HH2      ARG  32  11.822  -0.746  -5.969
  187    H    CYS  33           H        CYS  33   3.741   1.250  -5.631
  188    HA   CYS  33           HA       CYS  33   2.164  -1.176  -5.298
  189    HB2  CYS  33           2HB      CYS  33   3.373  -0.378  -3.300
  190    HB3  CYS  33           1HB      CYS  33   2.533   1.165  -3.405
  191    HA   PRO  34           HA       PRO  34  -1.190   0.962  -7.318
  192    HB2  PRO  34           2HB      PRO  34  -3.177  -0.814  -6.679
  193    HB3  PRO  34           1HB      PRO  34  -2.009  -1.080  -7.978
  194    HG2  PRO  34           2HG      PRO  34  -1.996  -2.132  -5.178
  195    HG3  PRO  34           1HG      PRO  34  -1.631  -2.984  -6.686
  196    HD2  PRO  34           2HD      PRO  34   0.313  -2.113  -5.064
  197    HD3  PRO  34           1HD      PRO  34   0.508  -2.072  -6.829
  198    H    CYS  35           H        CYS  35  -1.045   0.251  -4.004
  199    HA   CYS  35           HA       CYS  35  -3.434   1.690  -3.382
  200    HB2  CYS  35           2HB      CYS  35  -1.253   0.641  -1.598
  201    HB3  CYS  35           1HB      CYS  35  -2.666   1.502  -0.997
  202    H    TYR  36           H        TYR  36  -0.035   2.237  -2.696
  203    HA   TYR  36           HA       TYR  36  -0.103   4.785  -1.685
  204    HB2  TYR  36           2HB      TYR  36   1.881   3.433  -1.643
  205    HB3  TYR  36           1HB      TYR  36   1.964   3.420  -3.398
  206    HD1  TYR  36           1HD      TYR  36   2.433   5.496  -0.387
  207    HD2  TYR  36           2HD      TYR  36   2.991   5.210  -4.590
  208    HE1  TYR  36           1HE      TYR  36   3.938   7.438  -0.320
  209    HE2  TYR  36           2HE      TYR  36   4.477   7.133  -4.550
  210    HH   TYR  36           HH       TYR  36   4.905   9.046  -3.157
  211    H    LYS  37           H        LYS  37   0.412   3.857  -5.062
  212    HA   LYS  37           HA       LYS  37   0.730   6.524  -5.965
  213    HB2  LYS  37           2HB      LYS  37   1.761   4.478  -6.956
  214    HB3  LYS  37           1HB      LYS  37   0.168   4.050  -7.565
  215    HG2  LYS  37           2HG      LYS  37   0.158   6.183  -8.849
  216    HG3  LYS  37           1HG      LYS  37   1.812   6.450  -8.291
  217    HD2  LYS  37           2HD      LYS  37   1.786   5.481 -10.547
  218    HD3  LYS  37           1HD      LYS  37   2.524   4.381  -9.382
  219    HE2  LYS  37           2HE      LYS  37   0.469   3.086  -9.253
  220    HE3  LYS  37           1HE      LYS  37  -0.343   4.230 -10.323
  221    HZ1  LYS  37           3HZ      LYS  37   0.301   2.336 -11.555
  222    HZ2  LYS  37           1HZ      LYS  37   1.915   2.424 -11.023
  223    HZ3  LYS  37           2HZ      LYS  37   1.292   3.611 -12.023
  224    H    SER  38           H        SER  38  -2.050   4.377  -5.764
  225    HA   SER  38           HA       SER  38  -3.595   6.299  -7.329
  226    HB2  SER  38           2HB      SER  38  -4.296   3.461  -6.556
  227    HB3  SER  38           1HB      SER  38  -5.261   4.517  -7.587
  228    HG   SER  38           HG       SER  38  -4.113   3.845  -9.150
  229    H    TYR  39           H        TYR  39  -2.800   6.233  -4.316
  230    HA   TYR  39           HA       TYR  39  -3.602   7.165  -2.408
  231    HB2  TYR  39           2HB      TYR  39  -5.941   8.018  -4.134
  232    HB3  TYR  39           1HB      TYR  39  -5.635   8.588  -2.500
  233    HD1  TYR  39           2HD      TYR  39  -3.495   9.889  -2.077
  234    HD2  TYR  39           1HD      TYR  39  -4.943   9.056  -5.980
  235    HE1  TYR  39           2HE      TYR  39  -2.110  11.715  -2.969
  236    HE2  TYR  39           1HE      TYR  39  -3.568  10.878  -6.889
  237    HH   TYR  39           HH       TYR  39  -1.076  12.337  -5.198
  238    H    ASN  40           H        ASN  40  -4.189   4.400  -2.870
  239    HA   ASN  40           HA       ASN  40  -6.755   4.131  -1.464
  240    HB2  ASN  40           2HB      ASN  40  -5.134   1.893  -2.732
  241    HB3  ASN  40           1HB      ASN  40  -6.661   1.718  -1.899
  242   HD21  ASN  40          1HD2      ASN  40  -5.120   2.537  -4.855
  243   HD22  ASN  40          2HD2      ASN  40  -6.575   2.805  -5.739
  244    H    SER  41           H        SER  41  -6.816   2.499   0.270
  245    HA   SER  41           HA       SER  41  -4.607   3.011   2.046
  246    HB2  SER  41           2HB      SER  41  -6.390   2.172   3.656
  247    HB3  SER  41           1HB      SER  41  -6.672   3.719   2.847
  248    HG   SER  41           HG       SER  41  -8.402   1.831   2.852
  249    H    CYS  42           H        CYS  42  -3.620   1.304   3.165
  250    HA   CYS  42           HA       CYS  42  -4.110  -1.299   2.027
  251    HB2  CYS  42           2HB      CYS  42  -1.813  -0.303   3.678
  252    HB3  CYS  42           1HB      CYS  42  -2.116  -2.028   3.510
  253    H    ALA  43           H        ALA  43  -6.097  -1.148   2.914
  254    HA   ALA  43           HA       ALA  43  -6.171  -2.514   5.495
  255    HB1  ALA  43           1HB      ALA  43  -8.174  -0.500   4.429
  256    HB2  ALA  43           2HB      ALA  43  -7.104  -0.262   5.812
  257    HB3  ALA  43           3HB      ALA  43  -8.389  -1.467   5.890
  258    H    GLY  44           H        GLY  44  -6.593  -4.510   4.936
  259    HA2  GLY  44           2HA      GLY  44  -8.105  -6.161   4.099
  260    HA3  GLY  44           1HA      GLY  44  -8.617  -5.008   2.866
  261    H    CYS  45           H        CYS  45  -5.328  -4.889   3.282
  262    HA   CYS  45           HA       CYS  45  -4.892  -6.345   0.788
  263    HB2  CYS  45           2HB      CYS  45  -3.049  -4.497   2.329
  264    HB3  CYS  45           1HB      CYS  45  -2.682  -5.252   0.792
  265    H    HIS  46           H        HIS  46  -3.080  -7.784   0.661
  266    HA   HIS  46           HA       HIS  46  -2.547  -9.098   3.231
  267    HB2  HIS  46           2HB      HIS  46  -2.830 -10.216   0.448
  268    HB3  HIS  46           1HB      HIS  46  -1.930 -11.101   1.674
  269    HD1  HIS  46           1HD      HIS  46  -3.559 -13.002   2.006
  270    HD2  HIS  46           2HD      HIS  46  -5.347  -9.281   2.415
  271    HE1  HIS  46           1HE      HIS  46  -5.840 -13.452   2.945
  272    HE2  HIS  46           2HE      HIS  46  -6.965 -11.198   3.004
  273    H    CYS  47           H        CYS  47  -1.254  -6.853   2.128
  274    HA   CYS  47           HA       CYS  47   1.285  -7.614   1.150
  275    HB2  CYS  47           2HB      CYS  47   1.880  -5.227   1.660
  276    HB3  CYS  47           1HB      CYS  47   0.572  -5.495   0.514
  277    H    VAL  48           H        VAL  48   3.007  -8.024   2.097
  278    HA   VAL  48           HA       VAL  48   3.147  -8.105   5.042
  279    HB   VAL  48           HB       VAL  48   4.827  -9.618   2.997
  280   HG11  VAL  48          1HG1      VAL  48   5.647 -10.924   4.897
  281   HG12  VAL  48          2HG1      VAL  48   4.703  -9.920   5.995
  282   HG13  VAL  48          3HG1      VAL  48   6.037  -9.213   5.083
  283   HG21  VAL  48          3HG2      VAL  48   2.524 -10.417   3.001
  284   HG22  VAL  48          1HG2      VAL  48   2.584 -10.618   4.753
  285   HG23  VAL  48          2HG2      VAL  48   3.601 -11.617   3.715
  286    H    GLY  49           H        GLY  49   4.540  -6.749   6.009
  287    HA2  GLY  49           2HA      GLY  49   6.274  -5.248   6.277
  288    HA3  GLY  49           1HA      GLY  49   6.909  -5.780   4.721
  289    H    CYS  50           H        CYS  50   3.894  -4.269   5.772
  290    HA   CYS  50           HA       CYS  50   3.944  -2.620   3.420
  291    HB2  CYS  50           2HB      CYS  50   1.872  -3.669   3.756
  292    HB3  CYS  50           1HB      CYS  50   1.867  -3.305   5.476
  293    H    LYS  51           H        LYS  51   4.772  -0.648   3.587
  294    HA   LYS  51           HA       LYS  51   4.086   0.851   5.999
  295    HB2  LYS  51           2HB      LYS  51   6.448   1.240   4.130
  296    HB3  LYS  51           1HB      LYS  51   5.991   2.360   5.398
  297    HG2  LYS  51           2HG      LYS  51   6.830  -0.494   5.837
  298    HG3  LYS  51           1HG      LYS  51   7.883   0.913   6.001
  299    HD2  LYS  51           2HD      LYS  51   6.384   1.788   7.762
  300    HD3  LYS  51           1HD      LYS  51   5.391   0.340   7.611
  301    HE2  LYS  51           2HE      LYS  51   7.237  -1.054   8.281
  302    HE3  LYS  51           1HE      LYS  51   8.312   0.345   8.326
  303    HZ1  LYS  51           3HZ      LYS  51   7.016   1.239  10.129
  304    HZ2  LYS  51           1HZ      LYS  51   7.552  -0.315  10.503
  305    HZ3  LYS  51           2HZ      LYS  51   5.939  -0.060  10.071
  306    H    ASN  52           H        ASN  52   2.170   1.483   5.205
  307    HA   ASN  52           HA       ASN  52   2.275   2.968   2.694
  308    HB2  ASN  52           2HB      ASN  52   0.636   0.998   2.896
  309    HB3  ASN  52           1HB      ASN  52  -0.255   2.010   4.028
  310   HD21  ASN  52          1HD2      ASN  52  -1.316   1.076   1.616
  311   HD22  ASN  52          2HD2      ASN  52  -1.632   2.460   0.632
  312    HA   PRO  53           HA       PRO  53   1.654   6.403   5.544
  313    HB2  PRO  53           2HB      PRO  53   1.744   8.341   3.606
  314    HB3  PRO  53           1HB      PRO  53   3.188   7.651   4.352
  315    HG2  PRO  53           2HG      PRO  53   1.942   7.047   1.716
  316    HG3  PRO  53           1HG      PRO  53   3.655   7.126   2.158
  317    HD2  PRO  53           2HD      PRO  53   2.271   4.804   1.837
  318    HD3  PRO  53           1HD      PRO  53   3.669   4.947   2.924
  319    H    HIS  54           H        HIS  54  -0.181   5.262   2.936
  320    HA   HIS  54           HA       HIS  54  -2.361   7.140   3.373
  321    HB2  HIS  54           2HB      HIS  54  -2.112   4.952   1.291
  322    HB3  HIS  54           1HB      HIS  54  -3.450   6.078   1.426
  323    HD1  HIS  54           1HD      HIS  54  -3.153   8.350   0.333
  324    HD2  HIS  54           2HD      HIS  54   0.310   6.078   0.338
  325    HE1  HIS  54           1HE      HIS  54  -1.575   9.531  -1.208
  326    HE2  HIS  54           2HE      HIS  54   0.421   8.057  -1.352
  327    H    LYS  55           H        LYS  55  -3.246   6.559   5.160
  328    HA   LYS  55           HA       LYS  55  -4.099   3.814   5.545
  329    HB2  LYS  55           2HB      LYS  55  -5.019   4.723   7.799
  330    HB3  LYS  55           1HB      LYS  55  -3.287   4.551   7.636
  331    HG2  LYS  55           2HG      LYS  55  -4.638   7.181   7.133
  332    HG3  LYS  55           1HG      LYS  55  -4.218   6.667   8.768
  333    HD2  LYS  55           2HD      LYS  55  -1.891   6.468   8.142
  334    HD3  LYS  55           1HD      LYS  55  -2.250   6.852   6.470
  335    HE2  LYS  55           2HE      LYS  55  -3.044   9.071   7.212
  336    HE3  LYS  55           1HE      LYS  55  -2.564   8.641   8.854
  337    HZ1  LYS  55           3HZ      LYS  55  -0.743   8.762   6.513
  338    HZ2  LYS  55           1HZ      LYS  55  -0.283   8.376   8.081
  339    HZ3  LYS  55           2HZ      LYS  55  -0.830   9.918   7.720
  340    H    GLU  56           H        GLU  56  -6.482   3.786   6.564
  341    HA   GLU  56           HA       GLU  56  -7.888   4.606   4.223
  342    HB2  GLU  56           2HB      GLU  56  -8.130   2.341   5.210
  343    HB3  GLU  56           1HB      GLU  56  -8.969   3.078   6.568
  344    HG2  GLU  56           2HG      GLU  56 -10.815   3.638   5.290
  345    HG3  GLU  56           1HG      GLU  56  -9.912   3.537   3.777
  346    H    ASP  57           H        ASP  57  -8.269   6.592   4.115
  347    HA   ASP  57           HA       ASP  57  -9.488   8.055   6.305
  348    HB2  ASP  57           2HB      ASP  57  -7.776   9.129   4.763
  349    HB3  ASP  57           1HB      ASP  57  -8.988   8.910   3.493
  350    H    TYR  58           H        TYR  58 -11.510   7.903   6.537
  351    HA   TYR  58           HA       TYR  58 -13.324   7.822   4.259
  352    HB2  TYR  58           2HB      TYR  58 -12.722   5.461   4.895
  353    HB3  TYR  58           1HB      TYR  58 -13.390   5.776   6.485
  354    HD1  TYR  58           1HD      TYR  58 -14.169   5.358   2.925
  355    HD2  TYR  58           2HD      TYR  58 -15.780   5.716   6.842
  356    HE1  TYR  58           1HE      TYR  58 -16.338   4.576   2.097
  357    HE2  TYR  58           2HE      TYR  58 -17.963   4.942   6.021
  358    HH   TYR  58           HH       TYR  58 -19.208   4.703   4.005
  359    H    VAL  59           H        VAL  59 -14.944   9.189   4.711
  360    HA   VAL  59           HA       VAL  59 -15.094  10.157   7.391
  361    HB   VAL  59           HB       VAL  59 -16.749  11.871   6.480
  362   HG11  VAL  59          1HG1      VAL  59 -15.011  13.207   5.363
  363   HG12  VAL  59          2HG1      VAL  59 -13.994  11.772   5.253
  364   HG13  VAL  59          3HG1      VAL  59 -14.422  12.435   6.832
  365   HG21  VAL  59          3HG2      VAL  59 -17.472  10.670   4.469
  366   HG22  VAL  59          1HG2      VAL  59 -15.833  10.764   3.826
  367   HG23  VAL  59          2HG2      VAL  59 -16.776  12.236   4.050
  Start of MODEL    6
    1    H1   SER   8           1HT      SER   8 -16.772   4.923   1.157
    2    H2   SER   8           2HT      SER   8 -17.347   3.535   0.370
    3    H3   SER   8           3HT      SER   8 -17.116   4.941  -0.492
    4    HA   SER   8           HA       SER   8 -14.769   4.806  -0.193
    5    HB2  SER   8           2HB      SER   8 -14.915   3.635   2.054
    6    HB3  SER   8           1HB      SER   8 -15.376   2.174   1.196
    7    HG   SER   8           HG       SER   8 -12.888   3.545   1.134
    8    HA   PRO   9           HA       PRO   9 -15.819   2.656  -4.061
    9    HB2  PRO   9           2HB      PRO   9 -13.148   3.745  -4.761
   10    HB3  PRO   9           1HB      PRO   9 -14.675   3.907  -5.630
   11    HG2  PRO   9           2HG      PRO   9 -13.611   5.964  -4.305
   12    HG3  PRO   9           1HG      PRO   9 -15.363   5.708  -4.354
   13    HD2  PRO   9           2HD      PRO   9 -13.431   5.150  -2.144
   14    HD3  PRO   9           1HD      PRO   9 -15.099   5.756  -2.088
   15    HA   PRO  10           HA       PRO  10 -13.487  -1.023  -3.292
   16    HB2  PRO  10           2HB      PRO  10 -13.090  -1.800  -5.968
   17    HB3  PRO  10           1HB      PRO  10 -14.450  -2.262  -4.943
   18    HG2  PRO  10           2HG      PRO  10 -14.268  -0.121  -7.000
   19    HG3  PRO  10           1HG      PRO  10 -15.653  -1.134  -6.545
   20    HD2  PRO  10           2HD      PRO  10 -15.449   1.444  -5.810
   21    HD3  PRO  10           1HD      PRO  10 -16.197   0.222  -4.763
   22    H    LYS  11           H        LYS  11 -11.390  -1.200  -2.828
   23    HA   LYS  11           HA       LYS  11  -9.570   0.354  -4.475
   24    HB2  LYS  11           2HB      LYS  11  -8.154   0.689  -2.533
   25    HB3  LYS  11           1HB      LYS  11  -9.777   1.245  -2.208
   26    HG2  LYS  11           2HG      LYS  11 -10.196  -0.767  -0.879
   27    HG3  LYS  11           1HG      LYS  11  -8.556  -1.330  -1.226
   28    HD2  LYS  11           2HD      LYS  11  -7.688   0.791  -0.217
   29    HD3  LYS  11           1HD      LYS  11  -9.336   1.175   0.269
   30    HE2  LYS  11           2HE      LYS  11  -7.788  -1.269   1.109
   31    HE3  LYS  11           1HE      LYS  11  -7.990   0.187   2.075
   32    HZ1  LYS  11           3HZ      LYS  11 -10.361  -0.234   2.160
   33    HZ2  LYS  11           1HZ      LYS  11  -9.488  -1.553   2.719
   34    HZ3  LYS  11           2HZ      LYS  11 -10.194  -1.612   1.193
   35    HA   PRO  12           HA       PRO  12  -7.425  -3.338  -5.574
   36    HB2  PRO  12           2HB      PRO  12  -4.867  -1.928  -5.370
   37    HB3  PRO  12           1HB      PRO  12  -5.651  -2.581  -6.801
   38    HG2  PRO  12           2HG      PRO  12  -5.446   0.066  -6.369
   39    HG3  PRO  12           1HG      PRO  12  -6.810  -0.665  -7.230
   40    HD2  PRO  12           2HD      PRO  12  -6.650   0.354  -4.434
   41    HD3  PRO  12           1HD      PRO  12  -7.983   0.435  -5.605
   42    H    LYS  13           H        LYS  13  -6.333  -5.018  -4.618
   43    HA   LYS  13           HA       LYS  13  -5.157  -4.467  -2.000
   44    HB2  LYS  13           2HB      LYS  13  -6.311  -7.133  -2.919
   45    HB3  LYS  13           1HB      LYS  13  -5.555  -6.781  -1.375
   46    HG2  LYS  13           2HG      LYS  13  -7.887  -6.903  -1.006
   47    HG3  LYS  13           1HG      LYS  13  -7.431  -5.204  -0.889
   48    HD2  LYS  13           2HD      LYS  13  -8.237  -4.848  -3.170
   49    HD3  LYS  13           1HD      LYS  13  -8.665  -6.553  -3.283
   50    HE2  LYS  13           2HE      LYS  13 -10.260  -6.280  -1.470
   51    HE3  LYS  13           1HE      LYS  13  -9.810  -4.581  -1.315
   52    HZ1  LYS  13           3HZ      LYS  13 -11.833  -4.876  -2.572
   53    HZ2  LYS  13           1HZ      LYS  13 -11.043  -5.806  -3.732
   54    HZ3  LYS  13           2HZ      LYS  13 -10.643  -4.174  -3.528
   55    H    CYS  14           H        CYS  14  -3.123  -4.550  -2.055
   56    HA   CYS  14           HA       CYS  14  -1.782  -5.873  -4.268
   57    HB2  CYS  14           2HB      CYS  14   0.201  -4.605  -3.506
   58    HB3  CYS  14           1HB      CYS  14  -1.176  -3.565  -3.842
   59    H    ARG  15           H        ARG  15  -0.005  -7.252  -3.875
   60    HA   ARG  15           HA       ARG  15  -0.168  -8.658  -1.302
   61    HB2  ARG  15           2HB      ARG  15   0.553  -9.744  -4.049
   62    HB3  ARG  15           1HB      ARG  15   0.779 -10.644  -2.560
   63    HG2  ARG  15           2HG      ARG  15  -1.229 -11.443  -3.525
   64    HG3  ARG  15           1HG      ARG  15  -1.709 -10.418  -2.177
   65    HD2  ARG  15           2HD      ARG  15  -2.051  -8.565  -3.835
   66    HD3  ARG  15           1HD      ARG  15  -1.753  -9.738  -5.110
   67    HE   ARG  15           HE       ARG  15  -3.823 -10.350  -3.188
   68   HH11  ARG  15          1HH1      ARG  15  -3.029  -9.375  -6.491
   69   HH12  ARG  15          2HH1      ARG  15  -4.635  -9.421  -7.055
   70   HH21  ARG  15          1HH2      ARG  15  -6.045 -10.465  -3.984
   71   HH22  ARG  15          2HH2      ARG  15  -6.370 -10.107  -5.605
   72    H    CYS  16           H        CYS  16   1.295  -6.363  -1.833
   73    HA   CYS  16           HA       CYS  16   4.000  -6.651  -2.370
   74    HB2  CYS  16           2HB      CYS  16   2.582  -4.751  -0.508
   75    HB3  CYS  16           1HB      CYS  16   4.279  -4.598  -0.929
   76    H    GLY  17           H        GLY  17   5.708  -7.329  -1.254
   77    HA2  GLY  17           2HA      GLY  17   6.914  -7.760   0.768
   78    HA3  GLY  17           1HA      GLY  17   5.370  -8.039   1.578
   79    H    ILE  18           H        ILE  18   4.124  -9.592  -0.223
   80    HA   ILE  18           HA       ILE  18   5.468 -12.136  -0.001
   81    HB   ILE  18           HB       ILE  18   2.952 -11.488  -1.595
   82   HG12  ILE  18          2HG1      ILE  18   3.178 -12.163   1.354
   83   HG13  ILE  18          1HG1      ILE  18   2.650 -10.646   0.668
   84   HG21  ILE  18          1HG2      ILE  18   2.388 -13.847  -1.177
   85   HG22  ILE  18          2HG2      ILE  18   3.903 -14.049  -0.301
   86   HG23  ILE  18          3HG2      ILE  18   3.926 -13.691  -2.025
   87   HD11  ILE  18          3HD1      ILE  18   0.676 -11.711  -0.283
   88   HD12  ILE  18          1HD1      ILE  18   0.752 -11.941   1.462
   89   HD13  ILE  18          2HD1      ILE  18   1.188 -13.263   0.382
   90    H    SER  19           H        SER  19   4.278  -9.910  -2.409
   91    HA   SER  19           HA       SER  19   6.386 -10.678  -4.281
   92    HB2  SER  19           2HB      SER  19   3.719  -9.355  -4.871
   93    HB3  SER  19           1HB      SER  19   4.869 -10.029  -6.031
   94    HG   SER  19           HG       SER  19   4.335 -12.020  -5.467
   95    H    GLY  20           H        GLY  20   7.935  -9.116  -3.765
   96    HA2  GLY  20           2HA      GLY  20   7.209  -6.350  -4.075
   97    HA3  GLY  20           1HA      GLY  20   7.650  -6.787  -2.430
   98    H    SER  21           H        SER  21   8.775  -6.494  -5.722
   99    HA   SER  21           HA       SER  21  11.487  -7.133  -5.009
  100    HB2  SER  21           2HB      SER  21  11.760  -6.543  -7.486
  101    HB3  SER  21           1HB      SER  21  10.750  -7.942  -7.095
  102    HG   SER  21           HG       SER  21   9.320  -6.927  -8.260
  103    H    SER  22           H        SER  22   9.478  -4.416  -5.026
  104    HA   SER  22           HA       SER  22  11.583  -2.513  -5.643
  105    HB2  SER  22           2HB      SER  22   8.677  -2.032  -5.006
  106    HB3  SER  22           1HB      SER  22   9.804  -0.917  -5.786
  107    HG   SER  22           HG       SER  22   8.757  -3.346  -6.806
  108    H    ASN  23           H        ASN  23  12.343  -3.704  -3.438
  109    HA   ASN  23           HA       ASN  23  13.234  -3.321  -1.388
  110    HB2  ASN  23           2HB      ASN  23  11.848  -0.631  -1.516
  111    HB3  ASN  23           1HB      ASN  23  12.927  -1.120  -0.221
  112   HD21  ASN  23          1HD2      ASN  23  13.085   1.076  -2.119
  113   HD22  ASN  23          2HD2      ASN  23  14.581   0.909  -2.938
  114    H    THR  24           H        THR  24  12.556  -4.536   0.254
  115    HA   THR  24           HA       THR  24   9.797  -4.770   0.834
  116    HB   THR  24           HB       THR  24  10.685  -6.222   2.749
  117    HG1  THR  24           1HG      THR  24  12.734  -5.854   3.100
  118   HG21  THR  24          3HG2      THR  24   9.902  -7.152   0.632
  119   HG22  THR  24          1HG2      THR  24  11.331  -8.023   1.181
  120   HG23  THR  24          2HG2      THR  24  11.467  -6.824  -0.107
  121    H    LEU  25           H        LEU  25  11.937  -2.443   1.728
  122    HA   LEU  25           HA       LEU  25  10.711  -1.940   4.344
  123    HB2  LEU  25           2HB      LEU  25  12.979  -0.518   2.931
  124    HB3  LEU  25           1HB      LEU  25  12.349  -0.050   4.488
  125    HG   LEU  25           HG       LEU  25  14.382  -1.153   4.867
  126   HD11  LEU  25          1HD1      LEU  25  13.805  -3.077   6.222
  127   HD12  LEU  25          2HD1      LEU  25  12.198  -3.094   5.500
  128   HD13  LEU  25          3HD1      LEU  25  12.713  -1.715   6.473
  129   HD21  LEU  25          3HD2      LEU  25  14.923  -3.411   4.088
  130   HD22  LEU  25          1HD2      LEU  25  14.666  -2.304   2.739
  131   HD23  LEU  25          2HD2      LEU  25  13.410  -3.460   3.183
  132    H    THR  26           H        THR  26  10.328  -1.119   1.098
  133    HA   THR  26           HA       THR  26   8.790   1.296   1.768
  134    HB   THR  26           HB       THR  26  10.535   1.083  -0.710
  135    HG1  THR  26           1HG      THR  26  11.198   2.250   1.798
  136   HG21  THR  26          3HG2      THR  26   9.444   3.443   0.852
  137   HG22  THR  26          1HG2      THR  26   8.797   2.836  -0.672
  138   HG23  THR  26          2HG2      THR  26  10.414   3.546  -0.612
  139    H    THR  27           H        THR  27   8.182  -1.554   1.240
  140    HA   THR  27           HA       THR  27   7.588  -2.466  -1.192
  141    HB   THR  27           HB       THR  27   5.574  -2.988   0.857
  142    HG1  THR  27           1HG      THR  27   7.017  -3.476   2.465
  143   HG21  THR  27          3HG2      THR  27   7.787  -4.725  -0.259
  144   HG22  THR  27          1HG2      THR  27   6.233  -4.478  -1.071
  145   HG23  THR  27          2HG2      THR  27   6.276  -5.225   0.516
  146    H    CYS  28           H        CYS  28   5.159  -1.062   0.941
  147    HA   CYS  28           HA       CYS  28   3.426  -0.508  -1.293
  148    HB2  CYS  28           2HB      CYS  28   2.987  -0.369   1.670
  149    HB3  CYS  28           1HB      CYS  28   1.758   0.091   0.496
  150    H    ARG  29           H        ARG  29   5.868   1.106   0.021
  151    HA   ARG  29           HA       ARG  29   4.501   3.698   0.171
  152    HB2  ARG  29           2HB      ARG  29   5.837   2.780   2.119
  153    HB3  ARG  29           1HB      ARG  29   7.273   3.011   1.135
  154    HG2  ARG  29           2HG      ARG  29   6.829   5.400   1.042
  155    HG3  ARG  29           1HG      ARG  29   5.371   5.176   1.999
  156    HD2  ARG  29           2HD      ARG  29   6.741   4.254   3.825
  157    HD3  ARG  29           1HD      ARG  29   8.188   4.574   2.866
  158    HE   ARG  29           HE       ARG  29   6.711   6.908   3.044
  159   HH11  ARG  29          1HH1      ARG  29   8.608   4.791   5.154
  160   HH12  ARG  29          2HH1      ARG  29   9.062   6.022   6.231
  161   HH21  ARG  29          1HH2      ARG  29   7.287   8.606   4.573
  162   HH22  ARG  29          2HH2      ARG  29   8.294   8.234   5.891
  163    H    ASN  30           H        ASN  30   5.460   2.233  -2.308
  164    HA   ASN  30           HA       ASN  30   6.954   4.512  -3.348
  165    HB2  ASN  30           2HB      ASN  30   8.389   3.154  -4.724
  166    HB3  ASN  30           1HB      ASN  30   8.510   2.536  -3.084
  167   HD21  ASN  30          1HD2      ASN  30   7.670   0.500  -2.637
  168   HD22  ASN  30          2HD2      ASN  30   7.195  -0.591  -3.874
  169    H    SER  31           H        SER  31   6.832   4.576  -5.806
  170    HA   SER  31           HA       SER  31   4.130   4.890  -6.414
  171    HB2  SER  31           2HB      SER  31   5.235   5.532  -8.660
  172    HB3  SER  31           1HB      SER  31   5.540   6.512  -7.219
  173    HG   SER  31           HG       SER  31   7.506   6.085  -8.138
  174    H    ARG  32           H        ARG  32   5.832   2.007  -6.577
  175    HA   ARG  32           HA       ARG  32   4.464   1.142  -8.999
  176    HB2  ARG  32           2HB      ARG  32   6.374  -0.362  -7.210
  177    HB3  ARG  32           1HB      ARG  32   5.694  -0.974  -8.708
  178    HG2  ARG  32           2HG      ARG  32   6.867   0.736  -9.966
  179    HG3  ARG  32           1HG      ARG  32   7.495   1.423  -8.461
  180    HD2  ARG  32           2HD      ARG  32   8.593  -0.726  -7.980
  181    HD3  ARG  32           1HD      ARG  32   8.030  -1.337  -9.530
  182    HE   ARG  32           HE       ARG  32   9.388   0.917 -10.169
  183   HH11  ARG  32          1HH1      ARG  32  10.236  -1.959  -8.288
  184   HH12  ARG  32          2HH1      ARG  32  11.873  -1.970  -8.715
  185   HH21  ARG  32          1HH2      ARG  32  11.638   0.926 -10.790
  186   HH22  ARG  32          2HH2      ARG  32  12.704  -0.269 -10.194
  187    H    CYS  33           H        CYS  33   3.855   1.365  -5.722
  188    HA   CYS  33           HA       CYS  33   2.313  -1.064  -5.564
  189    HB2  CYS  33           2HB      CYS  33   3.472  -0.231  -3.543
  190    HB3  CYS  33           1HB      CYS  33   2.510   1.243  -3.603
  191    HA   PRO  34           HA       PRO  34  -1.080   0.835  -7.705
  192    HB2  PRO  34           2HB      PRO  34  -2.988  -1.032  -7.007
  193    HB3  PRO  34           1HB      PRO  34  -1.834  -1.227  -8.327
  194    HG2  PRO  34           2HG      PRO  34  -1.709  -2.282  -5.533
  195    HG3  PRO  34           1HG      PRO  34  -1.293  -3.098  -7.051
  196    HD2  PRO  34           2HD      PRO  34   0.591  -2.128  -5.445
  197    HD3  PRO  34           1HD      PRO  34   0.758  -2.016  -7.212
  198    H    CYS  35           H        CYS  35  -1.165   0.071  -4.343
  199    HA   CYS  35           HA       CYS  35  -3.615   1.470  -3.809
  200    HB2  CYS  35           2HB      CYS  35  -1.436   0.563  -1.935
  201    HB3  CYS  35           1HB      CYS  35  -2.995   1.207  -1.431
  202    H    TYR  36           H        TYR  36  -0.274   2.103  -2.872
  203    HA   TYR  36           HA       TYR  36  -0.351   4.571  -1.740
  204    HB2  TYR  36           2HB      TYR  36   1.615   3.161  -1.851
  205    HB3  TYR  36           1HB      TYR  36   1.701   3.377  -3.586
  206    HD1  TYR  36           1HD      TYR  36   2.261   4.978  -0.333
  207    HD2  TYR  36           2HD      TYR  36   2.737   5.334  -4.535
  208    HE1  TYR  36           1HE      TYR  36   3.861   6.813   0.008
  209    HE2  TYR  36           2HE      TYR  36   4.314   7.157  -4.238
  210    HH   TYR  36           HH       TYR  36   5.670   7.856  -1.131
  211    H    LYS  37           H        LYS  37   0.253   3.909  -5.143
  212    HA   LYS  37           HA       LYS  37   0.514   6.565  -6.005
  213    HB2  LYS  37           2HB      LYS  37   1.151   4.204  -7.010
  214    HB3  LYS  37           1HB      LYS  37  -0.410   4.333  -7.782
  215    HG2  LYS  37           2HG      LYS  37   1.824   6.325  -8.109
  216    HG3  LYS  37           1HG      LYS  37   1.578   4.964  -9.181
  217    HD2  LYS  37           2HD      LYS  37   0.486   6.573 -10.404
  218    HD3  LYS  37           1HD      LYS  37  -0.851   6.059  -9.385
  219    HE2  LYS  37           2HE      LYS  37  -0.744   8.493  -9.482
  220    HE3  LYS  37           1HE      LYS  37  -0.385   7.925  -7.854
  221    HZ1  LYS  37           3HZ      LYS  37   1.148   9.669  -8.558
  222    HZ2  LYS  37           1HZ      LYS  37   1.635   8.727  -9.870
  223    HZ3  LYS  37           2HZ      LYS  37   1.960   8.219  -8.313
  224    H    SER  38           H        SER  38  -2.256   4.382  -5.787
  225    HA   SER  38           HA       SER  38  -3.960   6.289  -7.162
  226    HB2  SER  38           2HB      SER  38  -4.617   3.573  -6.033
  227    HB3  SER  38           1HB      SER  38  -5.619   4.531  -7.130
  228    HG   SER  38           HG       SER  38  -3.512   2.915  -7.642
  229    H    TYR  39           H        TYR  39  -2.804   6.476  -4.274
  230    HA   TYR  39           HA       TYR  39  -3.360   7.521  -2.343
  231    HB2  TYR  39           2HB      TYR  39  -5.996   8.147  -3.698
  232    HB3  TYR  39           1HB      TYR  39  -5.405   8.891  -2.221
  233    HD1  TYR  39           2HD      TYR  39  -3.473  10.458  -2.331
  234    HD2  TYR  39           1HD      TYR  39  -5.269   8.857  -5.832
  235    HE1  TYR  39           2HE      TYR  39  -2.407  12.216  -3.677
  236    HE2  TYR  39           1HE      TYR  39  -4.216  10.602  -7.183
  237    HH   TYR  39           HH       TYR  39  -3.376  12.856  -6.823
  238    H    ASN  40           H        ASN  40  -4.139   4.677  -2.878
  239    HA   ASN  40           HA       ASN  40  -6.372   4.506  -1.014
  240    HB2  ASN  40           2HB      ASN  40  -5.342   2.390  -2.912
  241    HB3  ASN  40           1HB      ASN  40  -6.523   2.065  -1.655
  242   HD21  ASN  40          1HD2      ASN  40  -6.032   3.120  -4.811
  243   HD22  ASN  40          2HD2      ASN  40  -7.643   3.647  -5.146
  244    H    SER  41           H        SER  41  -6.367   2.934   0.598
  245    HA   SER  41           HA       SER  41  -3.845   2.822   1.950
  246    HB2  SER  41           2HB      SER  41  -5.598   2.045   3.721
  247    HB3  SER  41           1HB      SER  41  -5.524   3.740   3.201
  248    HG   SER  41           HG       SER  41  -7.601   2.119   3.040
  249    H    CYS  42           H        CYS  42  -3.625   0.726   3.302
  250    HA   CYS  42           HA       CYS  42  -4.141  -1.531   1.523
  251    HB2  CYS  42           2HB      CYS  42  -1.823  -0.994   3.337
  252    HB3  CYS  42           1HB      CYS  42  -2.161  -2.596   2.685
  253    H    ALA  43           H        ALA  43  -5.611  -0.361   3.971
  254    HA   ALA  43           HA       ALA  43  -5.648  -2.544   5.770
  255    HB1  ALA  43           1HB      ALA  43  -7.769  -1.541   6.598
  256    HB2  ALA  43           2HB      ALA  43  -7.738  -0.409   5.244
  257    HB3  ALA  43           3HB      ALA  43  -6.474  -0.354   6.469
  258    H    GLY  44           H        GLY  44  -6.281  -4.505   5.212
  259    HA2  GLY  44           2HA      GLY  44  -8.015  -5.975   4.469
  260    HA3  GLY  44           1HA      GLY  44  -8.429  -4.778   3.244
  261    H    CYS  45           H        CYS  45  -5.334  -4.487   2.898
  262    HA   CYS  45           HA       CYS  45  -5.084  -6.436   0.788
  263    HB2  CYS  45           2HB      CYS  45  -2.992  -4.603   1.984
  264    HB3  CYS  45           1HB      CYS  45  -2.786  -5.573   0.543
  265    H    HIS  46           H        HIS  46  -3.535  -8.109   0.759
  266    HA   HIS  46           HA       HIS  46  -2.981  -9.186   3.418
  267    HB2  HIS  46           2HB      HIS  46  -2.934 -10.455   0.673
  268    HB3  HIS  46           1HB      HIS  46  -2.341 -11.283   2.099
  269    HD1  HIS  46           1HD      HIS  46  -4.048 -12.990   2.664
  270    HD2  HIS  46           2HD      HIS  46  -5.802  -9.381   1.608
  271    HE1  HIS  46           1HE      HIS  46  -6.512 -13.328   2.950
  272    HE2  HIS  46           2HE      HIS  46  -7.488 -11.033   2.606
  273    H    CYS  47           H        CYS  47  -1.526  -7.007   2.001
  274    HA   CYS  47           HA       CYS  47   1.047  -7.968   1.353
  275    HB2  CYS  47           2HB      CYS  47   1.730  -5.549   1.564
  276    HB3  CYS  47           1HB      CYS  47   0.519  -5.913   0.355
  277    H    VAL  48           H        VAL  48   2.751  -8.245   2.452
  278    HA   VAL  48           HA       VAL  48   2.597  -8.016   5.396
  279    HB   VAL  48           HB       VAL  48   4.379  -9.879   3.798
  280   HG11  VAL  48          1HG1      VAL  48   5.202  -9.365   6.026
  281   HG12  VAL  48          2HG1      VAL  48   4.707 -11.049   5.909
  282   HG13  VAL  48          3HG1      VAL  48   3.668  -9.882   6.728
  283   HG21  VAL  48          3HG2      VAL  48   2.066 -10.514   3.393
  284   HG22  VAL  48          1HG2      VAL  48   1.753 -10.552   5.131
  285   HG23  VAL  48          2HG2      VAL  48   2.871 -11.711   4.403
  286    H    GLY  49           H        GLY  49   3.953  -6.514   6.187
  287    HA2  GLY  49           2HA      GLY  49   5.925  -5.262   6.349
  288    HA3  GLY  49           1HA      GLY  49   6.459  -5.953   4.812
  289    H    CYS  50           H        CYS  50   3.458  -4.383   5.675
  290    HA   CYS  50           HA       CYS  50   3.613  -2.775   3.301
  291    HB2  CYS  50           2HB      CYS  50   1.512  -3.779   3.561
  292    HB3  CYS  50           1HB      CYS  50   1.451  -3.400   5.281
  293    H    LYS  51           H        LYS  51   4.493  -0.830   3.466
  294    HA   LYS  51           HA       LYS  51   3.878   0.724   5.874
  295    HB2  LYS  51           2HB      LYS  51   6.146   1.086   3.893
  296    HB3  LYS  51           1HB      LYS  51   5.870   2.081   5.308
  297    HG2  LYS  51           2HG      LYS  51   6.596  -0.845   5.318
  298    HG3  LYS  51           1HG      LYS  51   7.698   0.489   5.630
  299    HD2  LYS  51           2HD      LYS  51   5.268  -0.221   7.293
  300    HD3  LYS  51           1HD      LYS  51   6.941  -0.599   7.696
  301    HE2  LYS  51           2HE      LYS  51   7.457   1.807   7.781
  302    HE3  LYS  51           1HE      LYS  51   5.780   2.172   7.386
  303    HZ1  LYS  51           3HZ      LYS  51   6.735   0.791   9.830
  304    HZ2  LYS  51           1HZ      LYS  51   5.112   1.089   9.457
  305    HZ3  LYS  51           2HZ      LYS  51   6.169   2.370   9.730
  306    H    ASN  52           H        ASN  52   1.923   1.414   5.085
  307    HA   ASN  52           HA       ASN  52   2.047   2.950   2.594
  308    HB2  ASN  52           2HB      ASN  52   0.375   1.040   2.756
  309    HB3  ASN  52           1HB      ASN  52  -0.459   1.986   3.982
  310   HD21  ASN  52          1HD2      ASN  52  -1.547   1.146   1.505
  311   HD22  ASN  52          2HD2      ASN  52  -1.945   2.573   0.618
  312    HA   PRO  53           HA       PRO  53   1.601   6.379   5.509
  313    HB2  PRO  53           2HB      PRO  53   2.065   8.362   3.723
  314    HB3  PRO  53           1HB      PRO  53   3.362   7.391   4.427
  315    HG2  PRO  53           2HG      PRO  53   2.046   7.147   1.756
  316    HG3  PRO  53           1HG      PRO  53   3.764   7.008   2.176
  317    HD2  PRO  53           2HD      PRO  53   2.144   4.859   1.750
  318    HD3  PRO  53           1HD      PRO  53   3.549   4.814   2.830
  319    H    HIS  54           H        HIS  54  -0.347   5.387   3.008
  320    HA   HIS  54           HA       HIS  54  -2.321   7.525   3.364
  321    HB2  HIS  54           2HB      HIS  54  -2.141   5.295   1.310
  322    HB3  HIS  54           1HB      HIS  54  -3.540   6.338   1.447
  323    HD1  HIS  54           1HD      HIS  54  -3.332   8.715   0.442
  324    HD2  HIS  54           2HD      HIS  54   0.172   6.486   0.225
  325    HE1  HIS  54           1HE      HIS  54  -1.827   9.969  -1.117
  326    HE2  HIS  54           2HE      HIS  54   0.196   8.542  -1.382
  327    H    LYS  55           H        LYS  55  -4.452   6.947   4.055
  328    HA   LYS  55           HA       LYS  55  -4.971   4.268   4.975
  329    HB2  LYS  55           2HB      LYS  55  -3.457   5.709   6.660
  330    HB3  LYS  55           1HB      LYS  55  -5.015   6.390   7.086
  331    HG2  LYS  55           2HG      LYS  55  -4.284   3.479   7.193
  332    HG3  LYS  55           1HG      LYS  55  -4.326   4.571   8.583
  333    HD2  LYS  55           2HD      LYS  55  -6.700   4.867   8.311
  334    HD3  LYS  55           1HD      LYS  55  -6.680   3.940   6.816
  335    HE2  LYS  55           2HE      LYS  55  -5.880   1.982   8.156
  336    HE3  LYS  55           1HE      LYS  55  -6.191   2.945   9.606
  337    HZ1  LYS  55           3HZ      LYS  55  -8.078   1.509   9.013
  338    HZ2  LYS  55           1HZ      LYS  55  -8.153   2.299   7.515
  339    HZ3  LYS  55           2HZ      LYS  55  -8.490   3.153   8.937
  340    H    GLU  56           H        GLU  56  -7.290   4.029   5.039
  341    HA   GLU  56           HA       GLU  56  -8.774   6.401   4.389
  342    HB2  GLU  56           2HB      GLU  56 -10.765   4.951   4.117
  343    HB3  GLU  56           1HB      GLU  56  -9.419   4.305   3.209
  344    HG2  GLU  56           2HG      GLU  56 -10.376   3.243   5.872
  345    HG3  GLU  56           1HG      GLU  56 -10.822   2.579   4.307
  346    H    ASP  57           H        ASP  57  -8.901   7.716   6.015
  347    HA   ASP  57           HA       ASP  57  -9.658   6.613   8.640
  348    HB2  ASP  57           2HB      ASP  57  -7.260   7.304   8.434
  349    HB3  ASP  57           1HB      ASP  57  -7.820   8.940   8.119
  350    H    TYR  58           H        TYR  58 -11.268   7.662   9.714
  351    HA   TYR  58           HA       TYR  58 -12.729   9.564   8.144
  352    HB2  TYR  58           2HB      TYR  58 -13.998   7.803   9.246
  353    HB3  TYR  58           1HB      TYR  58 -13.377   8.307  10.815
  354    HD1  TYR  58           2HD      TYR  58 -15.344   9.599   7.926
  355    HD2  TYR  58           1HD      TYR  58 -14.614   9.804  12.108
  356    HE1  TYR  58           2HE      TYR  58 -17.219  11.159   8.170
  357    HE2  TYR  58           1HE      TYR  58 -16.485  11.373  12.364
  358    HH   TYR  58           HH       TYR  58 -17.669  12.984  10.966
  359    H    VAL  59           H        VAL  59 -12.430  11.589   8.231
  360    HA   VAL  59           HA       VAL  59 -11.295  12.826  10.618
  361    HB   VAL  59           HB       VAL  59 -11.472  13.969   7.810
  362   HG11  VAL  59          1HG1      VAL  59 -11.357  15.650   9.575
  363   HG12  VAL  59          2HG1      VAL  59  -9.875  15.633   8.624
  364   HG13  VAL  59          3HG1      VAL  59  -9.905  14.884  10.222
  365   HG21  VAL  59          3HG2      VAL  59  -9.998  12.018   7.848
  366   HG22  VAL  59          1HG2      VAL  59  -9.087  12.725   9.178
  367   HG23  VAL  59          2HG2      VAL  59  -9.082  13.504   7.594
  Start of MODEL    7
    1    H1   SER   8           1HT      SER   8 -19.493  -2.909   2.220
    2    H2   SER   8           2HT      SER   8 -20.265  -1.968   1.035
    3    H3   SER   8           3HT      SER   8 -20.516  -1.652   2.685
    4    HA   SER   8           HA       SER   8 -19.034  -0.069   1.704
    5    HB2  SER   8           2HB      SER   8 -17.743  -1.973   3.664
    6    HB3  SER   8           1HB      SER   8 -17.333  -0.270   3.443
    7    HG   SER   8           HG       SER   8 -19.127  -1.274   5.048
    8    HA   PRO   9           HA       PRO   9 -16.441  -2.116  -1.327
    9    HB2  PRO   9           2HB      PRO   9 -15.728   0.059  -2.725
   10    HB3  PRO   9           1HB      PRO   9 -17.362  -0.611  -2.821
   11    HG2  PRO   9           2HG      PRO   9 -16.375   1.752  -1.286
   12    HG3  PRO   9           1HG      PRO   9 -17.883   1.552  -2.191
   13    HD2  PRO   9           2HD      PRO   9 -17.665   1.286   0.546
   14    HD3  PRO   9           1HD      PRO   9 -18.936   0.546  -0.449
   15    HA   PRO  10           HA       PRO  10 -12.518  -1.182   0.773
   16    HB2  PRO  10           2HB      PRO  10 -11.544  -3.590  -0.567
   17    HB3  PRO  10           1HB      PRO  10 -11.721  -3.293   1.162
   18    HG2  PRO  10           2HG      PRO  10 -13.275  -5.048  -0.194
   19    HG3  PRO  10           1HG      PRO  10 -13.847  -4.157   1.227
   20    HD2  PRO  10           2HD      PRO  10 -14.364  -3.623  -1.675
   21    HD3  PRO  10           1HD      PRO  10 -15.461  -3.515  -0.279
   22    H    LYS  11           H        LYS  11 -10.518  -0.526  -0.058
   23    HA   LYS  11           HA       LYS  11 -10.661   0.242  -2.828
   24    HB2  LYS  11           2HB      LYS  11  -8.784   1.069  -0.583
   25    HB3  LYS  11           1HB      LYS  11  -8.633   1.671  -2.233
   26    HG2  LYS  11           2HG      LYS  11 -10.982   2.478  -2.087
   27    HG3  LYS  11           1HG      LYS  11 -10.997   2.015  -0.396
   28    HD2  LYS  11           2HD      LYS  11  -9.047   3.995  -1.564
   29    HD3  LYS  11           1HD      LYS  11 -10.608   4.457  -0.907
   30    HE2  LYS  11           2HE      LYS  11  -9.911   3.432   1.258
   31    HE3  LYS  11           1HE      LYS  11  -8.308   3.169   0.566
   32    HZ1  LYS  11           3HZ      LYS  11  -8.318   5.256   1.821
   33    HZ2  LYS  11           1HZ      LYS  11  -9.659   5.776   0.967
   34    HZ3  LYS  11           2HZ      LYS  11  -8.209   5.627   0.175
   35    HA   PRO  12           HA       PRO  12  -8.005  -2.651  -4.760
   36    HB2  PRO  12           2HB      PRO  12  -5.893  -0.605  -5.124
   37    HB3  PRO  12           1HB      PRO  12  -6.581  -1.718  -6.304
   38    HG2  PRO  12           2HG      PRO  12  -7.353   0.831  -6.319
   39    HG3  PRO  12           1HG      PRO  12  -8.516  -0.474  -6.604
   40    HD2  PRO  12           2HD      PRO  12  -8.121   1.217  -4.191
   41    HD3  PRO  12           1HD      PRO  12  -9.614   0.507  -4.840
   42    H    LYS  13           H        LYS  13  -6.411  -4.018  -4.376
   43    HA   LYS  13           HA       LYS  13  -4.905  -3.572  -1.940
   44    HB2  LYS  13           2HB      LYS  13  -5.295  -6.077  -1.504
   45    HB3  LYS  13           1HB      LYS  13  -6.580  -4.936  -1.114
   46    HG2  LYS  13           2HG      LYS  13  -7.638  -6.770  -2.096
   47    HG3  LYS  13           1HG      LYS  13  -7.550  -5.585  -3.389
   48    HD2  LYS  13           2HD      LYS  13  -5.551  -6.741  -4.264
   49    HD3  LYS  13           1HD      LYS  13  -5.720  -7.952  -2.989
   50    HE2  LYS  13           2HE      LYS  13  -7.714  -7.348  -5.172
   51    HE3  LYS  13           1HE      LYS  13  -6.700  -8.783  -5.041
   52    HZ1  LYS  13           3HZ      LYS  13  -8.932  -9.250  -4.260
   53    HZ2  LYS  13           1HZ      LYS  13  -8.857  -8.001  -3.149
   54    HZ3  LYS  13           2HZ      LYS  13  -7.883  -9.347  -2.968
   55    H    CYS  14           H        CYS  14  -3.055  -4.850  -1.573
   56    HA   CYS  14           HA       CYS  14  -1.646  -5.546  -4.071
   57    HB2  CYS  14           2HB      CYS  14   0.298  -4.310  -3.166
   58    HB3  CYS  14           1HB      CYS  14  -1.114  -3.303  -3.402
   59    H    ARG  15           H        ARG  15   0.325  -6.861  -3.698
   60    HA   ARG  15           HA       ARG  15   0.222  -8.571  -1.284
   61    HB2  ARG  15           2HB      ARG  15   1.230  -9.145  -4.082
   62    HB3  ARG  15           1HB      ARG  15   1.486 -10.210  -2.718
   63    HG2  ARG  15           2HG      ARG  15  -0.932 -10.534  -2.530
   64    HG3  ARG  15           1HG      ARG  15  -1.176  -9.471  -3.923
   65    HD2  ARG  15           2HD      ARG  15   0.150 -10.962  -5.315
   66    HD3  ARG  15           1HD      ARG  15   0.481 -11.994  -3.930
   67    HE   ARG  15           HE       ARG  15  -2.282 -11.727  -4.309
   68   HH11  ARG  15          1HH1      ARG  15   0.534 -13.270  -5.802
   69   HH12  ARG  15          2HH1      ARG  15  -0.344 -14.586  -6.440
   70   HH21  ARG  15          1HH2      ARG  15  -3.494 -13.570  -5.213
   71   HH22  ARG  15          2HH2      ARG  15  -2.660 -14.754  -6.102
   72    H    CYS  16           H        CYS  16   1.613  -6.018  -1.483
   73    HA   CYS  16           HA       CYS  16   4.333  -6.212  -2.148
   74    HB2  CYS  16           2HB      CYS  16   3.005  -4.385  -0.138
   75    HB3  CYS  16           1HB      CYS  16   4.613  -4.160  -0.826
   76    H    GLY  17           H        GLY  17   6.170  -6.599  -0.915
   77    HA2  GLY  17           2HA      GLY  17   7.322  -7.122   1.105
   78    HA3  GLY  17           1HA      GLY  17   5.787  -7.610   1.817
   79    H    ILE  18           H        ILE  18   4.939  -9.051  -0.464
   80    HA   ILE  18           HA       ILE  18   6.435 -11.498  -0.079
   81    HB   ILE  18           HB       ILE  18   3.976 -10.974  -1.780
   82   HG12  ILE  18          2HG1      ILE  18   4.206 -11.948   1.075
   83   HG13  ILE  18          1HG1      ILE  18   3.557 -10.413   0.548
   84   HG21  ILE  18          1HG2      ILE  18   5.194 -13.008  -2.398
   85   HG22  ILE  18          2HG2      ILE  18   3.657 -13.416  -1.634
   86   HG23  ILE  18          3HG2      ILE  18   5.157 -13.547  -0.720
   87   HD11  ILE  18          3HD1      ILE  18   1.730 -11.515  -0.580
   88   HD12  ILE  18          1HD1      ILE  18   1.778 -11.960   1.126
   89   HD13  ILE  18          2HD1      ILE  18   2.365 -13.088  -0.101
   90    H    SER  19           H        SER  19   5.220  -9.523  -2.744
   91    HA   SER  19           HA       SER  19   6.862 -10.622  -4.731
   92    HB2  SER  19           2HB      SER  19   5.484  -7.928  -4.609
   93    HB3  SER  19           1HB      SER  19   6.047  -8.750  -6.069
   94    HG   SER  19           HG       SER  19   4.664 -10.507  -5.362
   95    H    GLY  20           H        GLY  20   9.012 -10.544  -4.478
   96    HA2  GLY  20           2HA      GLY  20  11.008  -9.347  -4.940
   97    HA3  GLY  20           1HA      GLY  20  10.276  -7.906  -4.249
   98    H    SER  21           H        SER  21   9.278  -9.820  -2.087
   99    HA   SER  21           HA       SER  21   9.711 -10.217   0.027
  100    HB2  SER  21           2HB      SER  21  10.995 -12.102  -0.915
  101    HB3  SER  21           1HB      SER  21  12.438 -11.096  -0.976
  102    HG   SER  21           HG       SER  21  11.165 -11.293   1.487
  103    H    SER  22           H        SER  22  13.054  -9.113  -0.633
  104    HA   SER  22           HA       SER  22  12.774  -7.404   1.673
  105    HB2  SER  22           2HB      SER  22  14.840  -8.797   1.348
  106    HB3  SER  22           1HB      SER  22  15.238  -7.789  -0.045
  107    HG   SER  22           HG       SER  22  16.279  -6.781   1.534
  108    H    ASN  23           H        ASN  23  11.401  -5.927   0.974
  109    HA   ASN  23           HA       ASN  23  12.593  -3.593  -0.301
  110    HB2  ASN  23           2HB      ASN  23  11.318  -5.008  -2.109
  111    HB3  ASN  23           1HB      ASN  23   9.862  -4.596  -1.220
  112   HD21  ASN  23          1HD2      ASN  23   9.174  -2.406  -1.241
  113   HD22  ASN  23          2HD2      ASN  23   9.712  -1.298  -2.464
  114    H    THR  24           H        THR  24  11.922  -4.638   2.222
  115    HA   THR  24           HA       THR  24   9.355  -4.313   3.169
  116    HB   THR  24           HB       THR  24  11.881  -4.217   4.805
  117    HG1  THR  24           1HG      THR  24  12.189  -6.306   4.305
  118   HG21  THR  24          3HG2      THR  24   9.708  -3.958   5.975
  119   HG22  THR  24          1HG2      THR  24  10.513  -5.471   6.394
  120   HG23  THR  24          2HG2      THR  24   9.165  -5.473   5.256
  121    H    LEU  25           H        LEU  25  11.980  -1.956   3.007
  122    HA   LEU  25           HA       LEU  25  10.748  -0.188   4.897
  123    HB2  LEU  25           2HB      LEU  25  12.497   1.376   4.511
  124    HB3  LEU  25           1HB      LEU  25  13.211  -0.214   4.571
  125    HG   LEU  25           HG       LEU  25  12.723   1.382   2.046
  126   HD11  LEU  25          1HD1      LEU  25  14.394   2.429   3.413
  127   HD12  LEU  25          2HD1      LEU  25  15.157   1.660   2.021
  128   HD13  LEU  25          3HD1      LEU  25  15.239   0.894   3.609
  129   HD21  LEU  25          3HD2      LEU  25  14.192  -0.254   0.967
  130   HD22  LEU  25          1HD2      LEU  25  12.736  -1.022   1.598
  131   HD23  LEU  25          2HD2      LEU  25  14.263  -1.184   2.467
  132    H    THR  26           H        THR  26  10.487  -0.568   1.468
  133    HA   THR  26           HA       THR  26   8.753   1.794   1.407
  134    HB   THR  26           HB       THR  26   9.650   1.993  -1.026
  135    HG1  THR  26           1HG      THR  26  11.288   0.789  -1.510
  136   HG21  THR  26          3HG2      THR  26  11.499   3.465  -0.263
  137   HG22  THR  26          1HG2      THR  26  11.350   2.784   1.355
  138   HG23  THR  26          2HG2      THR  26  10.022   3.719   0.666
  139    H    THR  27           H        THR  27   8.055  -1.040   1.714
  140    HA   THR  27           HA       THR  27   7.484  -2.534  -0.504
  141    HB   THR  27           HB       THR  27   5.347  -2.977   1.085
  142    HG1  THR  27           1HG      THR  27   6.657  -2.728   3.256
  143   HG21  THR  27          3HG2      THR  27   6.889  -4.692   0.491
  144   HG22  THR  27          1HG2      THR  27   6.749  -4.673   2.238
  145   HG23  THR  27          2HG2      THR  27   8.186  -3.971   1.460
  146    H    CYS  28           H        CYS  28   5.113  -0.646   1.211
  147    HA   CYS  28           HA       CYS  28   3.475  -0.593  -1.128
  148    HB2  CYS  28           2HB      CYS  28   2.911   0.076   1.729
  149    HB3  CYS  28           1HB      CYS  28   1.739   0.338   0.433
  150    H    ARG  29           H        ARG  29   5.841   1.364  -0.083
  151    HA   ARG  29           HA       ARG  29   4.345   3.861  -0.580
  152    HB2  ARG  29           2HB      ARG  29   5.949   3.363   1.471
  153    HB3  ARG  29           1HB      ARG  29   7.186   3.865   0.325
  154    HG2  ARG  29           2HG      ARG  29   5.801   5.952  -0.056
  155    HG3  ARG  29           1HG      ARG  29   4.854   5.467   1.345
  156    HD2  ARG  29           2HD      ARG  29   6.451   6.973   2.162
  157    HD3  ARG  29           1HD      ARG  29   7.064   5.372   2.603
  158    HE   ARG  29           HE       ARG  29   8.026   6.235   0.073
  159   HH11  ARG  29          1HH1      ARG  29   8.610   6.696   3.536
  160   HH12  ARG  29          2HH1      ARG  29  10.243   7.136   3.327
  161   HH21  ARG  29          1HH2      ARG  29  10.229   6.858  -0.190
  162   HH22  ARG  29          2HH2      ARG  29  11.188   7.216   1.178
  163    H    ASN  30           H        ASN  30   5.194   2.082  -2.787
  164    HA   ASN  30           HA       ASN  30   6.721   4.116  -4.217
  165    HB2  ASN  30           2HB      ASN  30   8.203   2.541  -5.301
  166    HB3  ASN  30           1HB      ASN  30   8.295   2.241  -3.574
  167   HD21  ASN  30          1HD2      ASN  30   7.433   0.317  -2.754
  168   HD22  ASN  30          2HD2      ASN  30   7.005  -0.996  -3.774
  169    H    SER  31           H        SER  31   6.683   3.398  -6.741
  170    HA   SER  31           HA       SER  31   3.939   3.755  -7.352
  171    HB2  SER  31           2HB      SER  31   6.332   3.489  -9.169
  172    HB3  SER  31           1HB      SER  31   4.711   3.889  -9.713
  173    HG   SER  31           HG       SER  31   6.253   5.374  -7.840
  174    H    ARG  32           H        ARG  32   5.493   0.876  -6.806
  175    HA   ARG  32           HA       ARG  32   4.000  -0.560  -8.849
  176    HB2  ARG  32           2HB      ARG  32   5.836  -1.617  -6.692
  177    HB3  ARG  32           1HB      ARG  32   5.092  -2.583  -7.960
  178    HG2  ARG  32           2HG      ARG  32   7.083  -0.361  -8.359
  179    HG3  ARG  32           1HG      ARG  32   7.411  -2.090  -8.492
  180    HD2  ARG  32           2HD      ARG  32   5.819  -2.253 -10.332
  181    HD3  ARG  32           1HD      ARG  32   5.478  -0.530 -10.199
  182    HE   ARG  32           HE       ARG  32   8.184  -0.763 -10.537
  183   HH11  ARG  32          1HH1      ARG  32   5.230  -1.480 -12.352
  184   HH12  ARG  32          2HH1      ARG  32   5.946  -1.370 -13.886
  185   HH21  ARG  32          1HH2      ARG  32   9.211  -0.602 -12.679
  186   HH22  ARG  32          2HH2      ARG  32   8.278  -0.846 -14.072
  187    H    CYS  33           H        CYS  33   3.437   0.647  -5.827
  188    HA   CYS  33           HA       CYS  33   1.678  -1.518  -5.069
  189    HB2  CYS  33           2HB      CYS  33   3.128  -0.575  -3.336
  190    HB3  CYS  33           1HB      CYS  33   2.425   1.013  -3.597
  191    HA   PRO  34           HA       PRO  34  -1.658   0.703  -7.157
  192    HB2  PRO  34           2HB      PRO  34  -3.629  -1.026  -6.370
  193    HB3  PRO  34           1HB      PRO  34  -2.523  -1.369  -7.713
  194    HG2  PRO  34           2HG      PRO  34  -2.383  -2.224  -4.851
  195    HG3  PRO  34           1HG      PRO  34  -2.171  -3.220  -6.308
  196    HD2  PRO  34           2HD      PRO  34  -0.086  -2.367  -4.930
  197    HD3  PRO  34           1HD      PRO  34  -0.031  -2.354  -6.706
  198    H    CYS  35           H        CYS  35  -1.143   0.343  -3.908
  199    HA   CYS  35           HA       CYS  35  -3.599   1.594  -3.143
  200    HB2  CYS  35           2HB      CYS  35  -1.233   0.808  -1.459
  201    HB3  CYS  35           1HB      CYS  35  -2.708   1.528  -0.819
  202    H    TYR  36           H        TYR  36  -0.211   2.293  -2.499
  203    HA   TYR  36           HA       TYR  36  -0.504   4.865  -1.529
  204    HB2  TYR  36           2HB      TYR  36   1.463   3.684  -1.091
  205    HB3  TYR  36           1HB      TYR  36   1.799   3.454  -2.797
  206    HD1  TYR  36           2HD      TYR  36   1.547   6.074  -0.181
  207    HD2  TYR  36           1HD      TYR  36   3.196   4.921  -3.917
  208    HE1  TYR  36           2HE      TYR  36   2.981   8.070  -0.162
  209    HE2  TYR  36           1HE      TYR  36   4.626   6.896  -3.920
  210    HH   TYR  36           HH       TYR  36   4.591   9.131  -2.900
  211    H    LYS  37           H        LYS  37   0.387   3.919  -4.846
  212    HA   LYS  37           HA       LYS  37   0.764   6.623  -5.617
  213    HB2  LYS  37           2HB      LYS  37   1.822   4.565  -6.663
  214    HB3  LYS  37           1HB      LYS  37   0.290   4.309  -7.483
  215    HG2  LYS  37           2HG      LYS  37   0.488   6.498  -8.548
  216    HG3  LYS  37           1HG      LYS  37   2.029   6.748  -7.732
  217    HD2  LYS  37           2HD      LYS  37   2.872   4.690  -8.860
  218    HD3  LYS  37           1HD      LYS  37   1.365   4.640  -9.774
  219    HE2  LYS  37           2HE      LYS  37   3.034   5.707 -11.130
  220    HE3  LYS  37           1HE      LYS  37   1.860   6.914 -10.595
  221    HZ1  LYS  37           3HZ      LYS  37   4.521   6.465  -9.364
  222    HZ2  LYS  37           1HZ      LYS  37   3.431   7.680  -8.933
  223    HZ3  LYS  37           2HZ      LYS  37   4.147   7.688 -10.458
  224    H    SER  38           H        SER  38  -1.997   4.598  -5.418
  225    HA   SER  38           HA       SER  38  -3.560   6.433  -7.052
  226    HB2  SER  38           2HB      SER  38  -4.327   3.771  -5.840
  227    HB3  SER  38           1HB      SER  38  -5.258   4.699  -7.023
  228    HG   SER  38           HG       SER  38  -2.862   4.441  -8.042
  229    H    TYR  39           H        TYR  39  -2.471   6.395  -4.055
  230    HA   TYR  39           HA       TYR  39  -2.981   7.304  -2.114
  231    HB2  TYR  39           2HB      TYR  39  -4.944   8.743  -3.869
  232    HB3  TYR  39           1HB      TYR  39  -4.871   9.080  -2.139
  233    HD1  TYR  39           2HD      TYR  39  -2.833   9.095  -5.266
  234    HD2  TYR  39           1HD      TYR  39  -3.160  10.416  -1.241
  235    HE1  TYR  39           2HE      TYR  39  -0.887  10.572  -5.591
  236    HE2  TYR  39           1HE      TYR  39  -1.229  11.880  -1.550
  237    HH   TYR  39           HH       TYR  39   0.666  12.078  -2.919
  238    H    ASN  40           H        ASN  40  -3.979   4.806  -2.548
  239    HA   ASN  40           HA       ASN  40  -6.487   4.689  -1.004
  240    HB2  ASN  40           2HB      ASN  40  -4.983   2.587  -2.549
  241    HB3  ASN  40           1HB      ASN  40  -6.468   2.291  -1.657
  242   HD21  ASN  40          1HD2      ASN  40  -5.659   2.137  -4.559
  243   HD22  ASN  40          2HD2      ASN  40  -6.877   3.045  -5.364
  244    H    SER  41           H        SER  41  -6.484   2.798   0.625
  245    HA   SER  41           HA       SER  41  -3.996   2.854   2.127
  246    HB2  SER  41           2HB      SER  41  -5.585   2.307   4.006
  247    HB3  SER  41           1HB      SER  41  -5.789   3.910   3.292
  248    HG   SER  41           HG       SER  41  -7.669   2.357   3.661
  249    H    CYS  42           H        CYS  42  -3.802   0.807   3.516
  250    HA   CYS  42           HA       CYS  42  -4.270  -1.420   1.736
  251    HB2  CYS  42           2HB      CYS  42  -2.355  -1.118   4.037
  252    HB3  CYS  42           1HB      CYS  42  -2.684  -2.677   3.287
  253    H    ALA  43           H        ALA  43  -6.397  -1.221   2.257
  254    HA   ALA  43           HA       ALA  43  -7.168  -2.646   4.718
  255    HB1  ALA  43           1HB      ALA  43  -8.870  -0.988   2.855
  256    HB2  ALA  43           2HB      ALA  43  -8.252  -0.467   4.423
  257    HB3  ALA  43           3HB      ALA  43  -9.429  -1.775   4.332
  258    H    GLY  44           H        GLY  44  -7.087  -4.769   4.243
  259    HA2  GLY  44           2HA      GLY  44  -8.232  -6.666   3.385
  260    HA3  GLY  44           1HA      GLY  44  -8.810  -5.676   2.048
  261    H    CYS  45           H        CYS  45  -5.590  -5.263   2.818
  262    HA   CYS  45           HA       CYS  45  -4.792  -6.381   0.287
  263    HB2  CYS  45           2HB      CYS  45  -3.226  -4.887   2.366
  264    HB3  CYS  45           1HB      CYS  45  -2.567  -5.442   0.829
  265    H    HIS  46           H        HIS  46  -2.674  -7.538   0.191
  266    HA   HIS  46           HA       HIS  46  -2.662  -9.701   2.187
  267    HB2  HIS  46           2HB      HIS  46  -3.543 -10.108  -0.270
  268    HB3  HIS  46           1HB      HIS  46  -1.863  -9.963  -0.700
  269    HD1  HIS  46           1HD      HIS  46  -4.226 -12.308   1.066
  270    HD2  HIS  46           2HD      HIS  46  -0.236 -12.142  -0.069
  271    HE1  HIS  46           1HE      HIS  46  -3.340 -14.615   1.384
  272    HE2  HIS  46           2HE      HIS  46  -0.965 -14.521   0.563
  273    H    CYS  47           H        CYS  47  -1.206  -7.183   2.106
  274    HA   CYS  47           HA       CYS  47   1.445  -7.983   1.260
  275    HB2  CYS  47           2HB      CYS  47   2.046  -5.587   1.873
  276    HB3  CYS  47           1HB      CYS  47   1.088  -5.813   0.434
  277    H    VAL  48           H        VAL  48   3.247  -7.759   2.550
  278    HA   VAL  48           HA       VAL  48   2.739  -8.151   5.419
  279    HB   VAL  48           HB       VAL  48   4.804  -9.528   3.661
  280   HG11  VAL  48          1HG1      VAL  48   5.338 -10.885   5.618
  281   HG12  VAL  48          2HG1      VAL  48   4.205  -9.946   6.585
  282   HG13  VAL  48          3HG1      VAL  48   5.643  -9.173   5.916
  283   HG21  VAL  48          3HG2      VAL  48   2.337 -10.683   4.975
  284   HG22  VAL  48          1HG2      VAL  48   3.563 -11.600   4.100
  285   HG23  VAL  48          2HG2      VAL  48   2.569 -10.421   3.247
  286    H    GLY  49           H        GLY  49   3.765  -6.632   6.603
  287    HA2  GLY  49           2HA      GLY  49   5.336  -5.143   7.312
  288    HA3  GLY  49           1HA      GLY  49   6.441  -5.859   6.149
  289    H    CYS  50           H        CYS  50   3.366  -4.178   5.629
  290    HA   CYS  50           HA       CYS  50   4.667  -2.797   3.458
  291    HB2  CYS  50           2HB      CYS  50   2.586  -2.191   2.670
  292    HB3  CYS  50           1HB      CYS  50   2.336  -3.818   3.291
  293    H    LYS  51           H        LYS  51   5.170  -0.732   3.415
  294    HA   LYS  51           HA       LYS  51   4.390   0.900   5.724
  295    HB2  LYS  51           2HB      LYS  51   6.427   1.515   3.569
  296    HB3  LYS  51           1HB      LYS  51   6.168   2.430   5.042
  297    HG2  LYS  51           2HG      LYS  51   7.269  -0.366   4.842
  298    HG3  LYS  51           1HG      LYS  51   8.189   1.103   5.169
  299    HD2  LYS  51           2HD      LYS  51   6.881   1.405   7.250
  300    HD3  LYS  51           1HD      LYS  51   6.047  -0.114   6.912
  301    HE2  LYS  51           2HE      LYS  51   9.010   0.211   7.314
  302    HE3  LYS  51           1HE      LYS  51   7.883  -0.404   8.515
  303    HZ1  LYS  51           3HZ      LYS  51   7.410  -2.274   7.047
  304    HZ2  LYS  51           1HZ      LYS  51   9.049  -2.176   7.400
  305    HZ3  LYS  51           2HZ      LYS  51   8.509  -1.690   5.889
  306    H    ASN  52           H        ASN  52   2.286   1.410   5.049
  307    HA   ASN  52           HA       ASN  52   2.149   2.924   2.561
  308    HB2  ASN  52           2HB      ASN  52   0.575   0.938   2.770
  309    HB3  ASN  52           1HB      ASN  52  -0.181   1.760   4.125
  310   HD21  ASN  52          1HD2      ASN  52  -1.446   1.001   1.687
  311   HD22  ASN  52          2HD2      ASN  52  -1.994   2.465   0.933
  312    HA   PRO  53           HA       PRO  53   1.941   6.381   5.426
  313    HB2  PRO  53           2HB      PRO  53   1.035   7.736   2.944
  314    HB3  PRO  53           1HB      PRO  53   2.316   8.199   4.071
  315    HG2  PRO  53           2HG      PRO  53   2.917   7.174   1.700
  316    HG3  PRO  53           1HG      PRO  53   3.845   6.728   3.142
  317    HD2  PRO  53           2HD      PRO  53   1.731   5.179   1.699
  318    HD3  PRO  53           1HD      PRO  53   3.249   4.619   2.439
  319    H    HIS  54           H        HIS  54  -0.536   5.171   3.310
  320    HA   HIS  54           HA       HIS  54  -2.557   6.848   4.523
  321    HB2  HIS  54           2HB      HIS  54  -2.792   4.722   2.420
  322    HB3  HIS  54           1HB      HIS  54  -4.178   5.553   3.106
  323    HD1  HIS  54           1HD      HIS  54  -4.753   7.829   2.149
  324    HD2  HIS  54           2HD      HIS  54  -1.116   6.347   0.797
  325    HE1  HIS  54           1HE      HIS  54  -4.099   9.307   0.289
  326    HE2  HIS  54           2HE      HIS  54  -1.703   8.672  -0.074
  327    H    LYS  55           H        LYS  55  -2.144   5.997   6.616
  328    HA   LYS  55           HA       LYS  55  -3.842   3.660   6.968
  329    HB2  LYS  55           2HB      LYS  55  -1.602   3.431   8.089
  330    HB3  LYS  55           1HB      LYS  55  -1.970   4.867   9.040
  331    HG2  LYS  55           2HG      LYS  55  -3.884   3.746  10.029
  332    HG3  LYS  55           1HG      LYS  55  -3.552   2.309   9.070
  333    HD2  LYS  55           2HD      LYS  55  -1.394   2.065  10.196
  334    HD3  LYS  55           1HD      LYS  55  -1.739   3.514  11.142
  335    HE2  LYS  55           2HE      LYS  55  -3.419   1.007  11.154
  336    HE3  LYS  55           1HE      LYS  55  -2.235   1.425  12.390
  337    HZ1  LYS  55           3HZ      LYS  55  -4.487   2.046  13.061
  338    HZ2  LYS  55           1HZ      LYS  55  -4.659   3.016  11.705
  339    HZ3  LYS  55           2HZ      LYS  55  -3.527   3.405  12.898
  340    H    GLU  56           H        GLU  56  -5.437   4.937   6.395
  341    HA   GLU  56           HA       GLU  56  -6.009   7.385   7.638
  342    HB2  GLU  56           2HB      GLU  56  -8.158   7.227   6.280
  343    HB3  GLU  56           1HB      GLU  56  -6.638   7.282   5.405
  344    HG2  GLU  56           2HG      GLU  56  -6.795   4.745   5.232
  345    HG3  GLU  56           1HG      GLU  56  -8.439   4.918   5.848
  346    H    ASP  57           H        ASP  57  -6.234   7.223   9.701
  347    HA   ASP  57           HA       ASP  57  -8.450   5.647  10.767
  348    HB2  ASP  57           2HB      ASP  57  -6.253   5.350  11.893
  349    HB3  ASP  57           1HB      ASP  57  -6.173   7.079  12.194
  350    H    TYR  58           H        TYR  58  -9.758   6.829  12.414
  351    HA   TYR  58           HA       TYR  58 -10.645   9.275  11.216
  352    HB2  TYR  58           2HB      TYR  58 -11.668   7.794  13.648
  353    HB3  TYR  58           1HB      TYR  58 -12.454   9.161  12.880
  354    HD1  TYR  58           1HD      TYR  58 -13.526   8.891  10.668
  355    HD2  TYR  58           2HD      TYR  58 -11.807   5.579  12.714
  356    HE1  TYR  58           1HE      TYR  58 -14.747   7.345   9.193
  357    HE2  TYR  58           2HE      TYR  58 -13.019   4.035  11.247
  358    HH   TYR  58           HH       TYR  58 -14.470   4.995   8.397
  359    H    VAL  59           H        VAL  59  -8.920  10.593  11.590
  360    HA   VAL  59           HA       VAL  59  -8.677  11.503  14.328
  361    HB   VAL  59           HB       VAL  59  -6.340  12.304  13.770
  362   HG11  VAL  59          1HG1      VAL  59  -5.297  10.104  13.996
  363   HG12  VAL  59          2HG1      VAL  59  -6.819   9.339  13.545
  364   HG13  VAL  59          3HG1      VAL  59  -6.704  10.264  15.043
  365   HG21  VAL  59          3HG2      VAL  59  -5.171  11.254  11.860
  366   HG22  VAL  59          1HG2      VAL  59  -6.485  12.308  11.329
  367   HG23  VAL  59          2HG2      VAL  59  -6.699  10.556  11.323
  Start of MODEL    8
    1    H1   SER   8           1HT      SER   8 -19.649  -0.784  -0.447
    2    H2   SER   8           2HT      SER   8 -19.921   0.756  -1.060
    3    H3   SER   8           3HT      SER   8 -19.881   0.499   0.636
    4    HA   SER   8           HA       SER   8 -17.891   1.525  -0.107
    5    HB2  SER   8           2HB      SER   8 -17.519  -1.382   0.638
    6    HB3  SER   8           1HB      SER   8 -16.415  -0.047   0.984
    7    HG   SER   8           HG       SER   8 -17.496  -0.083   2.788
    8    HA   PRO   9           HA       PRO   9 -17.023   0.255  -4.301
    9    HB2  PRO   9           2HB      PRO   9 -14.997   1.969  -4.795
   10    HB3  PRO   9           1HB      PRO   9 -16.688   2.485  -4.742
   11    HG2  PRO   9           2HG      PRO   9 -14.582   2.698  -2.632
   12    HG3  PRO   9           1HG      PRO   9 -15.764   3.909  -3.159
   13    HD2  PRO   9           2HD      PRO   9 -16.111   2.400  -0.940
   14    HD3  PRO   9           1HD      PRO   9 -17.474   2.953  -1.934
   15    HA   PRO  10           HA       PRO  10 -13.589  -2.612  -3.583
   16    HB2  PRO  10           2HB      PRO  10 -13.845  -2.864  -6.545
   17    HB3  PRO  10           1HB      PRO  10 -13.846  -4.140  -5.322
   18    HG2  PRO  10           2HG      PRO  10 -16.105  -3.468  -6.535
   19    HG3  PRO  10           1HG      PRO  10 -16.086  -3.809  -4.794
   20    HD2  PRO  10           2HD      PRO  10 -16.154  -1.161  -6.195
   21    HD3  PRO  10           1HD      PRO  10 -17.051  -1.713  -4.761
   22    H    LYS  11           H        LYS  11 -11.518  -1.974  -3.552
   23    HA   LYS  11           HA       LYS  11 -10.596  -0.020  -5.515
   24    HB2  LYS  11           2HB      LYS  11  -9.595   1.307  -3.651
   25    HB3  LYS  11           1HB      LYS  11 -11.347   1.247  -3.591
   26    HG2  LYS  11           2HG      LYS  11 -11.070  -0.622  -1.893
   27    HG3  LYS  11           1HG      LYS  11  -9.369  -0.146  -1.815
   28    HD2  LYS  11           2HD      LYS  11 -10.053   2.146  -1.254
   29    HD3  LYS  11           1HD      LYS  11 -11.743   1.649  -1.306
   30    HE2  LYS  11           2HE      LYS  11 -11.134   1.674   0.966
   31    HE3  LYS  11           1HE      LYS  11 -11.173  -0.021   0.497
   32    HZ1  LYS  11           3HZ      LYS  11  -8.696   0.109   0.261
   33    HZ2  LYS  11           1HZ      LYS  11  -9.250   0.454   1.832
   34    HZ3  LYS  11           2HZ      LYS  11  -8.792   1.702   0.833
   35    HA   PRO  12           HA       PRO  12  -6.889  -2.286  -5.985
   36    HB2  PRO  12           2HB      PRO  12  -5.014  -0.383  -5.036
   37    HB3  PRO  12           1HB      PRO  12  -5.413  -0.818  -6.697
   38    HG2  PRO  12           2HG      PRO  12  -6.324   1.481  -5.082
   39    HG3  PRO  12           1HG      PRO  12  -6.290   1.300  -6.839
   40    HD2  PRO  12           2HD      PRO  12  -8.580   1.273  -5.387
   41    HD3  PRO  12           1HD      PRO  12  -8.392   0.376  -6.901
   42    H    LYS  13           H        LYS  13  -5.973  -3.725  -4.948
   43    HA   LYS  13           HA       LYS  13  -5.094  -3.449  -2.185
   44    HB2  LYS  13           2HB      LYS  13  -6.757  -5.744  -3.288
   45    HB3  LYS  13           1HB      LYS  13  -5.972  -5.740  -1.709
   46    HG2  LYS  13           2HG      LYS  13  -7.344  -3.889  -0.988
   47    HG3  LYS  13           1HG      LYS  13  -8.080  -3.775  -2.582
   48    HD2  LYS  13           2HD      LYS  13  -9.036  -6.013  -2.292
   49    HD3  LYS  13           1HD      LYS  13  -8.286  -6.120  -0.696
   50    HE2  LYS  13           2HE      LYS  13  -9.563  -4.189   0.053
   51    HE3  LYS  13           1HE      LYS  13 -10.298  -4.041  -1.542
   52    HZ1  LYS  13           3HZ      LYS  13 -10.619  -6.347   0.302
   53    HZ2  LYS  13           1HZ      LYS  13 -11.329  -6.203  -1.214
   54    HZ3  LYS  13           2HZ      LYS  13 -11.764  -5.157  -0.004
   55    H    CYS  14           H        CYS  14  -3.402  -5.059  -1.690
   56    HA   CYS  14           HA       CYS  14  -2.076  -6.009  -4.116
   57    HB2  CYS  14           2HB      CYS  14   0.020  -4.929  -3.421
   58    HB3  CYS  14           1HB      CYS  14  -1.259  -3.764  -3.690
   59    H    ARG  15           H        ARG  15  -0.081  -7.237  -3.523
   60    HA   ARG  15           HA       ARG  15  -0.354  -8.762  -1.013
   61    HB2  ARG  15           2HB      ARG  15   0.283  -9.790  -3.791
   62    HB3  ARG  15           1HB      ARG  15   0.364 -10.754  -2.326
   63    HG2  ARG  15           2HG      ARG  15  -1.991 -10.570  -1.996
   64    HG3  ARG  15           1HG      ARG  15  -2.125  -9.406  -3.315
   65    HD2  ARG  15           2HD      ARG  15  -1.398 -11.123  -4.891
   66    HD3  ARG  15           1HD      ARG  15  -1.266 -12.285  -3.573
   67    HE   ARG  15           HE       ARG  15  -3.821 -11.233  -3.518
   68   HH11  ARG  15          1HH1      ARG  15  -1.876 -13.179  -5.729
   69   HH12  ARG  15          2HH1      ARG  15  -3.173 -14.117  -6.304
   70   HH21  ARG  15          1HH2      ARG  15  -5.649 -12.472  -4.373
   71   HH22  ARG  15          2HH2      ARG  15  -5.373 -13.697  -5.513
   72    H    CYS  16           H        CYS  16   1.278  -6.473  -1.800
   73    HA   CYS  16           HA       CYS  16   3.945  -7.035  -2.468
   74    HB2  CYS  16           2HB      CYS  16   2.958  -4.874  -0.583
   75    HB3  CYS  16           1HB      CYS  16   4.508  -4.920  -1.411
   76    H    GLY  17           H        GLY  17   5.130  -8.559  -1.399
   77    HA2  GLY  17           2HA      GLY  17   6.424  -8.618   0.774
   78    HA3  GLY  17           1HA      GLY  17   4.825  -8.702   1.515
   79    H    ILE  18           H        ILE  18   3.571 -10.325  -0.418
   80    HA   ILE  18           HA       ILE  18   4.545 -12.920   0.299
   81    HB   ILE  18           HB       ILE  18   2.496 -12.089  -1.778
   82   HG12  ILE  18          2HG1      ILE  18   1.996 -11.184   0.452
   83   HG13  ILE  18          1HG1      ILE  18   0.790 -12.332  -0.082
   84   HG21  ILE  18          1HG2      ILE  18   2.860 -14.727  -0.353
   85   HG22  ILE  18          2HG2      ILE  18   3.234 -14.398  -2.045
   86   HG23  ILE  18          3HG2      ILE  18   1.562 -14.341  -1.482
   87   HD11  ILE  18          3HD1      ILE  18   1.285 -12.618   2.281
   88   HD12  ILE  18          1HD1      ILE  18   3.002 -12.812   1.924
   89   HD13  ILE  18          2HD1      ILE  18   1.850 -14.034   1.390
   90    H    SER  19           H        SER  19   4.092 -11.123  -2.718
   91    HA   SER  19           HA       SER  19   6.624 -11.842  -3.779
   92    HB2  SER  19           2HB      SER  19   4.076 -12.820  -5.135
   93    HB3  SER  19           1HB      SER  19   5.692 -12.878  -5.841
   94    HG   SER  19           HG       SER  19   5.566 -13.971  -3.361
   95    H    GLY  20           H        GLY  20   6.972 -10.542  -5.777
   96    HA2  GLY  20           2HA      GLY  20   6.614  -8.695  -7.130
   97    HA3  GLY  20           1HA      GLY  20   4.979  -8.568  -6.487
   98    H    SER  21           H        SER  21   7.525  -8.907  -4.272
   99    HA   SER  21           HA       SER  21   6.886  -6.562  -2.875
  100    HB2  SER  21           2HB      SER  21   9.302  -8.348  -2.600
  101    HB3  SER  21           1HB      SER  21   8.583  -7.317  -1.364
  102    HG   SER  21           HG       SER  21   7.983  -9.448  -1.122
  103    H    SER  22           H        SER  22   7.469  -4.601  -3.543
  104    HA   SER  22           HA       SER  22  10.035  -4.236  -4.900
  105    HB2  SER  22           2HB      SER  22   7.638  -2.389  -4.858
  106    HB3  SER  22           1HB      SER  22   9.029  -2.314  -5.943
  107    HG   SER  22           HG       SER  22   7.503  -4.631  -5.813
  108    H    ASN  23           H        ASN  23  11.485  -3.634  -3.401
  109    HA   ASN  23           HA       ASN  23  12.566  -2.501  -1.766
  110    HB2  ASN  23           2HB      ASN  23   9.992  -0.933  -1.326
  111    HB3  ASN  23           1HB      ASN  23  11.490  -0.620  -0.479
  112   HD21  ASN  23          1HD2      ASN  23   9.715  -0.247  -3.376
  113   HD22  ASN  23          2HD2      ASN  23  10.806   0.809  -4.188
  114    H    THR  24           H        THR  24  12.538  -2.368   0.702
  115    HA   THR  24           HA       THR  24  10.767  -4.498   1.618
  116    HB   THR  24           HB       THR  24  13.101  -5.217   1.682
  117    HG1  THR  24           1HG      THR  24  11.508  -5.738   3.429
  118   HG21  THR  24          3HG2      THR  24  14.196  -3.067   1.981
  119   HG22  THR  24          1HG2      THR  24  14.718  -4.188   3.239
  120   HG23  THR  24          2HG2      THR  24  13.535  -2.933   3.610
  121    H    LEU  25           H        LEU  25  11.849  -1.288   2.323
  122    HA   LEU  25           HA       LEU  25  10.033  -1.219   4.633
  123    HB2  LEU  25           2HB      LEU  25  12.147   0.755   3.744
  124    HB3  LEU  25           1HB      LEU  25  11.080   0.989   5.108
  125    HG   LEU  25           HG       LEU  25  13.144  -1.215   4.906
  126   HD11  LEU  25          1HD1      LEU  25  14.182   0.990   5.050
  127   HD12  LEU  25          2HD1      LEU  25  14.383   0.086   6.551
  128   HD13  LEU  25          3HD1      LEU  25  13.182   1.372   6.452
  129   HD21  LEU  25          3HD2      LEU  25  11.218  -1.784   6.327
  130   HD22  LEU  25          1HD2      LEU  25  11.432  -0.279   7.213
  131   HD23  LEU  25          2HD2      LEU  25  12.676  -1.525   7.287
  132    H    THR  26           H        THR  26  10.899   0.403   1.652
  133    HA   THR  26           HA       THR  26   8.590   2.094   1.722
  134    HB   THR  26           HB       THR  26  10.580   1.719  -0.543
  135    HG1  THR  26           1HG      THR  26  11.715   3.450   0.583
  136   HG21  THR  26          3HG2      THR  26  10.119   4.085  -0.983
  137   HG22  THR  26          1HG2      THR  26   9.058   4.158   0.423
  138   HG23  THR  26          2HG2      THR  26   8.607   3.177  -0.966
  139    H    THR  27           H        THR  27   8.278  -0.937   1.515
  140    HA   THR  27           HA       THR  27   7.860  -2.054  -0.934
  141    HB   THR  27           HB       THR  27   6.021  -2.624   1.349
  142    HG1  THR  27           1HG      THR  27   7.667  -3.265   2.580
  143   HG21  THR  27          3HG2      THR  27   6.526  -4.929   0.741
  144   HG22  THR  27          1HG2      THR  27   7.760  -4.382  -0.404
  145   HG23  THR  27          2HG2      THR  27   6.064  -4.025  -0.700
  146    H    CYS  28           H        CYS  28   5.228  -0.942   1.154
  147    HA   CYS  28           HA       CYS  28   3.538  -0.608  -1.145
  148    HB2  CYS  28           2HB      CYS  28   2.956  -0.647   1.795
  149    HB3  CYS  28           1HB      CYS  28   1.721  -0.198   0.628
  150    H    ARG  29           H        ARG  29   5.682   1.224   0.286
  151    HA   ARG  29           HA       ARG  29   4.209   3.732   0.345
  152    HB2  ARG  29           2HB      ARG  29   5.790   3.148   2.177
  153    HB3  ARG  29           1HB      ARG  29   7.087   3.118   0.995
  154    HG2  ARG  29           2HG      ARG  29   6.788   5.506   0.598
  155    HG3  ARG  29           1HG      ARG  29   5.477   5.538   1.771
  156    HD2  ARG  29           2HD      ARG  29   7.013   4.892   3.537
  157    HD3  ARG  29           1HD      ARG  29   8.337   4.769   2.380
  158    HE   ARG  29           HE       ARG  29   6.991   7.219   3.251
  159   HH11  ARG  29          1HH1      ARG  29   9.746   5.657   1.636
  160   HH12  ARG  29          2HH1      ARG  29  10.653   7.076   1.499
  161   HH21  ARG  29          1HH2      ARG  29   8.315   9.213   3.051
  162   HH22  ARG  29          2HH2      ARG  29   9.843   9.099   2.303
  163    H    ASN  30           H        ASN  30   5.600   2.008  -2.049
  164    HA   ASN  30           HA       ASN  30   6.561   4.466  -3.344
  165    HB2  ASN  30           2HB      ASN  30   8.149   3.275  -4.658
  166    HB3  ASN  30           1HB      ASN  30   8.356   2.704  -3.012
  167   HD21  ASN  30          1HD2      ASN  30   7.689   0.602  -2.522
  168   HD22  ASN  30          2HD2      ASN  30   7.404  -0.576  -3.735
  169    H    SER  31           H        SER  31   6.360   4.472  -5.746
  170    HA   SER  31           HA       SER  31   3.630   4.340  -6.316
  171    HB2  SER  31           2HB      SER  31   5.929   4.860  -8.171
  172    HB3  SER  31           1HB      SER  31   4.246   5.347  -8.406
  173    HG   SER  31           HG       SER  31   4.610   7.018  -7.199
  174    H    ARG  32           H        ARG  32   5.826   1.759  -6.506
  175    HA   ARG  32           HA       ARG  32   4.551   0.576  -8.827
  176    HB2  ARG  32           2HB      ARG  32   6.563  -0.665  -6.919
  177    HB3  ARG  32           1HB      ARG  32   6.038  -1.350  -8.450
  178    HG2  ARG  32           2HG      ARG  32   7.048   0.510  -9.652
  179    HG3  ARG  32           1HG      ARG  32   7.528   1.249  -8.127
  180    HD2  ARG  32           2HD      ARG  32   8.900  -0.789  -7.654
  181    HD3  ARG  32           1HD      ARG  32   8.500  -1.368  -9.272
  182    HE   ARG  32           HE       ARG  32   9.554   1.264  -9.311
  183   HH11  ARG  32          1HH1      ARG  32  10.586  -2.147  -9.155
  184   HH12  ARG  32          2HH1      ARG  32  12.142  -1.827  -9.767
  185   HH21  ARG  32          1HH2      ARG  32  11.734   1.653 -10.129
  186   HH22  ARG  32          2HH2      ARG  32  12.797   0.326 -10.317
  187    H    CYS  33           H        CYS  33   3.764   1.010  -5.679
  188    HA   CYS  33           HA       CYS  33   2.242  -1.459  -5.457
  189    HB2  CYS  33           2HB      CYS  33   3.394  -0.617  -3.429
  190    HB3  CYS  33           1HB      CYS  33   2.500   0.891  -3.547
  191    HA   PRO  34           HA       PRO  34  -1.109   0.564  -7.562
  192    HB2  PRO  34           2HB      PRO  34  -3.145  -1.095  -6.688
  193    HB3  PRO  34           1HB      PRO  34  -2.080  -1.448  -8.048
  194    HG2  PRO  34           2HG      PRO  34  -1.936  -2.411  -5.230
  195    HG3  PRO  34           1HG      PRO  34  -1.613  -3.293  -6.733
  196    HD2  PRO  34           2HD      PRO  34   0.370  -2.385  -5.165
  197    HD3  PRO  34           1HD      PRO  34   0.525  -2.407  -6.932
  198    H    CYS  35           H        CYS  35  -1.379  -0.242  -4.181
  199    HA   CYS  35           HA       CYS  35  -3.686   1.277  -3.576
  200    HB2  CYS  35           2HB      CYS  35  -1.406   0.440  -1.814
  201    HB3  CYS  35           1HB      CYS  35  -2.950   1.060  -1.242
  202    H    TYR  36           H        TYR  36  -0.305   1.958  -2.887
  203    HA   TYR  36           HA       TYR  36  -0.489   4.493  -1.852
  204    HB2  TYR  36           2HB      TYR  36   1.566   3.224  -1.776
  205    HB3  TYR  36           1HB      TYR  36   1.703   3.268  -3.527
  206    HD1  TYR  36           1HD      TYR  36   1.909   5.326  -0.466
  207    HD2  TYR  36           2HD      TYR  36   2.699   5.115  -4.628
  208    HE1  TYR  36           1HE      TYR  36   3.264   7.376  -0.307
  209    HE2  TYR  36           2HE      TYR  36   4.048   7.148  -4.499
  210    HH   TYR  36           HH       TYR  36   4.293   9.052  -3.101
  211    H    LYS  37           H        LYS  37   0.007   3.591  -5.227
  212    HA   LYS  37           HA       LYS  37   0.292   6.210  -6.216
  213    HB2  LYS  37           2HB      LYS  37   0.783   3.760  -7.220
  214    HB3  LYS  37           1HB      LYS  37  -0.762   4.065  -7.994
  215    HG2  LYS  37           2HG      LYS  37   1.685   5.821  -8.218
  216    HG3  LYS  37           1HG      LYS  37   1.160   4.653  -9.425
  217    HD2  LYS  37           2HD      LYS  37  -0.905   5.924  -9.754
  218    HD3  LYS  37           1HD      LYS  37  -0.402   7.065  -8.507
  219    HE2  LYS  37           2HE      LYS  37   1.569   7.646  -9.872
  220    HE3  LYS  37           1HE      LYS  37   1.005   6.547 -11.126
  221    HZ1  LYS  37           3HZ      LYS  37  -0.468   8.916 -10.133
  222    HZ2  LYS  37           1HZ      LYS  37  -0.976   7.937 -11.399
  223    HZ3  LYS  37           2HZ      LYS  37   0.409   8.893 -11.541
  224    H    SER  38           H        SER  38  -2.541   4.093  -5.861
  225    HA   SER  38           HA       SER  38  -4.257   6.026  -7.136
  226    HB2  SER  38           2HB      SER  38  -4.883   3.389  -5.813
  227    HB3  SER  38           1HB      SER  38  -6.011   4.348  -6.770
  228    HG   SER  38           HG       SER  38  -5.078   3.747  -8.525
  229    H    TYR  39           H        TYR  39  -2.898   6.143  -4.239
  230    HA   TYR  39           HA       TYR  39  -3.246   7.367  -2.378
  231    HB2  TYR  39           2HB      TYR  39  -5.792   8.258  -3.754
  232    HB3  TYR  39           1HB      TYR  39  -5.205   8.934  -2.239
  233    HD1  TYR  39           2HD      TYR  39  -3.105  10.218  -2.201
  234    HD2  TYR  39           1HD      TYR  39  -4.819   8.886  -5.848
  235    HE1  TYR  39           2HE      TYR  39  -1.677  11.779  -3.433
  236    HE2  TYR  39           1HE      TYR  39  -3.393  10.446  -7.098
  237    HH   TYR  39           HH       TYR  39  -0.740  11.912  -5.673
  238    H    ASN  40           H        ASN  40  -4.226   4.627  -2.631
  239    HA   ASN  40           HA       ASN  40  -6.306   4.655  -0.570
  240    HB2  ASN  40           2HB      ASN  40  -5.504   2.464  -2.500
  241    HB3  ASN  40           1HB      ASN  40  -6.561   2.188  -1.124
  242   HD21  ASN  40          1HD2      ASN  40  -6.295   3.520  -4.286
  243   HD22  ASN  40          2HD2      ASN  40  -7.973   3.905  -4.466
  244    H    SER  41           H        SER  41  -6.134   2.988   1.039
  245    HA   SER  41           HA       SER  41  -3.378   2.848   1.997
  246    HB2  SER  41           2HB      SER  41  -4.449   2.438   4.206
  247    HB3  SER  41           1HB      SER  41  -4.917   3.975   3.480
  248    HG   SER  41           HG       SER  41  -6.815   2.645   2.672
  249    H    CYS  42           H        CYS  42  -2.983   0.802   3.354
  250    HA   CYS  42           HA       CYS  42  -3.957  -1.372   1.737
  251    HB2  CYS  42           2HB      CYS  42  -1.512  -1.209   3.477
  252    HB3  CYS  42           1HB      CYS  42  -2.099  -2.718   2.766
  253    H    ALA  43           H        ALA  43  -5.845  -1.096   2.677
  254    HA   ALA  43           HA       ALA  43  -6.166  -2.601   5.174
  255    HB1  ALA  43           1HB      ALA  43  -7.012  -0.300   5.338
  256    HB2  ALA  43           2HB      ALA  43  -8.339  -1.460   5.379
  257    HB3  ALA  43           3HB      ALA  43  -8.000  -0.562   3.899
  258    H    GLY  44           H        GLY  44  -6.619  -4.621   4.600
  259    HA2  GLY  44           2HA      GLY  44  -8.199  -6.207   3.782
  260    HA3  GLY  44           1HA      GLY  44  -8.679  -5.044   2.552
  261    H    CYS  45           H        CYS  45  -5.365  -5.231   3.037
  262    HA   CYS  45           HA       CYS  45  -4.982  -6.550   0.452
  263    HB2  CYS  45           2HB      CYS  45  -3.067  -4.996   2.199
  264    HB3  CYS  45           1HB      CYS  45  -2.680  -5.686   0.631
  265    H    HIS  46           H        HIS  46  -2.968  -7.933   0.370
  266    HA   HIS  46           HA       HIS  46  -2.560  -9.347   2.891
  267    HB2  HIS  46           2HB      HIS  46  -2.765 -10.531   0.112
  268    HB3  HIS  46           1HB      HIS  46  -1.985 -11.392   1.431
  269    HD1  HIS  46           1HD      HIS  46  -3.543 -12.286   3.365
  270    HD2  HIS  46           2HD      HIS  46  -5.550 -10.442   0.221
  271    HE1  HIS  46           1HE      HIS  46  -5.943 -12.841   3.682
  272    HE2  HIS  46           2HE      HIS  46  -7.115 -11.852   1.697
  273    H    CYS  47           H        CYS  47  -1.243  -7.196   2.377
  274    HA   CYS  47           HA       CYS  47   1.302  -7.929   1.204
  275    HB2  CYS  47           2HB      CYS  47   1.869  -5.497   1.585
  276    HB3  CYS  47           1HB      CYS  47   0.585  -5.778   0.431
  277    H    VAL  48           H        VAL  48   3.246  -7.610   2.337
  278    HA   VAL  48           HA       VAL  48   3.063  -7.756   5.259
  279    HB   VAL  48           HB       VAL  48   4.818  -9.540   3.510
  280   HG11  VAL  48          1HG1      VAL  48   5.412 -10.685   5.592
  281   HG12  VAL  48          2HG1      VAL  48   4.463  -9.508   6.503
  282   HG13  VAL  48          3HG1      VAL  48   5.893  -8.988   5.612
  283   HG21  VAL  48          3HG2      VAL  48   2.489 -10.271   3.405
  284   HG22  VAL  48          1HG2      VAL  48   2.404 -10.287   5.165
  285   HG23  VAL  48          2HG2      VAL  48   3.461 -11.423   4.327
  286    H    GLY  49           H        GLY  49   4.552  -6.466   6.200
  287    HA2  GLY  49           2HA      GLY  49   6.391  -5.063   6.435
  288    HA3  GLY  49           1HA      GLY  49   6.964  -5.607   4.853
  289    H    CYS  50           H        CYS  50   3.954  -4.137   5.925
  290    HA   CYS  50           HA       CYS  50   4.047  -2.447   3.585
  291    HB2  CYS  50           2HB      CYS  50   2.092  -3.743   3.664
  292    HB3  CYS  50           1HB      CYS  50   1.820  -3.355   5.360
  293    H    LYS  51           H        LYS  51   5.007  -0.604   4.037
  294    HA   LYS  51           HA       LYS  51   3.773   0.923   6.188
  295    HB2  LYS  51           2HB      LYS  51   6.382   1.451   4.722
  296    HB3  LYS  51           1HB      LYS  51   5.678   2.477   5.968
  297    HG2  LYS  51           2HG      LYS  51   5.915   0.619   7.577
  298    HG3  LYS  51           1HG      LYS  51   6.718  -0.325   6.320
  299    HD2  LYS  51           2HD      LYS  51   8.388   0.687   7.754
  300    HD3  LYS  51           1HD      LYS  51   8.452   1.443   6.163
  301    HE2  LYS  51           2HE      LYS  51   7.189   3.358   6.992
  302    HE3  LYS  51           1HE      LYS  51   7.025   2.590   8.571
  303    HZ1  LYS  51           3HZ      LYS  51   9.545   3.493   7.295
  304    HZ2  LYS  51           1HZ      LYS  51   9.442   2.706   8.791
  305    HZ3  LYS  51           2HZ      LYS  51   8.759   4.227   8.583
  306    H    ASN  52           H        ASN  52   1.982   1.500   5.097
  307    HA   ASN  52           HA       ASN  52   2.357   2.940   2.558
  308    HB2  ASN  52           2HB      ASN  52   0.672   1.076   2.604
  309    HB3  ASN  52           1HB      ASN  52  -0.221   1.968   3.827
  310   HD21  ASN  52          1HD2      ASN  52  -1.187   1.117   1.298
  311   HD22  ASN  52          2HD2      ASN  52  -1.652   2.542   0.425
  312    HA   PRO  53           HA       PRO  53   2.036   6.600   5.218
  313    HB2  PRO  53           2HB      PRO  53   1.908   7.926   2.576
  314    HB3  PRO  53           1HB      PRO  53   2.991   8.233   3.940
  315    HG2  PRO  53           2HG      PRO  53   3.870   7.008   1.763
  316    HG3  PRO  53           1HG      PRO  53   4.402   6.502   3.377
  317    HD2  PRO  53           2HD      PRO  53   2.396   5.220   1.561
  318    HD3  PRO  53           1HD      PRO  53   3.640   4.479   2.599
  319    H    HIS  54           H        HIS  54  -0.170   5.477   2.866
  320    HA   HIS  54           HA       HIS  54  -2.088   7.598   3.451
  321    HB2  HIS  54           2HB      HIS  54  -2.386   5.248   1.556
  322    HB3  HIS  54           1HB      HIS  54  -3.514   6.580   1.736
  323    HD1  HIS  54           1HD      HIS  54  -2.809   8.876   0.619
  324    HD2  HIS  54           2HD      HIS  54  -0.196   5.724   0.022
  325    HE1  HIS  54           1HE      HIS  54  -1.320   9.604  -1.231
  326    HE2  HIS  54           2HE      HIS  54   0.083   7.647  -1.758
  327    H    LYS  55           H        LYS  55  -3.797   7.239   4.638
  328    HA   LYS  55           HA       LYS  55  -4.461   4.547   5.496
  329    HB2  LYS  55           2HB      LYS  55  -4.006   6.882   7.348
  330    HB3  LYS  55           1HB      LYS  55  -4.954   5.485   7.801
  331    HG2  LYS  55           2HG      LYS  55  -2.938   4.080   7.461
  332    HG3  LYS  55           1HG      LYS  55  -2.018   5.559   7.152
  333    HD2  LYS  55           2HD      LYS  55  -2.600   6.413   9.351
  334    HD3  LYS  55           1HD      LYS  55  -3.597   4.996   9.656
  335    HE2  LYS  55           2HE      LYS  55  -1.463   4.824  10.789
  336    HE3  LYS  55           1HE      LYS  55  -1.617   3.577   9.556
  337    HZ1  LYS  55           3HZ      LYS  55  -0.186   4.768   8.133
  338    HZ2  LYS  55           1HZ      LYS  55   0.563   4.669   9.623
  339    HZ3  LYS  55           2HZ      LYS  55  -0.141   6.126   9.132
  340    H    GLU  56           H        GLU  56  -6.470   4.300   4.867
  341    HA   GLU  56           HA       GLU  56  -8.188   6.580   4.679
  342    HB2  GLU  56           2HB      GLU  56  -8.611   3.641   4.159
  343    HB3  GLU  56           1HB      GLU  56  -9.822   4.893   3.890
  344    HG2  GLU  56           2HG      GLU  56  -8.563   5.885   2.173
  345    HG3  GLU  56           1HG      GLU  56  -7.127   4.945   2.582
  346    H    ASP  57           H        ASP  57  -8.209   7.196   6.707
  347    HA   ASP  57           HA       ASP  57  -8.726   5.556   8.966
  348    HB2  ASP  57           2HB      ASP  57  -7.514   7.820   8.905
  349    HB3  ASP  57           1HB      ASP  57  -9.159   8.443   8.666
  350    H    TYR  58           H        TYR  58 -10.506   4.546   8.498
  351    HA   TYR  58           HA       TYR  58 -12.942   5.983   7.844
  352    HB2  TYR  58           2HB      TYR  58 -12.333   3.953   6.550
  353    HB3  TYR  58           1HB      TYR  58 -12.478   2.998   8.016
  354    HD1  TYR  58           1HD      TYR  58 -14.379   5.106   5.650
  355    HD2  TYR  58           2HD      TYR  58 -14.577   2.179   8.715
  356    HE1  TYR  58           1HE      TYR  58 -16.766   4.787   5.180
  357    HE2  TYR  58           2HE      TYR  58 -16.955   1.850   8.251
  358    HH   TYR  58           HH       TYR  58 -18.803   3.084   7.293
  359    H    VAL  59           H        VAL  59 -13.974   6.793   9.474
  360    HA   VAL  59           HA       VAL  59 -13.992   5.377  11.976
  361    HB   VAL  59           HB       VAL  59 -13.340   7.708  12.191
  362   HG11  VAL  59          1HG1      VAL  59 -14.812   9.590  11.674
  363   HG12  VAL  59          2HG1      VAL  59 -15.960   8.478  10.932
  364   HG13  VAL  59          3HG1      VAL  59 -14.351   8.684  10.231
  365   HG21  VAL  59          3HG2      VAL  59 -16.114   7.273  13.274
  366   HG22  VAL  59          1HG2      VAL  59 -14.988   8.508  13.831
  367   HG23  VAL  59          2HG2      VAL  59 -14.602   6.796  14.038
  Start of MODEL    9
    1    H1   SER   8           1HT      SER   8 -22.027  -0.614  -4.855
    2    H2   SER   8           2HT      SER   8 -20.568  -1.173  -5.520
    3    H3   SER   8           3HT      SER   8 -21.050   0.424  -5.771
    4    HA   SER   8           HA       SER   8 -20.790   0.916  -3.474
    5    HB2  SER   8           2HB      SER   8 -19.818  -1.953  -3.258
    6    HB3  SER   8           1HB      SER   8 -19.977  -0.789  -1.941
    7    HG   SER   8           HG       SER   8 -22.240  -0.769  -2.349
    8    HA   PRO   9           HA       PRO   9 -16.644   1.639  -4.971
    9    HB2  PRO   9           2HB      PRO   9 -15.672   3.237  -3.035
   10    HB3  PRO   9           1HB      PRO   9 -16.950   3.759  -4.133
   11    HG2  PRO   9           2HG      PRO   9 -17.135   2.924  -1.288
   12    HG3  PRO   9           1HG      PRO   9 -18.097   4.114  -2.175
   13    HD2  PRO   9           2HD      PRO   9 -18.850   1.469  -1.576
   14    HD3  PRO   9           1HD      PRO   9 -19.650   2.555  -2.728
   15    HA   PRO  10           HA       PRO  10 -14.343  -1.402  -2.476
   16    HB2  PRO  10           2HB      PRO  10 -13.205  -2.732  -4.502
   17    HB3  PRO  10           1HB      PRO  10 -14.904  -2.977  -4.082
   18    HG2  PRO  10           2HG      PRO  10 -13.721  -1.505  -6.370
   19    HG3  PRO  10           1HG      PRO  10 -15.271  -2.346  -6.255
   20    HD2  PRO  10           2HD      PRO  10 -14.805   0.448  -5.998
   21    HD3  PRO  10           1HD      PRO  10 -16.328  -0.416  -5.721
   22    H    LYS  11           H        LYS  11 -11.960  -1.873  -2.329
   23    HA   LYS  11           HA       LYS  11 -10.377   0.382  -3.363
   24    HB2  LYS  11           2HB      LYS  11  -9.845  -1.264  -0.897
   25    HB3  LYS  11           1HB      LYS  11  -8.881   0.093  -1.449
   26    HG2  LYS  11           2HG      LYS  11 -10.877   1.555  -1.058
   27    HG3  LYS  11           1HG      LYS  11 -11.676   0.158  -0.326
   28    HD2  LYS  11           2HD      LYS  11  -9.129   1.499   0.607
   29    HD3  LYS  11           1HD      LYS  11 -10.686   1.494   1.431
   30    HE2  LYS  11           2HE      LYS  11 -10.506  -0.946   1.730
   31    HE3  LYS  11           1HE      LYS  11  -8.963  -0.926   0.893
   32    HZ1  LYS  11           3HZ      LYS  11  -8.131   0.569   2.657
   33    HZ2  LYS  11           1HZ      LYS  11  -8.580  -0.971   3.211
   34    HZ3  LYS  11           2HZ      LYS  11  -9.581   0.350   3.496
   35    HA   PRO  12           HA       PRO  12  -7.991  -2.814  -5.437
   36    HB2  PRO  12           2HB      PRO  12  -5.704  -0.973  -5.265
   37    HB3  PRO  12           1HB      PRO  12  -6.498  -1.618  -6.700
   38    HG2  PRO  12           2HG      PRO  12  -6.763   0.967  -5.998
   39    HG3  PRO  12           1HG      PRO  12  -8.074   0.052  -6.765
   40    HD2  PRO  12           2HD      PRO  12  -7.710   0.793  -3.892
   41    HD3  PRO  12           1HD      PRO  12  -9.186   0.764  -4.884
   42    H    LYS  13           H        LYS  13  -6.510  -4.348  -4.784
   43    HA   LYS  13           HA       LYS  13  -5.228  -3.885  -2.199
   44    HB2  LYS  13           2HB      LYS  13  -6.685  -6.393  -3.070
   45    HB3  LYS  13           1HB      LYS  13  -5.716  -6.229  -1.604
   46    HG2  LYS  13           2HG      LYS  13  -7.203  -4.673  -0.658
   47    HG3  LYS  13           1HG      LYS  13  -8.064  -4.463  -2.182
   48    HD2  LYS  13           2HD      LYS  13  -8.900  -6.714  -2.058
   49    HD3  LYS  13           1HD      LYS  13  -7.964  -7.016  -0.589
   50    HE2  LYS  13           2HE      LYS  13  -9.234  -5.394   0.621
   51    HE3  LYS  13           1HE      LYS  13 -10.072  -4.880  -0.839
   52    HZ1  LYS  13           3HZ      LYS  13 -11.181  -6.935  -0.965
   53    HZ2  LYS  13           1HZ      LYS  13 -11.370  -6.387   0.609
   54    HZ3  LYS  13           2HZ      LYS  13 -10.278  -7.636   0.261
   55    H    CYS  14           H        CYS  14  -3.315  -5.067  -1.861
   56    HA   CYS  14           HA       CYS  14  -2.062  -5.979  -4.354
   57    HB2  CYS  14           2HB      CYS  14  -0.030  -4.797  -3.663
   58    HB3  CYS  14           1HB      CYS  14  -1.387  -3.687  -3.863
   59    H    ARG  15           H        ARG  15  -0.037  -7.139  -3.902
   60    HA   ARG  15           HA       ARG  15  -0.095  -8.640  -1.374
   61    HB2  ARG  15           2HB      ARG  15   0.512  -9.634  -4.176
   62    HB3  ARG  15           1HB      ARG  15   1.027 -10.511  -2.747
   63    HG2  ARG  15           2HG      ARG  15  -0.967 -11.535  -3.544
   64    HG3  ARG  15           1HG      ARG  15  -1.384 -10.657  -2.075
   65    HD2  ARG  15           2HD      ARG  15  -2.152  -8.775  -3.558
   66    HD3  ARG  15           1HD      ARG  15  -1.917  -9.870  -4.922
   67    HE   ARG  15           HE       ARG  15  -3.465 -11.235  -3.173
   68   HH11  ARG  15          1HH1      ARG  15  -3.777  -8.210  -5.022
   69   HH12  ARG  15          2HH1      ARG  15  -5.478  -8.214  -5.010
   70   HH21  ARG  15          1HH2      ARG  15  -5.841 -11.230  -3.200
   71   HH22  ARG  15          2HH2      ARG  15  -6.656  -9.957  -3.949
   72    H    CYS  16           H        CYS  16   1.261  -6.189  -2.129
   73    HA   CYS  16           HA       CYS  16   3.983  -6.493  -2.683
   74    HB2  CYS  16           2HB      CYS  16   2.672  -4.435  -0.886
   75    HB3  CYS  16           1HB      CYS  16   4.294  -4.334  -1.550
   76    H    GLY  17           H        GLY  17   5.369  -7.664  -1.623
   77    HA2  GLY  17           2HA      GLY  17   6.650  -7.747   0.513
   78    HA3  GLY  17           1HA      GLY  17   5.078  -7.922   1.304
   79    H    ILE  18           H        ILE  18   3.845  -9.571  -0.476
   80    HA   ILE  18           HA       ILE  18   5.097 -12.131   0.009
   81    HB   ILE  18           HB       ILE  18   2.716 -11.450  -1.763
   82   HG12  ILE  18          2HG1      ILE  18   2.738 -12.311   1.139
   83   HG13  ILE  18          1HG1      ILE  18   2.285 -10.729   0.531
   84   HG21  ILE  18          1HG2      ILE  18   3.669 -13.617  -2.259
   85   HG22  ILE  18          2HG2      ILE  18   2.100 -13.811  -1.470
   86   HG23  ILE  18          3HG2      ILE  18   3.584 -14.071  -0.555
   87   HD11  ILE  18          3HD1      ILE  18   0.826 -13.306  -0.033
   88   HD12  ILE  18          1HD1      ILE  18   0.383 -11.714  -0.647
   89   HD13  ILE  18          2HD1      ILE  18   0.315 -12.038   1.083
   90    H    SER  19           H        SER  19   4.324  -9.966  -2.604
   91    HA   SER  19           HA       SER  19   6.501 -11.013  -4.228
   92    HB2  SER  19           2HB      SER  19   3.734 -10.164  -5.155
   93    HB3  SER  19           1HB      SER  19   5.041 -10.694  -6.209
   94    HG   SER  19           HG       SER  19   4.973 -12.696  -4.934
   95    H    GLY  20           H        GLY  20   7.175  -9.220  -5.800
   96    HA2  GLY  20           2HA      GLY  20   7.238  -6.942  -6.399
   97    HA3  GLY  20           1HA      GLY  20   6.311  -6.560  -4.959
   98    H    SER  21           H        SER  21   9.324  -8.393  -5.317
   99    HA   SER  21           HA       SER  21  10.492  -7.001  -3.111
  100    HB2  SER  21           2HB      SER  21  11.712  -8.960  -5.067
  101    HB3  SER  21           1HB      SER  21  12.395  -8.477  -3.514
  102    HG   SER  21           HG       SER  21  10.207  -9.273  -2.718
  103    H    SER  22           H        SER  22  10.951  -4.958  -3.540
  104    HA   SER  22           HA       SER  22  12.989  -4.339  -5.500
  105    HB2  SER  22           2HB      SER  22  10.317  -2.890  -5.538
  106    HB3  SER  22           1HB      SER  22  11.726  -2.475  -6.516
  107    HG   SER  22           HG       SER  22  11.251  -5.032  -6.843
  108    H    ASN  23           H        ASN  23  10.719  -3.108  -3.086
  109    HA   ASN  23           HA       ASN  23  12.914  -1.622  -1.867
  110    HB2  ASN  23           2HB      ASN  23  10.002  -0.758  -2.122
  111    HB3  ASN  23           1HB      ASN  23  11.189   0.031  -1.101
  112   HD21  ASN  23          1HD2      ASN  23  10.032  -0.404  -4.335
  113   HD22  ASN  23          2HD2      ASN  23  11.013   0.793  -5.078
  114    H    THR  24           H        THR  24  13.168  -2.203   0.234
  115    HA   THR  24           HA       THR  24  11.324  -4.247   1.206
  116    HB   THR  24           HB       THR  24  14.022  -3.476   2.353
  117    HG1  THR  24           1HG      THR  24  14.373  -4.138   0.251
  118   HG21  THR  24          3HG2      THR  24  12.580  -4.830   3.824
  119   HG22  THR  24          1HG2      THR  24  13.965  -5.764   3.261
  120   HG23  THR  24          2HG2      THR  24  12.381  -6.016   2.533
  121    H    LEU  25           H        LEU  25  12.521  -1.073   1.976
  122    HA   LEU  25           HA       LEU  25  11.093  -0.990   4.527
  123    HB2  LEU  25           2HB      LEU  25  12.722   1.137   3.134
  124    HB3  LEU  25           1HB      LEU  25  12.138   1.190   4.784
  125    HG   LEU  25           HG       LEU  25  14.212  -0.744   3.742
  126   HD11  LEU  25          1HD1      LEU  25  15.038   1.525   3.743
  127   HD12  LEU  25          2HD1      LEU  25  15.784   0.606   5.053
  128   HD13  LEU  25          3HD1      LEU  25  14.477   1.745   5.397
  129   HD21  LEU  25          3HD2      LEU  25  13.274  -0.167   6.551
  130   HD22  LEU  25          1HD2      LEU  25  14.591  -1.250   6.102
  131   HD23  LEU  25          2HD2      LEU  25  12.939  -1.633   5.624
  132    H    THR  26           H        THR  26  11.099   0.229   1.302
  133    HA   THR  26           HA       THR  26   8.764   1.906   1.784
  134    HB   THR  26           HB       THR  26  10.417   1.761  -0.741
  135    HG1  THR  26           1HG      THR  26  11.110   3.557   1.331
  136   HG21  THR  26          3HG2      THR  26   8.388   3.184  -0.705
  137   HG22  THR  26          1HG2      THR  26   9.866   4.129  -0.873
  138   HG23  THR  26          2HG2      THR  26   9.043   4.051   0.683
  139    H    THR  27           H        THR  27   8.626  -1.129   1.556
  140    HA   THR  27           HA       THR  27   8.081  -2.202  -0.899
  141    HB   THR  27           HB       THR  27   6.597  -2.912   1.644
  142    HG1  THR  27           1HG      THR  27   9.188  -3.562   0.671
  143   HG21  THR  27          3HG2      THR  27   7.431  -4.577  -0.747
  144   HG22  THR  27          1HG2      THR  27   5.794  -4.039  -0.377
  145   HG23  THR  27          2HG2      THR  27   6.607  -5.178   0.695
  146    H    CYS  28           H        CYS  28   5.401  -1.223   1.247
  147    HA   CYS  28           HA       CYS  28   3.732  -0.901  -1.084
  148    HB2  CYS  28           2HB      CYS  28   3.107  -0.984   1.829
  149    HB3  CYS  28           1HB      CYS  28   1.916  -0.311   0.731
  150    H    ARG  29           H        ARG  29   5.847   1.035   0.214
  151    HA   ARG  29           HA       ARG  29   4.224   3.482   0.352
  152    HB2  ARG  29           2HB      ARG  29   5.804   2.689   2.166
  153    HB3  ARG  29           1HB      ARG  29   7.117   3.069   1.077
  154    HG2  ARG  29           2HG      ARG  29   6.386   5.437   1.098
  155    HG3  ARG  29           1HG      ARG  29   5.134   5.008   2.268
  156    HD2  ARG  29           2HD      ARG  29   6.928   4.103   3.753
  157    HD3  ARG  29           1HD      ARG  29   8.117   4.745   2.625
  158    HE   ARG  29           HE       ARG  29   6.255   6.706   3.551
  159   HH11  ARG  29          1HH1      ARG  29   9.407   5.192   4.173
  160   HH12  ARG  29          2HH1      ARG  29   9.838   6.298   5.389
  161   HH21  ARG  29          1HH2      ARG  29   6.881   8.218   5.215
  162   HH22  ARG  29          2HH2      ARG  29   8.390   8.046   5.984
  163    H    ASN  30           H        ASN  30   5.300   2.009  -2.202
  164    HA   ASN  30           HA       ASN  30   6.605   4.379  -3.320
  165    HB2  ASN  30           2HB      ASN  30   8.278   3.139  -4.496
  166    HB3  ASN  30           1HB      ASN  30   8.315   2.567  -2.835
  167   HD21  ASN  30          1HD2      ASN  30   7.592   0.481  -2.413
  168   HD22  ASN  30          2HD2      ASN  30   7.340  -0.695  -3.650
  169    H    SER  31           H        SER  31   6.805   4.013  -5.824
  170    HA   SER  31           HA       SER  31   4.256   4.345  -6.879
  171    HB2  SER  31           2HB      SER  31   6.796   3.755  -8.373
  172    HB3  SER  31           1HB      SER  31   5.402   4.685  -8.935
  173    HG   SER  31           HG       SER  31   5.823   6.188  -7.320
  174    H    ARG  32           H        ARG  32   5.908   1.379  -6.338
  175    HA   ARG  32           HA       ARG  32   4.540   0.052  -8.522
  176    HB2  ARG  32           2HB      ARG  32   6.563  -0.982  -6.544
  177    HB3  ARG  32           1HB      ARG  32   5.874  -1.932  -7.860
  178    HG2  ARG  32           2HG      ARG  32   6.795  -0.372  -9.484
  179    HG3  ARG  32           1HG      ARG  32   7.448   0.611  -8.182
  180    HD2  ARG  32           2HD      ARG  32   8.864  -1.292  -7.503
  181    HD3  ARG  32           1HD      ARG  32   8.232  -2.212  -8.876
  182    HE   ARG  32           HE       ARG  32   9.165   0.260  -9.764
  183   HH11  ARG  32          1HH1      ARG  32  10.529  -2.817  -8.566
  184   HH12  ARG  32          2HH1      ARG  32  11.973  -2.614  -9.420
  185   HH21  ARG  32          1HH2      ARG  32  11.169   0.485 -10.889
  186   HH22  ARG  32          2HH2      ARG  32  12.370  -0.704 -10.746
  187    H    CYS  33           H        CYS  33   3.659   0.968  -5.570
  188    HA   CYS  33           HA       CYS  33   2.048  -1.417  -5.151
  189    HB2  CYS  33           2HB      CYS  33   3.195  -0.541  -3.155
  190    HB3  CYS  33           1HB      CYS  33   2.406   1.015  -3.385
  191    HA   PRO  34           HA       PRO  34  -0.928   0.795  -7.686
  192    HB2  PRO  34           2HB      PRO  34  -3.022  -0.958  -7.181
  193    HB3  PRO  34           1HB      PRO  34  -1.810  -1.176  -8.445
  194    HG2  PRO  34           2HG      PRO  34  -1.940  -2.367  -5.712
  195    HG3  PRO  34           1HG      PRO  34  -1.450  -3.127  -7.234
  196    HD2  PRO  34           2HD      PRO  34   0.336  -2.355  -5.429
  197    HD3  PRO  34           1HD      PRO  34   0.675  -2.166  -7.163
  198    H    CYS  35           H        CYS  35  -1.462  -0.200  -4.432
  199    HA   CYS  35           HA       CYS  35  -3.838   1.265  -3.888
  200    HB2  CYS  35           2HB      CYS  35  -1.672   0.405  -1.988
  201    HB3  CYS  35           1HB      CYS  35  -3.310   0.878  -1.551
  202    H    TYR  36           H        TYR  36  -0.513   1.785  -2.873
  203    HA   TYR  36           HA       TYR  36  -0.750   4.255  -1.660
  204    HB2  TYR  36           2HB      TYR  36   1.213   2.892  -1.364
  205    HB3  TYR  36           1HB      TYR  36   1.600   3.015  -3.077
  206    HD1  TYR  36           2HD      TYR  36   1.437   4.877   0.078
  207    HD2  TYR  36           1HD      TYR  36   2.762   4.910  -3.952
  208    HE1  TYR  36           2HE      TYR  36   2.750   6.907   0.528
  209    HE2  TYR  36           1HE      TYR  36   4.064   6.922  -3.541
  210    HH   TYR  36           HH       TYR  36   3.979   8.806  -1.911
  211    H    LYS  37           H        LYS  37   0.264   3.515  -4.949
  212    HA   LYS  37           HA       LYS  37   0.792   6.169  -5.653
  213    HB2  LYS  37           2HB      LYS  37   1.611   3.964  -6.721
  214    HB3  LYS  37           1HB      LYS  37   0.093   3.954  -7.591
  215    HG2  LYS  37           2HG      LYS  37   2.077   6.203  -7.718
  216    HG3  LYS  37           1HG      LYS  37   2.076   4.854  -8.853
  217    HD2  LYS  37           2HD      LYS  37  -0.154   5.443  -9.577
  218    HD3  LYS  37           1HD      LYS  37  -0.234   6.730  -8.374
  219    HE2  LYS  37           2HE      LYS  37   1.669   7.825  -9.509
  220    HE3  LYS  37           1HE      LYS  37   1.611   6.554 -10.737
  221    HZ1  LYS  37           3HZ      LYS  37   0.398   8.494 -11.481
  222    HZ2  LYS  37           1HZ      LYS  37  -0.571   8.450 -10.097
  223    HZ3  LYS  37           2HZ      LYS  37  -0.664   7.214 -11.226
  224    H    SER  38           H        SER  38  -2.124   4.201  -5.869
  225    HA   SER  38           HA       SER  38  -3.564   6.369  -7.160
  226    HB2  SER  38           2HB      SER  38  -4.559   3.643  -6.292
  227    HB3  SER  38           1HB      SER  38  -5.411   4.786  -7.334
  228    HG   SER  38           HG       SER  38  -3.418   3.019  -7.894
  229    H    TYR  39           H        TYR  39  -2.501   6.192  -4.266
  230    HA   TYR  39           HA       TYR  39  -2.901   7.208  -2.351
  231    HB2  TYR  39           2HB      TYR  39  -5.248   8.449  -3.785
  232    HB3  TYR  39           1HB      TYR  39  -4.596   9.003  -2.242
  233    HD1  TYR  39           2HD      TYR  39  -2.015   9.500  -2.239
  234    HD2  TYR  39           1HD      TYR  39  -4.420   9.404  -5.744
  235    HE1  TYR  39           2HE      TYR  39  -0.318  10.806  -3.430
  236    HE2  TYR  39           1HE      TYR  39  -2.722  10.708  -6.948
  237    HH   TYR  39           HH       TYR  39  -0.919  12.261  -6.393
  238    H    ASN  40           H        ASN  40  -4.160   4.618  -2.857
  239    HA   ASN  40           HA       ASN  40  -6.342   4.704  -0.914
  240    HB2  ASN  40           2HB      ASN  40  -5.433   2.533  -2.798
  241    HB3  ASN  40           1HB      ASN  40  -6.520   2.194  -1.459
  242   HD21  ASN  40          1HD2      ASN  40  -6.167   3.702  -4.544
  243   HD22  ASN  40          2HD2      ASN  40  -7.842   3.990  -4.828
  244    H    SER  41           H        SER  41  -6.367   2.788   0.624
  245    HA   SER  41           HA       SER  41  -3.867   2.839   2.072
  246    HB2  SER  41           2HB      SER  41  -5.375   1.950   3.882
  247    HB3  SER  41           1HB      SER  41  -5.815   3.552   3.283
  248    HG   SER  41           HG       SER  41  -7.665   2.482   3.291
  249    H    CYS  42           H        CYS  42  -3.376   0.725   3.236
  250    HA   CYS  42           HA       CYS  42  -3.933  -1.497   1.430
  251    HB2  CYS  42           2HB      CYS  42  -1.504  -0.948   3.094
  252    HB3  CYS  42           1HB      CYS  42  -1.863  -2.563   2.486
  253    H    ALA  43           H        ALA  43  -5.203  -0.386   3.960
  254    HA   ALA  43           HA       ALA  43  -5.265  -2.626   5.706
  255    HB1  ALA  43           1HB      ALA  43  -7.253  -1.533   6.689
  256    HB2  ALA  43           2HB      ALA  43  -7.268  -0.386   5.351
  257    HB3  ALA  43           3HB      ALA  43  -5.922  -0.393   6.489
  258    H    GLY  44           H        GLY  44  -6.018  -4.530   5.094
  259    HA2  GLY  44           2HA      GLY  44  -7.918  -5.874   4.470
  260    HA3  GLY  44           1HA      GLY  44  -8.390  -4.597   3.356
  261    H    CYS  45           H        CYS  45  -5.174  -4.703   2.980
  262    HA   CYS  45           HA       CYS  45  -5.314  -6.321   0.587
  263    HB2  CYS  45           2HB      CYS  45  -2.974  -4.906   1.877
  264    HB3  CYS  45           1HB      CYS  45  -2.935  -5.705   0.315
  265    H    HIS  46           H        HIS  46  -3.006  -7.605   0.385
  266    HA   HIS  46           HA       HIS  46  -2.793  -9.272   2.775
  267    HB2  HIS  46           2HB      HIS  46  -2.673 -10.096  -0.136
  268    HB3  HIS  46           1HB      HIS  46  -2.162 -11.144   1.185
  269    HD1  HIS  46           1HD      HIS  46  -4.104 -11.769   2.931
  270    HD2  HIS  46           2HD      HIS  46  -5.364 -10.172  -0.681
  271    HE1  HIS  46           1HE      HIS  46  -6.550 -12.305   2.778
  272    HE2  HIS  46           2HE      HIS  46  -7.225 -11.553   0.497
  273    H    CYS  47           H        CYS  47  -1.473  -6.897   2.033
  274    HA   CYS  47           HA       CYS  47   1.111  -7.577   1.027
  275    HB2  CYS  47           2HB      CYS  47   1.610  -5.136   1.519
  276    HB3  CYS  47           1HB      CYS  47   0.353  -5.458   0.337
  277    H    VAL  48           H        VAL  48   3.035  -7.462   2.051
  278    HA   VAL  48           HA       VAL  48   3.004  -7.849   4.968
  279    HB   VAL  48           HB       VAL  48   4.734  -9.277   2.908
  280   HG11  VAL  48          1HG1      VAL  48   5.523 -10.650   4.766
  281   HG12  VAL  48          2HG1      VAL  48   4.592  -9.661   5.889
  282   HG13  VAL  48          3HG1      VAL  48   5.929  -8.949   4.988
  283   HG21  VAL  48          3HG2      VAL  48   3.520 -11.320   3.557
  284   HG22  VAL  48          1HG2      VAL  48   2.453 -10.114   2.836
  285   HG23  VAL  48          2HG2      VAL  48   2.462 -10.352   4.581
  286    H    GLY  49           H        GLY  49   4.422  -6.513   6.010
  287    HA2  GLY  49           2HA      GLY  49   6.087  -4.938   6.309
  288    HA3  GLY  49           1HA      GLY  49   6.796  -5.487   4.788
  289    H    CYS  50           H        CYS  50   3.743  -4.062   5.704
  290    HA   CYS  50           HA       CYS  50   3.832  -2.426   3.314
  291    HB2  CYS  50           2HB      CYS  50   1.811  -3.624   3.507
  292    HB3  CYS  50           1HB      CYS  50   1.619  -3.166   5.195
  293    H    LYS  51           H        LYS  51   4.655  -0.463   3.549
  294    HA   LYS  51           HA       LYS  51   3.774   1.030   5.907
  295    HB2  LYS  51           2HB      LYS  51   5.939   1.741   3.898
  296    HB3  LYS  51           1HB      LYS  51   5.526   2.673   5.324
  297    HG2  LYS  51           2HG      LYS  51   6.747  -0.070   5.256
  298    HG3  LYS  51           1HG      LYS  51   7.584   1.435   5.635
  299    HD2  LYS  51           2HD      LYS  51   6.109   1.704   7.601
  300    HD3  LYS  51           1HD      LYS  51   5.356   0.155   7.218
  301    HE2  LYS  51           2HE      LYS  51   8.256   0.622   7.896
  302    HE3  LYS  51           1HE      LYS  51   7.049  -0.127   8.934
  303    HZ1  LYS  51           3HZ      LYS  51   8.009  -1.216   6.337
  304    HZ2  LYS  51           1HZ      LYS  51   6.862  -1.947   7.345
  305    HZ3  LYS  51           2HZ      LYS  51   8.463  -1.743   7.846
  306    H    ASN  52           H        ASN  52   1.744   1.487   5.175
  307    HA   ASN  52           HA       ASN  52   1.609   3.004   2.682
  308    HB2  ASN  52           2HB      ASN  52   0.169   0.968   2.703
  309    HB3  ASN  52           1HB      ASN  52  -0.657   1.594   4.124
  310   HD21  ASN  52          1HD2      ASN  52  -0.298   1.866   0.670
  311   HD22  ASN  52          2HD2      ASN  52  -1.655   2.921   0.442
  312    HA   PRO  53           HA       PRO  53   1.359   6.259   5.788
  313    HB2  PRO  53           2HB      PRO  53   1.191   7.845   3.278
  314    HB3  PRO  53           1HB      PRO  53   2.224   8.075   4.694
  315    HG2  PRO  53           2HG      PRO  53   3.286   7.072   2.513
  316    HG3  PRO  53           1HG      PRO  53   3.664   6.337   4.078
  317    HD2  PRO  53           2HD      PRO  53   1.706   5.415   2.005
  318    HD3  PRO  53           1HD      PRO  53   2.931   4.481   2.900
  319    H    HIS  54           H        HIS  54  -1.042   5.178   3.744
  320    HA   HIS  54           HA       HIS  54  -2.841   7.394   4.366
  321    HB2  HIS  54           2HB      HIS  54  -3.257   5.045   2.495
  322    HB3  HIS  54           1HB      HIS  54  -4.493   6.241   2.863
  323    HD1  HIS  54           1HD      HIS  54  -4.200   8.599   1.798
  324    HD2  HIS  54           2HD      HIS  54  -1.265   5.851   0.735
  325    HE1  HIS  54           1HE      HIS  54  -2.983   9.627  -0.132
  326    HE2  HIS  54           2HE      HIS  54  -1.023   8.117  -0.492
  327    H    LYS  55           H        LYS  55  -4.542   7.189   5.587
  328    HA   LYS  55           HA       LYS  55  -4.674   4.890   7.390
  329    HB2  LYS  55           2HB      LYS  55  -4.210   7.091   8.354
  330    HB3  LYS  55           1HB      LYS  55  -5.599   7.767   7.535
  331    HG2  LYS  55           2HG      LYS  55  -7.027   6.234   8.917
  332    HG3  LYS  55           1HG      LYS  55  -5.571   5.839   9.838
  333    HD2  LYS  55           2HD      LYS  55  -5.274   8.117  10.467
  334    HD3  LYS  55           1HD      LYS  55  -6.581   8.630   9.399
  335    HE2  LYS  55           2HE      LYS  55  -8.157   7.312  10.753
  336    HE3  LYS  55           1HE      LYS  55  -6.846   6.919  11.869
  337    HZ1  LYS  55           3HZ      LYS  55  -8.197   8.827  12.619
  338    HZ2  LYS  55           1HZ      LYS  55  -7.774   9.651  11.221
  339    HZ3  LYS  55           2HZ      LYS  55  -6.594   9.266  12.353
  340    H    GLU  56           H        GLU  56  -6.925   4.254   7.977
  341    HA   GLU  56           HA       GLU  56  -8.716   4.428   5.759
  342    HB2  GLU  56           2HB      GLU  56  -8.871   3.041   8.414
  343    HB3  GLU  56           1HB      GLU  56 -10.259   3.129   7.335
  344    HG2  GLU  56           2HG      GLU  56  -7.586   2.051   6.550
  345    HG3  GLU  56           1HG      GLU  56  -8.920   1.046   7.140
  346    H    ASP  57           H        ASP  57  -9.135   6.506   5.599
  347    HA   ASP  57           HA       ASP  57 -10.473   7.868   7.804
  348    HB2  ASP  57           2HB      ASP  57  -8.752   9.000   6.239
  349    HB3  ASP  57           1HB      ASP  57 -10.014   8.945   5.013
  350    H    TYR  58           H        TYR  58 -12.668   8.029   7.862
  351    HA   TYR  58           HA       TYR  58 -14.156   7.183   5.495
  352    HB2  TYR  58           2HB      TYR  58 -13.568   5.277   7.186
  353    HB3  TYR  58           1HB      TYR  58 -14.770   6.039   8.211
  354    HD1  TYR  58           1HD      TYR  58 -17.171   5.982   7.539
  355    HD2  TYR  58           2HD      TYR  58 -14.165   4.013   5.265
  356    HE1  TYR  58           1HE      TYR  58 -18.900   4.638   6.418
  357    HE2  TYR  58           2HE      TYR  58 -15.884   2.672   4.135
  358    HH   TYR  58           HH       TYR  58 -19.166   3.420   4.323
  359    H    VAL  59           H        VAL  59 -16.356   7.930   5.590
  360    HA   VAL  59           HA       VAL  59 -16.633  10.145   7.404
  361    HB   VAL  59           HB       VAL  59 -16.897  10.761   5.077
  362   HG11  VAL  59          1HG1      VAL  59 -19.138   8.774   4.877
  363   HG12  VAL  59          2HG1      VAL  59 -17.564   8.676   4.083
  364   HG13  VAL  59          3HG1      VAL  59 -18.700   9.949   3.637
  365   HG21  VAL  59          3HG2      VAL  59 -18.250  12.021   6.635
  366   HG22  VAL  59          1HG2      VAL  59 -19.554  10.842   6.500
  367   HG23  VAL  59          2HG2      VAL  59 -19.120  11.835   5.111
  Start of MODEL   10
    1    H1   SER   8           1HT      SER   8 -18.884   2.173  -3.543
    2    H2   SER   8           2HT      SER   8 -19.167   3.116  -4.923
    3    H3   SER   8           3HT      SER   8 -19.398   3.768  -3.369
    4    HA   SER   8           HA       SER   8 -17.328   4.508  -4.330
    5    HB2  SER   8           2HB      SER   8 -15.945   3.758  -2.343
    6    HB3  SER   8           1HB      SER   8 -17.521   4.427  -1.927
    7    HG   SER   8           HG       SER   8 -16.640   2.211  -1.087
    8    HA   PRO   9           HA       PRO   9 -14.945   1.495  -6.563
    9    HB2  PRO   9           2HB      PRO   9 -12.413   2.468  -6.333
   10    HB3  PRO   9           1HB      PRO   9 -13.622   3.219  -7.375
   11    HG2  PRO   9           2HG      PRO   9 -12.723   4.016  -4.646
   12    HG3  PRO   9           1HG      PRO   9 -13.090   5.040  -6.047
   13    HD2  PRO   9           2HD      PRO   9 -14.816   4.675  -3.983
   14    HD3  PRO   9           1HD      PRO   9 -15.339   4.990  -5.647
   15    HA   PRO  10           HA       PRO  10 -13.570  -1.247  -3.248
   16    HB2  PRO  10           2HB      PRO  10 -12.548  -3.196  -4.912
   17    HB3  PRO  10           1HB      PRO  10 -14.255  -3.074  -4.471
   18    HG2  PRO  10           2HG      PRO  10 -12.861  -2.141  -6.940
   19    HG3  PRO  10           1HG      PRO  10 -14.445  -2.920  -6.779
   20    HD2  PRO  10           2HD      PRO  10 -14.200  -0.287  -7.168
   21    HD3  PRO  10           1HD      PRO  10 -15.476  -0.965  -6.134
   22    H    LYS  11           H        LYS  11 -11.716  -1.021  -2.179
   23    HA   LYS  11           HA       LYS  11  -9.539   0.226  -3.435
   24    HB2  LYS  11           2HB      LYS  11  -9.876  -0.830  -0.638
   25    HB3  LYS  11           1HB      LYS  11  -8.377  -0.081  -1.186
   26    HG2  LYS  11           2HG      LYS  11  -9.672   1.926  -1.835
   27    HG3  LYS  11           1HG      LYS  11 -11.102   1.180  -1.130
   28    HD2  LYS  11           2HD      LYS  11  -8.575   1.707   0.414
   29    HD3  LYS  11           1HD      LYS  11  -9.878   2.874   0.296
   30    HE2  LYS  11           2HE      LYS  11 -11.398   1.088   1.254
   31    HE3  LYS  11           1HE      LYS  11  -9.941   0.143   1.563
   32    HZ1  LYS  11           3HZ      LYS  11 -10.571   1.463   3.535
   33    HZ2  LYS  11           1HZ      LYS  11 -10.462   2.866   2.615
   34    HZ3  LYS  11           2HZ      LYS  11  -9.088   1.980   2.922
   35    HA   PRO  12           HA       PRO  12  -7.479  -3.210  -5.108
   36    HB2  PRO  12           2HB      PRO  12  -4.971  -1.752  -4.824
   37    HB3  PRO  12           1HB      PRO  12  -5.777  -2.296  -6.292
   38    HG2  PRO  12           2HG      PRO  12  -5.674   0.321  -5.584
   39    HG3  PRO  12           1HG      PRO  12  -7.022  -0.381  -6.496
   40    HD2  PRO  12           2HD      PRO  12  -6.874   0.386  -3.630
   41    HD3  PRO  12           1HD      PRO  12  -8.232   0.433  -4.776
   42    H    LYS  13           H        LYS  13  -6.439  -4.913  -4.405
   43    HA   LYS  13           HA       LYS  13  -5.210  -4.725  -1.781
   44    HB2  LYS  13           2HB      LYS  13  -5.575  -7.196  -1.665
   45    HB3  LYS  13           1HB      LYS  13  -7.020  -6.197  -1.547
   46    HG2  LYS  13           2HG      LYS  13  -7.512  -6.677  -3.919
   47    HG3  LYS  13           1HG      LYS  13  -6.084  -7.707  -3.994
   48    HD2  LYS  13           2HD      LYS  13  -7.047  -9.182  -2.315
   49    HD3  LYS  13           1HD      LYS  13  -8.464  -8.134  -2.182
   50    HE2  LYS  13           2HE      LYS  13  -9.012  -8.553  -4.506
   51    HE3  LYS  13           1HE      LYS  13  -7.579  -9.564  -4.687
   52    HZ1  LYS  13           3HZ      LYS  13  -9.911 -10.149  -2.924
   53    HZ2  LYS  13           1HZ      LYS  13  -8.523 -11.106  -3.101
   54    HZ3  LYS  13           2HZ      LYS  13  -9.562 -10.867  -4.399
   55    H    CYS  14           H        CYS  14  -3.225  -4.642  -1.869
   56    HA   CYS  14           HA       CYS  14  -1.746  -5.748  -4.119
   57    HB2  CYS  14           2HB      CYS  14   0.175  -4.434  -3.278
   58    HB3  CYS  14           1HB      CYS  14  -1.246  -3.442  -3.558
   59    H    ARG  15           H        ARG  15   0.173  -7.020  -3.750
   60    HA   ARG  15           HA       ARG  15   0.016  -8.609  -1.273
   61    HB2  ARG  15           2HB      ARG  15   0.815  -9.479  -4.058
   62    HB3  ARG  15           1HB      ARG  15   0.848 -10.524  -2.642
   63    HG2  ARG  15           2HG      ARG  15  -1.591 -10.195  -2.396
   64    HG3  ARG  15           1HG      ARG  15  -1.582  -9.211  -3.853
   65    HD2  ARG  15           2HD      ARG  15  -0.706 -11.206  -5.087
   66    HD3  ARG  15           1HD      ARG  15  -0.948 -12.152  -3.612
   67    HE   ARG  15           HE       ARG  15  -3.246 -10.669  -4.422
   68   HH11  ARG  15          1HH1      ARG  15  -1.631 -13.797  -4.803
   69   HH12  ARG  15          2HH1      ARG  15  -2.990 -14.582  -5.447
   70   HH21  ARG  15          1HH2      ARG  15  -5.096 -11.730  -5.287
   71   HH22  ARG  15          2HH2      ARG  15  -5.019 -13.375  -5.725
   72    H    CYS  16           H        CYS  16   1.485  -6.237  -1.681
   73    HA   CYS  16           HA       CYS  16   4.233  -6.534  -2.189
   74    HB2  CYS  16           2HB      CYS  16   2.877  -4.645  -0.241
   75    HB3  CYS  16           1HB      CYS  16   4.500  -4.460  -0.886
   76    H    GLY  17           H        GLY  17   5.520  -7.936  -1.149
   77    HA2  GLY  17           2HA      GLY  17   6.650  -8.207   1.088
   78    HA3  GLY  17           1HA      GLY  17   5.021  -8.420   1.729
   79    H    ILE  18           H        ILE  18   3.919  -9.915  -0.338
   80    HA   ILE  18           HA       ILE  18   5.030 -12.523   0.119
   81    HB   ILE  18           HB       ILE  18   2.992 -11.637  -1.976
   82   HG12  ILE  18          2HG1      ILE  18   2.532 -12.760   0.805
   83   HG13  ILE  18          1HG1      ILE  18   2.231 -11.104   0.298
   84   HG21  ILE  18          1HG2      ILE  18   2.305 -14.003  -2.037
   85   HG22  ILE  18          2HG2      ILE  18   3.581 -14.399  -0.889
   86   HG23  ILE  18          3HG2      ILE  18   3.999 -13.812  -2.496
   87   HD11  ILE  18          3HD1      ILE  18   0.491 -11.909  -1.242
   88   HD12  ILE  18          1HD1      ILE  18   0.170 -12.362   0.432
   89   HD13  ILE  18          2HD1      ILE  18   0.797 -13.557  -0.701
   90    H    SER  19           H        SER  19   4.920 -10.111  -2.342
   91    HA   SER  19           HA       SER  19   7.360 -11.160  -3.529
   92    HB2  SER  19           2HB      SER  19   5.393 -11.467  -5.067
   93    HB3  SER  19           1HB      SER  19   5.081  -9.732  -4.951
   94    HG   SER  19           HG       SER  19   7.252 -11.082  -6.111
   95    H    GLY  20           H        GLY  20   8.933  -9.683  -3.133
   96    HA2  GLY  20           2HA      GLY  20   8.892  -6.999  -3.651
   97    HA3  GLY  20           1HA      GLY  20   8.254  -7.132  -2.016
   98    H    SER  21           H        SER  21  10.924  -8.399  -3.953
   99    HA   SER  21           HA       SER  21  12.633  -8.673  -1.680
  100    HB2  SER  21           2HB      SER  21  13.305  -8.752  -4.625
  101    HB3  SER  21           1HB      SER  21  14.241  -9.448  -3.299
  102    HG   SER  21           HG       SER  21  13.010 -11.130  -3.339
  103    H    SER  22           H        SER  22  14.392  -7.351  -1.188
  104    HA   SER  22           HA       SER  22  15.731  -5.618  -1.046
  105    HB2  SER  22           2HB      SER  22  14.765  -4.829  -3.804
  106    HB3  SER  22           1HB      SER  22  16.156  -4.128  -2.976
  107    HG   SER  22           HG       SER  22  16.421  -6.745  -2.899
  108    H    ASN  23           H        ASN  23  12.544  -4.682  -2.279
  109    HA   ASN  23           HA       ASN  23  12.726  -2.410  -0.479
  110    HB2  ASN  23           2HB      ASN  23  10.807  -1.371  -1.677
  111    HB3  ASN  23           1HB      ASN  23  12.192  -1.640  -2.710
  112   HD21  ASN  23          1HD2      ASN  23  12.032  -3.171  -4.358
  113   HD22  ASN  23          2HD2      ASN  23  10.516  -3.779  -4.912
  114    H    THR  24           H        THR  24  12.409  -3.594   1.387
  115    HA   THR  24           HA       THR  24   9.583  -4.281   1.807
  116    HB   THR  24           HB       THR  24  11.925  -4.958   3.630
  117    HG1  THR  24           1HG      THR  24  11.245  -5.915   1.193
  118   HG21  THR  24          3HG2      THR  24  10.397  -6.726   4.428
  119   HG22  THR  24          1HG2      THR  24   9.164  -6.172   3.295
  120   HG23  THR  24          2HG2      THR  24   9.666  -5.130   4.626
  121    H    LEU  25           H        LEU  25  11.891  -1.961   2.246
  122    HA   LEU  25           HA       LEU  25  10.604  -0.749   4.553
  123    HB2  LEU  25           2HB      LEU  25  12.426   0.753   4.714
  124    HB3  LEU  25           1HB      LEU  25  13.117  -0.802   4.354
  125    HG   LEU  25           HG       LEU  25  12.799   1.488   2.395
  126   HD11  LEU  25          1HD1      LEU  25  15.231   0.402   3.772
  127   HD12  LEU  25          2HD1      LEU  25  14.437   1.942   4.100
  128   HD13  LEU  25          3HD1      LEU  25  15.217   1.665   2.542
  129   HD21  LEU  25          3HD2      LEU  25  12.746  -0.689   1.237
  130   HD22  LEU  25          1HD2      LEU  25  14.259  -1.134   2.040
  131   HD23  LEU  25          2HD2      LEU  25  14.231   0.204   0.898
  132    H    THR  26           H        THR  26  10.414  -0.729   1.206
  133    HA   THR  26           HA       THR  26   8.805   1.682   1.277
  134    HB   THR  26           HB       THR  26   9.708   2.056  -1.140
  135    HG1  THR  26           1HG      THR  26  11.362   0.967  -1.718
  136   HG21  THR  26          3HG2      THR  26  11.574   3.435  -0.282
  137   HG22  THR  26          1HG2      THR  26  11.426   2.641   1.282
  138   HG23  THR  26          2HG2      THR  26  10.105   3.640   0.672
  139    H    THR  27           H        THR  27   8.155  -1.250   1.298
  140    HA   THR  27           HA       THR  27   7.527  -2.471  -1.057
  141    HB   THR  27           HB       THR  27   5.517  -2.882   0.937
  142    HG1  THR  27           1HG      THR  27   6.915  -3.159   2.754
  143   HG21  THR  27          3HG2      THR  27   6.493  -4.636  -0.537
  144   HG22  THR  27          1HG2      THR  27   6.619  -5.060   1.170
  145   HG23  THR  27          2HG2      THR  27   8.033  -4.454   0.297
  146    H    CYS  28           H        CYS  28   5.187  -0.892   1.057
  147    HA   CYS  28           HA       CYS  28   3.393  -0.413  -1.140
  148    HB2  CYS  28           2HB      CYS  28   3.012  -0.206   1.844
  149    HB3  CYS  28           1HB      CYS  28   1.765   0.265   0.686
  150    H    ARG  29           H        ARG  29   5.876   1.195   0.053
  151    HA   ARG  29           HA       ARG  29   4.651   3.846   0.179
  152    HB2  ARG  29           2HB      ARG  29   6.193   3.098   1.983
  153    HB3  ARG  29           1HB      ARG  29   7.466   2.958   0.783
  154    HG2  ARG  29           2HG      ARG  29   7.405   5.366   0.421
  155    HG3  ARG  29           1HG      ARG  29   6.110   5.512   1.608
  156    HD2  ARG  29           2HD      ARG  29   7.528   4.704   3.355
  157    HD3  ARG  29           1HD      ARG  29   8.831   4.366   2.215
  158    HE   ARG  29           HE       ARG  29   8.299   7.039   1.947
  159   HH11  ARG  29          1HH1      ARG  29   9.247   4.968   4.640
  160   HH12  ARG  29          2HH1      ARG  29  10.189   6.153   5.407
  161   HH21  ARG  29          1HH2      ARG  29   9.596   8.685   3.027
  162   HH22  ARG  29          2HH2      ARG  29  10.384   8.301   4.491
  163    H    ASN  30           H        ASN  30   5.630   2.036  -2.307
  164    HA   ASN  30           HA       ASN  30   6.861   4.353  -3.625
  165    HB2  ASN  30           2HB      ASN  30   8.298   3.016  -4.938
  166    HB3  ASN  30           1HB      ASN  30   8.415   2.346  -3.320
  167   HD21  ASN  30          1HD2      ASN  30   7.519   0.296  -2.935
  168   HD22  ASN  30          2HD2      ASN  30   7.090  -0.752  -4.235
  169    H    SER  31           H        SER  31   6.612   4.225  -6.096
  170    HA   SER  31           HA       SER  31   3.871   4.549  -6.552
  171    HB2  SER  31           2HB      SER  31   6.131   4.508  -8.525
  172    HB3  SER  31           1HB      SER  31   4.547   5.247  -8.757
  173    HG   SER  31           HG       SER  31   6.621   6.399  -7.839
  174    H    ARG  32           H        ARG  32   5.670   1.645  -6.751
  175    HA   ARG  32           HA       ARG  32   4.060   0.576  -8.907
  176    HB2  ARG  32           2HB      ARG  32   6.173  -0.723  -7.183
  177    HB3  ARG  32           1HB      ARG  32   5.321  -1.532  -8.487
  178    HG2  ARG  32           2HG      ARG  32   7.069   0.900  -8.813
  179    HG3  ARG  32           1HG      ARG  32   7.561  -0.762  -9.137
  180    HD2  ARG  32           2HD      ARG  32   5.352   0.748 -10.552
  181    HD3  ARG  32           1HD      ARG  32   6.948   0.377 -11.200
  182    HE   ARG  32           HE       ARG  32   5.890  -2.021 -10.447
  183   HH11  ARG  32          1HH1      ARG  32   5.056   0.472 -12.802
  184   HH12  ARG  32          2HH1      ARG  32   4.229  -0.581 -13.845
  185   HH21  ARG  32          1HH2      ARG  32   4.801  -3.458 -11.828
  186   HH22  ARG  32          2HH2      ARG  32   4.055  -2.909 -13.267
  187    H    CYS  33           H        CYS  33   3.571   1.132  -5.705
  188    HA   CYS  33           HA       CYS  33   1.992  -1.242  -5.296
  189    HB2  CYS  33           2HB      CYS  33   3.278  -0.300  -3.399
  190    HB3  CYS  33           1HB      CYS  33   2.372   1.203  -3.535
  191    HA   PRO  34           HA       PRO  34  -1.338   0.782  -7.447
  192    HB2  PRO  34           2HB      PRO  34  -3.320  -1.000  -6.746
  193    HB3  PRO  34           1HB      PRO  34  -2.160  -1.271  -8.051
  194    HG2  PRO  34           2HG      PRO  34  -2.135  -2.294  -5.247
  195    HG3  PRO  34           1HG      PRO  34  -1.715  -3.138  -6.746
  196    HD2  PRO  34           2HD      PRO  34   0.157  -2.187  -5.066
  197    HD3  PRO  34           1HD      PRO  34   0.403  -2.197  -6.823
  198    H    CYS  35           H        CYS  35  -1.220   0.209  -4.129
  199    HA   CYS  35           HA       CYS  35  -3.649   1.610  -3.477
  200    HB2  CYS  35           2HB      CYS  35  -1.362   0.671  -1.778
  201    HB3  CYS  35           1HB      CYS  35  -2.862   1.346  -1.148
  202    H    TYR  36           H        TYR  36  -0.218   2.145  -2.859
  203    HA   TYR  36           HA       TYR  36  -0.174   4.643  -1.765
  204    HB2  TYR  36           2HB      TYR  36   1.794   3.260  -1.909
  205    HB3  TYR  36           1HB      TYR  36   1.779   3.355  -3.662
  206    HD1  TYR  36           2HD      TYR  36   2.498   5.227  -0.565
  207    HD2  TYR  36           1HD      TYR  36   2.740   5.225  -4.805
  208    HE1  TYR  36           2HE      TYR  36   4.039   7.155  -0.480
  209    HE2  TYR  36           1HE      TYR  36   4.280   7.135  -4.738
  210    HH   TYR  36           HH       TYR  36   4.921   8.909  -3.314
  211    H    LYS  37           H        LYS  37   0.300   3.973  -5.217
  212    HA   LYS  37           HA       LYS  37   0.425   6.728  -5.876
  213    HB2  LYS  37           2HB      LYS  37   1.617   4.913  -7.074
  214    HB3  LYS  37           1HB      LYS  37   0.079   4.364  -7.709
  215    HG2  LYS  37           2HG      LYS  37  -0.204   6.454  -8.918
  216    HG3  LYS  37           1HG      LYS  37   1.295   7.069  -8.228
  217    HD2  LYS  37           2HD      LYS  37   2.567   5.332  -9.349
  218    HD3  LYS  37           1HD      LYS  37   1.087   4.612  -9.968
  219    HE2  LYS  37           2HE      LYS  37   2.075   7.383 -10.617
  220    HE3  LYS  37           1HE      LYS  37   2.238   5.969 -11.666
  221    HZ1  LYS  37           3HZ      LYS  37  -0.214   5.826 -11.692
  222    HZ2  LYS  37           1HZ      LYS  37   0.360   7.283 -12.328
  223    HZ3  LYS  37           2HZ      LYS  37  -0.294   7.249 -10.792
  224    H    SER  38           H        SER  38  -2.182   4.606  -5.470
  225    HA   SER  38           HA       SER  38  -3.932   6.366  -7.024
  226    HB2  SER  38           2HB      SER  38  -4.529   3.635  -5.888
  227    HB3  SER  38           1HB      SER  38  -5.556   4.558  -6.983
  228    HG   SER  38           HG       SER  38  -3.534   2.925  -7.505
  229    H    TYR  39           H        TYR  39  -2.728   6.426  -4.126
  230    HA   TYR  39           HA       TYR  39  -3.213   7.494  -2.202
  231    HB2  TYR  39           2HB      TYR  39  -5.682   8.433  -3.695
  232    HB3  TYR  39           1HB      TYR  39  -5.097   9.104  -2.173
  233    HD1  TYR  39           2HD      TYR  39  -2.918  10.292  -2.126
  234    HD2  TYR  39           1HD      TYR  39  -4.717   9.072  -5.775
  235    HE1  TYR  39           2HE      TYR  39  -1.437  11.809  -3.360
  236    HE2  TYR  39           1HE      TYR  39  -3.234  10.589  -7.019
  237    HH   TYR  39           HH       TYR  39  -1.921  12.606  -6.602
  238    H    ASN  40           H        ASN  40  -4.108   4.752  -2.538
  239    HA   ASN  40           HA       ASN  40  -6.537   4.704  -0.880
  240    HB2  ASN  40           2HB      ASN  40  -5.212   2.410  -2.341
  241    HB3  ASN  40           1HB      ASN  40  -6.614   2.265  -1.305
  242   HD21  ASN  40          1HD2      ASN  40  -5.438   3.076  -4.372
  243   HD22  ASN  40          2HD2      ASN  40  -6.976   3.355  -5.121
  244    H    SER  41           H        SER  41  -6.627   3.049   0.755
  245    HA   SER  41           HA       SER  41  -4.177   2.944   2.302
  246    HB2  SER  41           2HB      SER  41  -5.900   2.251   4.074
  247    HB3  SER  41           1HB      SER  41  -5.939   3.930   3.529
  248    HG   SER  41           HG       SER  41  -7.750   3.542   2.369
  249    H    CYS  42           H        CYS  42  -3.566   0.911   3.223
  250    HA   CYS  42           HA       CYS  42  -4.310  -1.313   1.565
  251    HB2  CYS  42           2HB      CYS  42  -2.099  -1.015   3.589
  252    HB3  CYS  42           1HB      CYS  42  -2.475  -2.537   2.791
  253    H    ALA  43           H        ALA  43  -6.332  -1.142   2.441
  254    HA   ALA  43           HA       ALA  43  -6.626  -2.775   4.863
  255    HB1  ALA  43           1HB      ALA  43  -8.625  -0.853   3.645
  256    HB2  ALA  43           2HB      ALA  43  -7.633  -0.539   5.071
  257    HB3  ALA  43           3HB      ALA  43  -8.861  -1.802   5.117
  258    H    GLY  44           H        GLY  44  -6.913  -4.798   4.288
  259    HA2  GLY  44           2HA      GLY  44  -8.316  -6.490   3.355
  260    HA3  GLY  44           1HA      GLY  44  -8.724  -5.378   2.054
  261    H    CYS  45           H        CYS  45  -5.562  -5.062   2.683
  262    HA   CYS  45           HA       CYS  45  -4.801  -6.458   0.252
  263    HB2  CYS  45           2HB      CYS  45  -3.156  -4.770   2.132
  264    HB3  CYS  45           1HB      CYS  45  -2.630  -5.380   0.569
  265    H    HIS  46           H        HIS  46  -2.801  -7.761   0.262
  266    HA   HIS  46           HA       HIS  46  -2.555  -9.326   2.729
  267    HB2  HIS  46           2HB      HIS  46  -2.399 -10.149  -0.167
  268    HB3  HIS  46           1HB      HIS  46  -1.615 -11.106   1.087
  269    HD1  HIS  46           1HD      HIS  46  -3.011 -12.880   2.030
  270    HD2  HIS  46           2HD      HIS  46  -5.308  -9.823   0.442
  271    HE1  HIS  46           1HE      HIS  46  -5.389 -13.648   2.248
  272    HE2  HIS  46           2HE      HIS  46  -6.717 -11.612   1.616
  273    H    CYS  47           H        CYS  47  -1.293  -6.894   2.031
  274    HA   CYS  47           HA       CYS  47   1.402  -7.542   1.366
  275    HB2  CYS  47           2HB      CYS  47   1.835  -5.125   1.921
  276    HB3  CYS  47           1HB      CYS  47   0.748  -5.433   0.582
  277    H    VAL  48           H        VAL  48   3.001  -7.808   2.600
  278    HA   VAL  48           HA       VAL  48   2.604  -7.822   5.519
  279    HB   VAL  48           HB       VAL  48   4.361  -9.718   3.922
  280   HG11  VAL  48          1HG1      VAL  48   4.560 -10.964   6.039
  281   HG12  VAL  48          2HG1      VAL  48   3.635  -9.698   6.845
  282   HG13  VAL  48          3HG1      VAL  48   5.210  -9.327   6.149
  283   HG21  VAL  48          3HG2      VAL  48   2.742 -11.485   4.476
  284   HG22  VAL  48          1HG2      VAL  48   2.016 -10.221   3.486
  285   HG23  VAL  48          2HG2      VAL  48   1.688 -10.282   5.218
  286    H    GLY  49           H        GLY  49   3.874  -6.366   6.419
  287    HA2  GLY  49           2HA      GLY  49   5.834  -5.144   6.810
  288    HA3  GLY  49           1HA      GLY  49   6.512  -5.793   5.305
  289    H    CYS  50           H        CYS  50   3.429  -4.288   5.927
  290    HA   CYS  50           HA       CYS  50   3.616  -2.712   3.562
  291    HB2  CYS  50           2HB      CYS  50   1.505  -3.667   3.954
  292    HB3  CYS  50           1HB      CYS  50   1.505  -3.185   5.646
  293    H    LYS  51           H        LYS  51   4.872  -0.969   3.762
  294    HA   LYS  51           HA       LYS  51   4.218   0.806   5.997
  295    HB2  LYS  51           2HB      LYS  51   6.596   0.863   4.111
  296    HB3  LYS  51           1HB      LYS  51   6.289   2.004   5.413
  297    HG2  LYS  51           2HG      LYS  51   6.552   0.304   7.054
  298    HG3  LYS  51           1HG      LYS  51   6.687  -0.939   5.803
  299    HD2  LYS  51           2HD      LYS  51   8.746   0.118   5.002
  300    HD3  LYS  51           1HD      LYS  51   8.616   1.334   6.269
  301    HE2  LYS  51           2HE      LYS  51  10.198  -0.458   6.851
  302    HE3  LYS  51           1HE      LYS  51   8.857  -0.362   7.984
  303    HZ1  LYS  51           3HZ      LYS  51   9.086  -2.333   5.752
  304    HZ2  LYS  51           1HZ      LYS  51   7.841  -2.264   6.909
  305    HZ3  LYS  51           2HZ      LYS  51   9.406  -2.636   7.379
  306    H    ASN  52           H        ASN  52   2.369   1.578   5.133
  307    HA   ASN  52           HA       ASN  52   2.666   2.960   2.576
  308    HB2  ASN  52           2HB      ASN  52   0.912   1.232   2.485
  309    HB3  ASN  52           1HB      ASN  52   0.112   1.962   3.866
  310   HD21  ASN  52          1HD2      ASN  52  -1.725   2.157   2.615
  311   HD22  ASN  52          2HD2      ASN  52  -1.969   3.392   1.430
  312    HA   PRO  53           HA       PRO  53   2.375   6.486   5.280
  313    HB2  PRO  53           2HB      PRO  53   2.961   8.360   3.437
  314    HB3  PRO  53           1HB      PRO  53   4.185   7.293   4.135
  315    HG2  PRO  53           2HG      PRO  53   2.766   7.063   1.511
  316    HG3  PRO  53           1HG      PRO  53   4.493   6.865   1.862
  317    HD2  PRO  53           2HD      PRO  53   2.806   4.768   1.577
  318    HD3  PRO  53           1HD      PRO  53   4.207   4.717   2.662
  319    H    HIS  54           H        HIS  54   0.267   5.481   2.955
  320    HA   HIS  54           HA       HIS  54  -1.357   7.916   3.067
  321    HB2  HIS  54           2HB      HIS  54  -1.665   5.465   1.366
  322    HB3  HIS  54           1HB      HIS  54  -2.885   6.724   1.450
  323    HD1  HIS  54           1HD      HIS  54  -2.469   8.850   0.174
  324    HD2  HIS  54           2HD      HIS  54   0.712   6.208   0.042
  325    HE1  HIS  54           1HE      HIS  54  -0.939   9.738  -1.599
  326    HE2  HIS  54           2HE      HIS  54   0.862   8.043  -1.807
  327    H    LYS  55           H        LYS  55  -2.123   7.867   5.074
  328    HA   LYS  55           HA       LYS  55  -3.866   5.658   5.734
  329    HB2  LYS  55           2HB      LYS  55  -4.279   6.828   7.937
  330    HB3  LYS  55           1HB      LYS  55  -2.613   6.388   7.674
  331    HG2  LYS  55           2HG      LYS  55  -2.481   8.497   8.655
  332    HG3  LYS  55           1HG      LYS  55  -2.315   8.848   6.943
  333    HD2  LYS  55           2HD      LYS  55  -4.670   9.504   6.834
  334    HD3  LYS  55           1HD      LYS  55  -4.871   9.104   8.542
  335    HE2  LYS  55           2HE      LYS  55  -4.590  11.507   8.291
  336    HE3  LYS  55           1HE      LYS  55  -3.199  10.826   9.115
  337    HZ1  LYS  55           3HZ      LYS  55  -3.299  11.551   6.230
  338    HZ2  LYS  55           1HZ      LYS  55  -1.965  10.893   7.037
  339    HZ3  LYS  55           2HZ      LYS  55  -2.527  12.422   7.443
  340    H    GLU  56           H        GLU  56  -5.952   5.634   5.515
  341    HA   GLU  56           HA       GLU  56  -7.031   7.811   3.935
  342    HB2  GLU  56           2HB      GLU  56  -7.203   5.481   3.181
  343    HB3  GLU  56           1HB      GLU  56  -8.175   5.104   4.592
  344    HG2  GLU  56           2HG      GLU  56  -9.927   6.569   3.783
  345    HG3  GLU  56           1HG      GLU  56  -8.926   7.033   2.405
  346    H    ASP  57           H        ASP  57  -8.654   9.083   4.572
  347    HA   ASP  57           HA       ASP  57  -9.931   8.540   7.123
  348    HB2  ASP  57           2HB      ASP  57  -7.896  10.188   7.248
  349    HB3  ASP  57           1HB      ASP  57  -8.954  11.294   6.383
  350    H    TYR  58           H        TYR  58 -11.541  10.802   7.123
  351    HA   TYR  58           HA       TYR  58 -13.050  10.307   4.702
  352    HB2  TYR  58           2HB      TYR  58 -13.948  11.137   7.453
  353    HB3  TYR  58           1HB      TYR  58 -14.994  10.910   6.051
  354    HD1  TYR  58           1HD      TYR  58 -15.183   8.645   5.029
  355    HD2  TYR  58           2HD      TYR  58 -13.209   9.278   8.737
  356    HE1  TYR  58           1HE      TYR  58 -15.293   6.243   5.488
  357    HE2  TYR  58           2HE      TYR  58 -13.320   6.872   9.208
  358    HH   TYR  58           HH       TYR  58 -14.712   4.930   8.508
  359    H    VAL  59           H        VAL  59 -12.783  11.848   3.333
  360    HA   VAL  59           HA       VAL  59 -12.134  14.528   4.140
  361    HB   VAL  59           HB       VAL  59 -12.681  13.403   1.369
  362   HG11  VAL  59          1HG1      VAL  59 -12.910  15.837   1.480
  363   HG12  VAL  59          2HG1      VAL  59 -11.500  15.371   0.537
  364   HG13  VAL  59          3HG1      VAL  59 -11.294  15.963   2.179
  365   HG21  VAL  59          3HG2      VAL  59 -10.799  12.263   2.423
  366   HG22  VAL  59          1HG2      VAL  59 -10.046  13.812   2.786
  367   HG23  VAL  59          2HG2      VAL  59 -10.237  13.303   1.112
  Start of MODEL   11
    1    H1   SER   8           1HT      SER   8 -20.773   0.147  -2.281
    2    H2   SER   8           2HT      SER   8 -20.698   1.319  -1.056
    3    H3   SER   8           3HT      SER   8 -20.347  -0.315  -0.724
    4    HA   SER   8           HA       SER   8 -18.823   1.415  -2.527
    5    HB2  SER   8           2HB      SER   8 -18.204   0.394   0.257
    6    HB3  SER   8           1HB      SER   8 -17.091   1.306  -0.765
    7    HG   SER   8           HG       SER   8 -19.142   2.192   0.806
    8    HA   PRO   9           HA       PRO   9 -17.633  -2.696  -3.850
    9    HB2  PRO   9           2HB      PRO   9 -16.082  -1.968  -5.935
   10    HB3  PRO   9           1HB      PRO   9 -17.844  -1.849  -6.010
   11    HG2  PRO   9           2HG      PRO   9 -15.822   0.297  -5.560
   12    HG3  PRO   9           1HG      PRO   9 -17.331   0.347  -6.487
   13    HD2  PRO   9           2HD      PRO   9 -17.019   1.328  -3.919
   14    HD3  PRO   9           1HD      PRO   9 -18.568   0.888  -4.656
   15    HA   PRO  10           HA       PRO  10 -13.689  -3.369  -1.911
   16    HB2  PRO  10           2HB      PRO  10 -12.935  -4.995  -4.293
   17    HB3  PRO  10           1HB      PRO  10 -12.922  -5.448  -2.584
   18    HG2  PRO  10           2HG      PRO  10 -14.824  -6.374  -4.179
   19    HG3  PRO  10           1HG      PRO  10 -15.213  -5.835  -2.535
   20    HD2  PRO  10           2HD      PRO  10 -15.651  -4.417  -5.135
   21    HD3  PRO  10           1HD      PRO  10 -16.706  -4.535  -3.708
   22    H    LYS  11           H        LYS  11 -12.022  -2.084  -1.839
   23    HA   LYS  11           HA       LYS  11 -11.275  -0.443  -4.079
   24    HB2  LYS  11           2HB      LYS  11  -9.764   0.668  -2.489
   25    HB3  LYS  11           1HB      LYS  11 -11.368   0.489  -1.802
   26    HG2  LYS  11           2HG      LYS  11 -10.546  -1.471  -0.508
   27    HG3  LYS  11           1HG      LYS  11  -8.935  -1.179  -1.155
   28    HD2  LYS  11           2HD      LYS  11  -9.065  -0.206   1.054
   29    HD3  LYS  11           1HD      LYS  11  -9.006   1.099  -0.126
   30    HE2  LYS  11           2HE      LYS  11 -11.487   1.306   0.039
   31    HE3  LYS  11           1HE      LYS  11 -11.462   0.040   1.268
   32    HZ1  LYS  11           3HZ      LYS  11 -10.200   1.458   2.710
   33    HZ2  LYS  11           1HZ      LYS  11 -11.557   2.303   2.193
   34    HZ3  LYS  11           2HZ      LYS  11 -10.048   2.638   1.531
   35    HA   PRO  12           HA       PRO  12  -7.852  -2.819  -5.623
   36    HB2  PRO  12           2HB      PRO  12  -6.088  -0.485  -5.365
   37    HB3  PRO  12           1HB      PRO  12  -6.466  -1.417  -6.804
   38    HG2  PRO  12           2HG      PRO  12  -7.508   1.027  -6.493
   39    HG3  PRO  12           1HG      PRO  12  -8.460  -0.284  -7.211
   40    HD2  PRO  12           2HD      PRO  12  -8.589   0.859  -4.455
   41    HD3  PRO  12           1HD      PRO  12  -9.904   0.297  -5.507
   42    H    LYS  13           H        LYS  13  -6.194  -3.990  -4.864
   43    HA   LYS  13           HA       LYS  13  -5.122  -3.377  -2.228
   44    HB2  LYS  13           2HB      LYS  13  -6.505  -5.952  -3.016
   45    HB3  LYS  13           1HB      LYS  13  -5.564  -5.749  -1.542
   46    HG2  LYS  13           2HG      LYS  13  -7.095  -4.112  -0.713
   47    HG3  LYS  13           1HG      LYS  13  -7.957  -4.065  -2.245
   48    HD2  LYS  13           2HD      LYS  13  -8.636  -6.417  -1.885
   49    HD3  LYS  13           1HD      LYS  13  -7.822  -6.382  -0.320
   50    HE2  LYS  13           2HE      LYS  13  -9.269  -4.609   0.451
   51    HE3  LYS  13           1HE      LYS  13 -10.022  -4.498  -1.139
   52    HZ1  LYS  13           3HZ      LYS  13 -10.168  -6.876   0.640
   53    HZ2  LYS  13           1HZ      LYS  13 -10.943  -6.685  -0.838
   54    HZ3  LYS  13           2HZ      LYS  13 -11.375  -5.719   0.460
   55    H    CYS  14           H        CYS  14  -3.215  -4.518  -1.741
   56    HA   CYS  14           HA       CYS  14  -1.787  -5.480  -4.121
   57    HB2  CYS  14           2HB      CYS  14   0.218  -4.349  -3.229
   58    HB3  CYS  14           1HB      CYS  14  -1.093  -3.233  -3.554
   59    H    ARG  15           H        ARG  15   0.109  -6.816  -3.592
   60    HA   ARG  15           HA       ARG  15  -0.202  -8.428  -1.145
   61    HB2  ARG  15           2HB      ARG  15   0.193  -9.269  -4.019
   62    HB3  ARG  15           1HB      ARG  15   0.459 -10.359  -2.669
   63    HG2  ARG  15           2HG      ARG  15  -1.738 -10.665  -2.307
   64    HG3  ARG  15           1HG      ARG  15  -2.123  -8.974  -2.625
   65    HD2  ARG  15           2HD      ARG  15  -1.514 -11.044  -4.736
   66    HD3  ARG  15           1HD      ARG  15  -3.131 -10.526  -4.262
   67    HE   ARG  15           HE       ARG  15  -1.107  -8.780  -5.493
   68   HH11  ARG  15          1HH1      ARG  15  -4.538  -9.605  -4.996
   69   HH12  ARG  15          2HH1      ARG  15  -5.116  -8.398  -6.041
   70   HH21  ARG  15          1HH2      ARG  15  -1.926  -7.133  -6.933
   71   HH22  ARG  15          2HH2      ARG  15  -3.601  -6.940  -7.146
   72    H    CYS  16           H        CYS  16   1.496  -6.249  -1.506
   73    HA   CYS  16           HA       CYS  16   4.170  -6.823  -2.266
   74    HB2  CYS  16           2HB      CYS  16   3.257  -4.875  -0.134
   75    HB3  CYS  16           1HB      CYS  16   4.745  -4.808  -1.063
   76    H    GLY  17           H        GLY  17   5.945  -7.548  -0.934
   77    HA2  GLY  17           2HA      GLY  17   6.972  -7.951   1.151
   78    HA3  GLY  17           1HA      GLY  17   5.388  -7.925   1.912
   79    H    ILE  18           H        ILE  18   4.248  -9.763  -0.084
   80    HA   ILE  18           HA       ILE  18   5.048 -12.273   1.029
   81    HB   ILE  18           HB       ILE  18   3.535 -11.799  -1.579
   82   HG12  ILE  18          2HG1      ILE  18   2.504 -12.003   1.265
   83   HG13  ILE  18          1HG1      ILE  18   2.422 -10.614   0.212
   84   HG21  ILE  18          1HG2      ILE  18   2.604 -14.042  -1.173
   85   HG22  ILE  18          2HG2      ILE  18   3.583 -14.183   0.283
   86   HG23  ILE  18          3HG2      ILE  18   4.367 -14.094  -1.292
   87   HD11  ILE  18          3HD1      ILE  18   0.259 -11.691   0.349
   88   HD12  ILE  18          1HD1      ILE  18   0.961 -13.206  -0.222
   89   HD13  ILE  18          2HD1      ILE  18   0.909 -11.810  -1.289
   90    H    SER  19           H        SER  19   5.393 -10.693  -2.045
   91    HA   SER  19           HA       SER  19   7.891 -12.094  -2.537
   92    HB2  SER  19           2HB      SER  19   6.170 -12.040  -4.385
   93    HB3  SER  19           1HB      SER  19   6.218 -10.280  -4.321
   94    HG   SER  19           HG       SER  19   8.435 -11.950  -4.872
   95    H    GLY  20           H        GLY  20   9.645 -10.935  -1.936
   96    HA2  GLY  20           2HA      GLY  20   9.225  -8.114  -1.222
   97    HA3  GLY  20           1HA      GLY  20  10.478  -9.156  -0.560
   98    H    SER  21           H        SER  21  10.305  -9.817  -3.737
   99    HA   SER  21           HA       SER  21  12.695  -8.290  -4.283
  100    HB2  SER  21           2HB      SER  21  11.218 -10.272  -6.014
  101    HB3  SER  21           1HB      SER  21  12.860  -9.669  -6.277
  102    HG   SER  21           HG       SER  21  12.122 -10.910  -3.857
  103    H    SER  22           H        SER  22   9.453  -7.705  -4.513
  104    HA   SER  22           HA       SER  22   9.411  -6.169  -6.905
  105    HB2  SER  22           2HB      SER  22   7.247  -5.397  -5.653
  106    HB3  SER  22           1HB      SER  22   7.351  -7.070  -6.210
  107    HG   SER  22           HG       SER  22   6.739  -7.203  -4.120
  108    H    ASN  23           H        ASN  23   9.365  -5.586  -3.432
  109    HA   ASN  23           HA       ASN  23  11.504  -3.832  -3.330
  110    HB2  ASN  23           2HB      ASN  23   9.748  -2.257  -4.338
  111    HB3  ASN  23           1HB      ASN  23   8.827  -2.473  -2.850
  112   HD21  ASN  23          1HD2      ASN  23  11.679  -1.117  -4.274
  113   HD22  ASN  23          2HD2      ASN  23  12.136  -0.134  -2.944
  114    H    THR  24           H        THR  24  11.917  -3.397  -1.038
  115    HA   THR  24           HA       THR  24  10.292  -5.199   0.607
  116    HB   THR  24           HB       THR  24  13.181  -4.416   1.005
  117    HG1  THR  24           1HG      THR  24  11.955  -6.307  -0.552
  118   HG21  THR  24          3HG2      THR  24  11.989  -5.008   3.100
  119   HG22  THR  24          1HG2      THR  24  13.213  -6.205   2.667
  120   HG23  THR  24          2HG2      THR  24  11.517  -6.541   2.355
  121    H    LEU  25           H        LEU  25  12.272  -2.201   1.074
  122    HA   LEU  25           HA       LEU  25  10.996  -1.898   3.656
  123    HB2  LEU  25           2HB      LEU  25  13.278  -0.378   2.422
  124    HB3  LEU  25           1HB      LEU  25  12.702  -0.204   4.073
  125    HG   LEU  25           HG       LEU  25  13.864  -2.744   2.922
  126   HD11  LEU  25          1HD1      LEU  25  15.808  -2.279   4.271
  127   HD12  LEU  25          2HD1      LEU  25  15.098  -0.771   4.818
  128   HD13  LEU  25          3HD1      LEU  25  15.536  -0.976   3.114
  129   HD21  LEU  25          3HD2      LEU  25  12.288  -3.205   4.718
  130   HD22  LEU  25          1HD2      LEU  25  13.077  -2.003   5.743
  131   HD23  LEU  25          2HD2      LEU  25  13.939  -3.461   5.280
  132    H    THR  26           H        THR  26  10.478  -0.733   0.598
  133    HA   THR  26           HA       THR  26   8.724   1.326   1.718
  134    HB   THR  26           HB       THR  26   9.129   2.577  -0.520
  135    HG1  THR  26           1HG      THR  26  10.603   0.574  -1.070
  136   HG21  THR  26          3HG2      THR  26   9.871   3.482   1.622
  137   HG22  THR  26          1HG2      THR  26  11.085   3.788   0.379
  138   HG23  THR  26          2HG2      THR  26  11.329   2.494   1.553
  139    H    THR  27           H        THR  27   8.076  -1.348   1.222
  140    HA   THR  27           HA       THR  27   7.243  -2.356  -1.097
  141    HB   THR  27           HB       THR  27   5.204  -3.064   0.450
  142    HG1  THR  27           1HG      THR  27   6.682  -2.991   2.611
  143   HG21  THR  27          3HG2      THR  27   8.051  -3.995   0.897
  144   HG22  THR  27          1HG2      THR  27   6.956  -4.584  -0.360
  145   HG23  THR  27          2HG2      THR  27   6.579  -4.879   1.331
  146    H    CYS  28           H        CYS  28   5.043  -0.652   1.005
  147    HA   CYS  28           HA       CYS  28   3.247  -0.243  -1.198
  148    HB2  CYS  28           2HB      CYS  28   2.864   0.123   1.739
  149    HB3  CYS  28           1HB      CYS  28   1.624   0.440   0.526
  150    H    ARG  29           H        ARG  29   5.687   1.472  -0.055
  151    HA   ARG  29           HA       ARG  29   4.330   4.050  -0.238
  152    HB2  ARG  29           2HB      ARG  29   5.859   3.616   1.688
  153    HB3  ARG  29           1HB      ARG  29   7.200   3.522   0.556
  154    HG2  ARG  29           2HG      ARG  29   6.854   5.841  -0.078
  155    HG3  ARG  29           1HG      ARG  29   5.455   5.936   0.981
  156    HD2  ARG  29           2HD      ARG  29   6.943   5.405   2.899
  157    HD3  ARG  29           1HD      ARG  29   8.328   5.517   1.807
  158    HE   ARG  29           HE       ARG  29   7.415   7.840   1.344
  159   HH11  ARG  29          1HH1      ARG  29   7.295   6.278   4.513
  160   HH12  ARG  29          2HH1      ARG  29   7.087   7.723   5.382
  161   HH21  ARG  29          1HH2      ARG  29   7.146   9.819   2.530
  162   HH22  ARG  29          2HH2      ARG  29   7.041   9.794   4.223
  163    H    ASN  30           H        ASN  30   6.062   2.027  -2.169
  164    HA   ASN  30           HA       ASN  30   7.149   4.233  -3.759
  165    HB2  ASN  30           2HB      ASN  30   8.572   2.700  -4.904
  166    HB3  ASN  30           1HB      ASN  30   8.581   2.166  -3.234
  167   HD21  ASN  30          1HD2      ASN  30   7.559   0.200  -2.727
  168   HD22  ASN  30          2HD2      ASN  30   7.126  -0.930  -3.957
  169    H    SER  31           H        SER  31   6.866   4.091  -6.182
  170    HA   SER  31           HA       SER  31   4.106   4.328  -6.651
  171    HB2  SER  31           2HB      SER  31   6.389   4.351  -8.606
  172    HB3  SER  31           1HB      SER  31   4.751   4.932  -8.901
  173    HG   SER  31           HG       SER  31   5.591   6.721  -8.252
  174    H    ARG  32           H        ARG  32   6.093   1.537  -6.904
  175    HA   ARG  32           HA       ARG  32   4.513   0.375  -8.986
  176    HB2  ARG  32           2HB      ARG  32   6.527  -0.899  -7.148
  177    HB3  ARG  32           1HB      ARG  32   5.728  -1.729  -8.476
  178    HG2  ARG  32           2HG      ARG  32   7.584   0.633  -8.710
  179    HG3  ARG  32           1HG      ARG  32   7.971  -1.044  -9.094
  180    HD2  ARG  32           2HD      ARG  32   5.954   0.721 -10.488
  181    HD3  ARG  32           1HD      ARG  32   7.499   0.165 -11.121
  182    HE   ARG  32           HE       ARG  32   5.404  -1.761 -10.414
  183   HH11  ARG  32          1HH1      ARG  32   7.430  -0.282 -12.918
  184   HH12  ARG  32          2HH1      ARG  32   7.116  -1.510 -14.052
  185   HH21  ARG  32          1HH2      ARG  32   4.943  -3.382 -12.011
  186   HH22  ARG  32          2HH2      ARG  32   5.692  -3.296 -13.537
  187    H    CYS  33           H        CYS  33   4.078   0.896  -5.725
  188    HA   CYS  33           HA       CYS  33   2.285  -1.334  -5.431
  189    HB2  CYS  33           2HB      CYS  33   3.579  -0.596  -3.465
  190    HB3  CYS  33           1HB      CYS  33   2.851   1.003  -3.588
  191    HA   PRO  34           HA       PRO  34  -0.859   1.041  -7.512
  192    HB2  PRO  34           2HB      PRO  34  -2.989  -0.460  -6.549
  193    HB3  PRO  34           1HB      PRO  34  -2.035  -0.888  -7.979
  194    HG2  PRO  34           2HG      PRO  34  -1.849  -1.873  -5.170
  195    HG3  PRO  34           1HG      PRO  34  -1.684  -2.781  -6.682
  196    HD2  PRO  34           2HD      PRO  34   0.436  -2.083  -5.224
  197    HD3  PRO  34           1HD      PRO  34   0.512  -2.065  -7.001
  198    H    CYS  35           H        CYS  35  -0.993   0.204  -4.162
  199    HA   CYS  35           HA       CYS  35  -3.149   1.767  -3.420
  200    HB2  CYS  35           2HB      CYS  35  -0.873   0.655  -1.859
  201    HB3  CYS  35           1HB      CYS  35  -2.088   1.660  -1.093
  202    H    TYR  36           H        TYR  36   0.264   2.539  -3.200
  203    HA   TYR  36           HA       TYR  36  -0.052   5.033  -1.955
  204    HB2  TYR  36           2HB      TYR  36   2.093   3.780  -2.127
  205    HB3  TYR  36           1HB      TYR  36   2.175   4.213  -3.830
  206    HD1  TYR  36           2HD      TYR  36   2.043   5.657  -0.426
  207    HD2  TYR  36           1HD      TYR  36   3.168   6.253  -4.479
  208    HE1  TYR  36           2HE      TYR  36   3.177   7.740   0.205
  209    HE2  TYR  36           1HE      TYR  36   4.309   8.340  -3.862
  210    HH   TYR  36           HH       TYR  36   4.225   9.988  -2.081
  211    H    LYS  37           H        LYS  37   0.226   4.206  -5.410
  212    HA   LYS  37           HA       LYS  37   0.104   6.871  -6.237
  213    HB2  LYS  37           2HB      LYS  37   0.308   4.203  -7.367
  214    HB3  LYS  37           1HB      LYS  37  -0.285   5.418  -8.462
  215    HG2  LYS  37           2HG      LYS  37   2.306   5.459  -6.884
  216    HG3  LYS  37           1HG      LYS  37   2.171   5.082  -8.605
  217    HD2  LYS  37           2HD      LYS  37   1.510   7.754  -7.316
  218    HD3  LYS  37           1HD      LYS  37   2.981   7.374  -8.196
  219    HE2  LYS  37           2HE      LYS  37   1.670   6.950 -10.220
  220    HE3  LYS  37           1HE      LYS  37   0.188   7.325  -9.341
  221    HZ1  LYS  37           3HZ      LYS  37   2.421   9.232  -9.830
  222    HZ2  LYS  37           1HZ      LYS  37   0.999   9.574  -9.010
  223    HZ3  LYS  37           2HZ      LYS  37   0.937   9.230 -10.644
  224    H    SER  38           H        SER  38  -2.346   4.446  -5.642
  225    HA   SER  38           HA       SER  38  -4.289   6.091  -7.098
  226    HB2  SER  38           2HB      SER  38  -4.764   3.359  -5.910
  227    HB3  SER  38           1HB      SER  38  -5.702   4.177  -7.163
  228    HG   SER  38           HG       SER  38  -3.167   3.054  -7.248
  229    H    TYR  39           H        TYR  39  -3.023   5.967  -4.142
  230    HA   TYR  39           HA       TYR  39  -3.516   6.806  -2.116
  231    HB2  TYR  39           2HB      TYR  39  -6.063   7.878  -3.353
  232    HB3  TYR  39           1HB      TYR  39  -5.240   8.509  -1.924
  233    HD1  TYR  39           2HD      TYR  39  -2.634   9.113  -2.458
  234    HD2  TYR  39           1HD      TYR  39  -5.799   9.068  -5.293
  235    HE1  TYR  39           2HE      TYR  39  -1.330  10.586  -3.932
  236    HE2  TYR  39           1HE      TYR  39  -4.503  10.524  -6.776
  237    HH   TYR  39           HH       TYR  39  -2.711  12.154  -6.576
  238    H    ASN  40           H        ASN  40  -4.102   4.222  -2.565
  239    HA   ASN  40           HA       ASN  40  -6.715   3.597  -1.384
  240    HB2  ASN  40           2HB      ASN  40  -4.591   1.638  -2.294
  241    HB3  ASN  40           1HB      ASN  40  -6.251   1.313  -1.911
  242   HD21  ASN  40          1HD2      ASN  40  -7.484   3.406  -3.321
  243   HD22  ASN  40          2HD2      ASN  40  -7.308   3.105  -4.996
  244    H    SER  41           H        SER  41  -6.830   2.350   0.511
  245    HA   SER  41           HA       SER  41  -4.539   2.566   2.233
  246    HB2  SER  41           2HB      SER  41  -6.405   1.977   3.897
  247    HB3  SER  41           1HB      SER  41  -6.465   3.570   3.129
  248    HG   SER  41           HG       SER  41  -8.299   1.698   3.128
  249    H    CYS  42           H        CYS  42  -3.873   0.680   3.385
  250    HA   CYS  42           HA       CYS  42  -4.192  -1.706   1.790
  251    HB2  CYS  42           2HB      CYS  42  -2.219  -0.949   3.913
  252    HB3  CYS  42           1HB      CYS  42  -2.334  -2.595   3.288
  253    H    ALA  43           H        ALA  43  -6.310  -0.860   3.611
  254    HA   ALA  43           HA       ALA  43  -6.414  -2.958   5.589
  255    HB1  ALA  43           1HB      ALA  43  -8.678  -2.123   6.043
  256    HB2  ALA  43           2HB      ALA  43  -8.548  -1.028   4.669
  257    HB3  ALA  43           3HB      ALA  43  -7.496  -0.818   6.072
  258    H    GLY  44           H        GLY  44  -6.617  -4.919   4.825
  259    HA2  GLY  44           2HA      GLY  44  -8.084  -6.594   3.931
  260    HA3  GLY  44           1HA      GLY  44  -8.623  -5.411   2.739
  261    H    CYS  45           H        CYS  45  -5.482  -4.814   2.916
  262    HA   CYS  45           HA       CYS  45  -4.888  -6.310   0.515
  263    HB2  CYS  45           2HB      CYS  45  -3.148  -4.469   2.175
  264    HB3  CYS  45           1HB      CYS  45  -2.633  -5.229   0.680
  265    H    HIS  46           H        HIS  46  -3.010  -7.707   0.339
  266    HA   HIS  46           HA       HIS  46  -2.649  -9.204   2.825
  267    HB2  HIS  46           2HB      HIS  46  -2.751 -10.129  -0.020
  268    HB3  HIS  46           1HB      HIS  46  -1.867 -11.075   1.173
  269    HD1  HIS  46           1HD      HIS  46  -3.219 -12.790   2.300
  270    HD2  HIS  46           2HD      HIS  46  -5.566  -9.629   0.987
  271    HE1  HIS  46           1HE      HIS  46  -5.564 -13.405   2.889
  272    HE2  HIS  46           2HE      HIS  46  -6.975 -11.586   1.946
  273    H    CYS  47           H        CYS  47  -1.237  -6.890   1.742
  274    HA   CYS  47           HA       CYS  47   1.397  -7.781   1.236
  275    HB2  CYS  47           2HB      CYS  47   1.982  -5.375   1.737
  276    HB3  CYS  47           1HB      CYS  47   0.943  -5.660   0.356
  277    H    VAL  48           H        VAL  48   2.966  -8.104   2.520
  278    HA   VAL  48           HA       VAL  48   2.399  -8.160   5.404
  279    HB   VAL  48           HB       VAL  48   4.550  -9.692   3.902
  280   HG11  VAL  48          1HG1      VAL  48   5.121  -9.307   6.236
  281   HG12  VAL  48          2HG1      VAL  48   4.765 -11.011   5.957
  282   HG13  VAL  48          3HG1      VAL  48   3.571  -9.979   6.742
  283   HG21  VAL  48          3HG2      VAL  48   2.335 -10.471   3.237
  284   HG22  VAL  48          1HG2      VAL  48   1.885 -10.677   4.929
  285   HG23  VAL  48          2HG2      VAL  48   3.148 -11.684   4.225
  286    H    GLY  49           H        GLY  49   3.290  -6.633   6.540
  287    HA2  GLY  49           2HA      GLY  49   4.786  -5.086   7.316
  288    HA3  GLY  49           1HA      GLY  49   6.022  -5.919   6.378
  289    H    CYS  50           H        CYS  50   3.078  -4.138   5.521
  290    HA   CYS  50           HA       CYS  50   4.552  -2.918   3.367
  291    HB2  CYS  50           2HB      CYS  50   2.542  -2.108   2.546
  292    HB3  CYS  50           1HB      CYS  50   2.121  -3.695   3.178
  293    H    LYS  51           H        LYS  51   5.347  -0.932   3.389
  294    HA   LYS  51           HA       LYS  51   4.702   0.747   5.712
  295    HB2  LYS  51           2HB      LYS  51   6.826   1.079   3.571
  296    HB3  LYS  51           1HB      LYS  51   6.574   2.171   4.918
  297    HG2  LYS  51           2HG      LYS  51   7.371  -0.721   5.175
  298    HG3  LYS  51           1HG      LYS  51   8.491   0.634   5.223
  299    HD2  LYS  51           2HD      LYS  51   7.187   1.522   7.171
  300    HD3  LYS  51           1HD      LYS  51   6.256   0.025   7.160
  301    HE2  LYS  51           2HE      LYS  51   8.016  -0.139   8.808
  302    HE3  LYS  51           1HE      LYS  51   8.358  -1.245   7.478
  303    HZ1  LYS  51           3HZ      LYS  51   9.626   1.404   7.961
  304    HZ2  LYS  51           1HZ      LYS  51   9.923   0.463   6.598
  305    HZ3  LYS  51           2HZ      LYS  51  10.350  -0.104   8.113
  306    H    ASN  52           H        ASN  52   2.659   1.430   5.071
  307    HA   ASN  52           HA       ASN  52   2.595   3.022   2.616
  308    HB2  ASN  52           2HB      ASN  52   0.953   1.083   2.834
  309    HB3  ASN  52           1HB      ASN  52   0.198   1.971   4.146
  310   HD21  ASN  52          1HD2      ASN  52  -1.027   1.188   1.718
  311   HD22  ASN  52          2HD2      ASN  52  -1.527   2.623   0.905
  312    HA   PRO  53           HA       PRO  53   2.518   6.472   5.573
  313    HB2  PRO  53           2HB      PRO  53   1.854   7.871   3.025
  314    HB3  PRO  53           1HB      PRO  53   3.056   8.296   4.252
  315    HG2  PRO  53           2HG      PRO  53   3.869   7.246   1.982
  316    HG3  PRO  53           1HG      PRO  53   4.569   6.689   3.509
  317    HD2  PRO  53           2HD      PRO  53   2.493   5.359   1.806
  318    HD3  PRO  53           1HD      PRO  53   3.899   4.652   2.634
  319    H    HIS  54           H        HIS  54   0.127   5.536   3.229
  320    HA   HIS  54           HA       HIS  54  -1.947   7.285   4.248
  321    HB2  HIS  54           2HB      HIS  54  -2.072   5.005   2.255
  322    HB3  HIS  54           1HB      HIS  54  -3.438   6.014   2.675
  323    HD1  HIS  54           1HD      HIS  54  -3.585   8.304   1.526
  324    HD2  HIS  54           2HD      HIS  54  -0.093   6.236   0.655
  325    HE1  HIS  54           1HE      HIS  54  -2.551   9.513  -0.409
  326    HE2  HIS  54           2HE      HIS  54  -0.322   8.441  -0.688
  327    H    LYS  55           H        LYS  55  -3.717   6.599   5.435
  328    HA   LYS  55           HA       LYS  55  -3.536   3.913   6.577
  329    HB2  LYS  55           2HB      LYS  55  -2.791   5.637   8.208
  330    HB3  LYS  55           1HB      LYS  55  -4.329   6.466   8.005
  331    HG2  LYS  55           2HG      LYS  55  -5.499   4.490   8.885
  332    HG3  LYS  55           1HG      LYS  55  -3.955   3.683   9.114
  333    HD2  LYS  55           2HD      LYS  55  -4.723   4.600  11.216
  334    HD3  LYS  55           1HD      LYS  55  -3.291   5.471  10.673
  335    HE2  LYS  55           2HE      LYS  55  -4.638   7.317   9.910
  336    HE3  LYS  55           1HE      LYS  55  -6.122   6.433  10.249
  337    HZ1  LYS  55           3HZ      LYS  55  -5.613   6.507  12.580
  338    HZ2  LYS  55           1HZ      LYS  55  -5.578   8.070  11.959
  339    HZ3  LYS  55           2HZ      LYS  55  -4.136   7.259  12.302
  340    H    GLU  56           H        GLU  56  -5.521   2.942   6.949
  341    HA   GLU  56           HA       GLU  56  -7.667   3.621   5.264
  342    HB2  GLU  56           2HB      GLU  56  -7.201   1.344   6.020
  343    HB3  GLU  56           1HB      GLU  56  -7.557   1.810   7.677
  344    HG2  GLU  56           2HG      GLU  56  -9.396   0.572   6.650
  345    HG3  GLU  56           1HG      GLU  56  -9.872   2.210   7.089
  346    H    ASP  57           H        ASP  57  -9.495   4.792   5.643
  347    HA   ASP  57           HA       ASP  57 -10.111   5.694   8.313
  348    HB2  ASP  57           2HB      ASP  57  -8.511   7.398   7.250
  349    HB3  ASP  57           1HB      ASP  57  -9.794   7.723   6.088
  350    H    TYR  58           H        TYR  58 -12.251   6.211   8.521
  351    HA   TYR  58           HA       TYR  58 -13.911   4.628   6.961
  352    HB2  TYR  58           2HB      TYR  58 -15.751   5.346   8.347
  353    HB3  TYR  58           1HB      TYR  58 -14.323   5.121   9.341
  354    HD1  TYR  58           1HD      TYR  58 -12.952   7.379   9.831
  355    HD2  TYR  58           2HD      TYR  58 -17.032   7.221   8.624
  356    HE1  TYR  58           1HE      TYR  58 -13.314   9.626  10.757
  357    HE2  TYR  58           2HE      TYR  58 -17.395   9.457   9.540
  358    HH   TYR  58           HH       TYR  58 -14.865  11.507  10.426
  359    H    VAL  59           H        VAL  59 -14.447   4.923   4.952
  360    HA   VAL  59           HA       VAL  59 -15.668   7.471   4.192
  361    HB   VAL  59           HB       VAL  59 -14.288   5.467   2.341
  362   HG11  VAL  59          1HG1      VAL  59 -16.199   6.556   1.281
  363   HG12  VAL  59          2HG1      VAL  59 -14.681   7.097   0.568
  364   HG13  VAL  59          3HG1      VAL  59 -15.540   8.137   1.704
  365   HG21  VAL  59          3HG2      VAL  59 -13.449   8.267   3.074
  366   HG22  VAL  59          1HG2      VAL  59 -12.630   7.206   1.932
  367   HG23  VAL  59          2HG2      VAL  59 -12.677   6.791   3.650
  Start of MODEL   12
    1    H1   SER   8           1HT      SER   8 -21.488  -2.176  -5.888
    2    H2   SER   8           2HT      SER   8 -20.048  -3.075  -5.767
    3    H3   SER   8           3HT      SER   8 -20.398  -2.249  -7.185
    4    HA   SER   8           HA       SER   8 -20.150  -0.178  -6.110
    5    HB2  SER   8           2HB      SER   8 -20.968  -0.994  -3.859
    6    HB3  SER   8           1HB      SER   8 -19.447  -1.854  -3.658
    7    HG   SER   8           HG       SER   8 -18.690  -0.108  -2.888
    8    HA   PRO   9           HA       PRO   9 -16.166  -0.841  -7.846
    9    HB2  PRO   9           2HB      PRO   9 -14.973   1.528  -7.094
   10    HB3  PRO   9           1HB      PRO   9 -16.039   1.350  -8.488
   11    HG2  PRO   9           2HG      PRO   9 -16.654   2.358  -5.744
   12    HG3  PRO   9           1HG      PRO   9 -17.222   2.963  -7.311
   13    HD2  PRO   9           2HD      PRO   9 -18.778   1.457  -5.739
   14    HD3  PRO   9           1HD      PRO   9 -18.830   1.307  -7.508
   15    HA   PRO  10           HA       PRO  10 -14.030  -2.372  -4.163
   16    HB2  PRO  10           2HB      PRO  10 -12.292  -3.565  -6.227
   17    HB3  PRO  10           1HB      PRO  10 -13.164  -4.353  -4.912
   18    HG2  PRO  10           2HG      PRO  10 -13.976  -4.641  -7.426
   19    HG3  PRO  10           1HG      PRO  10 -15.152  -4.447  -6.113
   20    HD2  PRO  10           2HD      PRO  10 -14.166  -2.400  -8.072
   21    HD3  PRO  10           1HD      PRO  10 -15.822  -2.749  -7.520
   22    H    LYS  11           H        LYS  11 -12.304  -1.638  -3.135
   23    HA   LYS  11           HA       LYS  11 -10.738   0.480  -4.236
   24    HB2  LYS  11           2HB      LYS  11  -9.650   0.498  -2.015
   25    HB3  LYS  11           1HB      LYS  11 -11.402   0.512  -1.868
   26    HG2  LYS  11           2HG      LYS  11 -11.390  -1.876  -1.358
   27    HG3  LYS  11           1HG      LYS  11  -9.650  -1.919  -1.573
   28    HD2  LYS  11           2HD      LYS  11 -11.035  -0.242   0.523
   29    HD3  LYS  11           1HD      LYS  11 -10.454  -1.876   0.819
   30    HE2  LYS  11           2HE      LYS  11  -8.720  -0.567   1.629
   31    HE3  LYS  11           1HE      LYS  11  -8.176  -0.946   0.009
   32    HZ1  LYS  11           3HZ      LYS  11  -9.435   1.599   0.878
   33    HZ2  LYS  11           1HZ      LYS  11  -8.886   1.321  -0.703
   34    HZ3  LYS  11           2HZ      LYS  11  -7.831   1.352   0.614
   35    HA   PRO  12           HA       PRO  12  -7.236  -1.890  -5.775
   36    HB2  PRO  12           2HB      PRO  12  -5.572   0.122  -4.458
   37    HB3  PRO  12           1HB      PRO  12  -5.568  -0.335  -6.144
   38    HG2  PRO  12           2HG      PRO  12  -6.633   2.006  -5.354
   39    HG3  PRO  12           1HG      PRO  12  -7.278   1.082  -6.720
   40    HD2  PRO  12           2HD      PRO  12  -8.370   1.454  -3.997
   41    HD3  PRO  12           1HD      PRO  12  -9.213   1.143  -5.530
   42    H    LYS  13           H        LYS  13  -5.981  -3.394  -4.931
   43    HA   LYS  13           HA       LYS  13  -5.273  -3.389  -2.091
   44    HB2  LYS  13           2HB      LYS  13  -6.641  -5.709  -3.508
   45    HB3  LYS  13           1HB      LYS  13  -6.007  -5.744  -1.864
   46    HG2  LYS  13           2HG      LYS  13  -7.603  -4.058  -1.178
   47    HG3  LYS  13           1HG      LYS  13  -8.201  -3.930  -2.828
   48    HD2  LYS  13           2HD      LYS  13  -8.980  -6.251  -2.716
   49    HD3  LYS  13           1HD      LYS  13  -8.374  -6.369  -1.060
   50    HE2  LYS  13           2HE      LYS  13  -9.823  -4.509  -0.404
   51    HE3  LYS  13           1HE      LYS  13 -10.461  -4.431  -2.038
   52    HZ1  LYS  13           3HZ      LYS  13 -11.879  -5.609  -0.464
   53    HZ2  LYS  13           1HZ      LYS  13 -10.714  -6.787  -0.250
   54    HZ3  LYS  13           2HZ      LYS  13 -11.465  -6.590  -1.762
   55    H    CYS  14           H        CYS  14  -3.470  -4.850  -1.642
   56    HA   CYS  14           HA       CYS  14  -2.011  -5.575  -4.050
   57    HB2  CYS  14           2HB      CYS  14   0.021  -4.488  -3.219
   58    HB3  CYS  14           1HB      CYS  14  -1.282  -3.339  -3.512
   59    H    ARG  15           H        ARG  15  -0.257  -6.973  -3.685
   60    HA   ARG  15           HA       ARG  15  -0.410  -8.556  -1.201
   61    HB2  ARG  15           2HB      ARG  15   0.212  -9.444  -4.033
   62    HB3  ARG  15           1HB      ARG  15   0.170 -10.491  -2.624
   63    HG2  ARG  15           2HG      ARG  15  -2.203 -10.101  -2.353
   64    HG3  ARG  15           1HG      ARG  15  -2.183  -8.941  -3.674
   65    HD2  ARG  15           2HD      ARG  15  -1.554 -10.699  -5.226
   66    HD3  ARG  15           1HD      ARG  15  -1.532 -11.872  -3.904
   67    HE   ARG  15           HE       ARG  15  -4.013 -10.672  -3.859
   68   HH11  ARG  15          1HH1      ARG  15  -2.194 -12.618  -6.183
   69   HH12  ARG  15          2HH1      ARG  15  -3.563 -13.404  -6.813
   70   HH21  ARG  15          1HH2      ARG  15  -5.907 -11.743  -4.730
   71   HH22  ARG  15          2HH2      ARG  15  -5.731 -12.870  -5.985
   72    H    CYS  16           H        CYS  16   1.224  -6.310  -1.517
   73    HA   CYS  16           HA       CYS  16   3.867  -6.836  -2.447
   74    HB2  CYS  16           2HB      CYS  16   2.999  -4.818  -0.359
   75    HB3  CYS  16           1HB      CYS  16   4.499  -4.807  -1.278
   76    H    GLY  17           H        GLY  17   5.796  -7.050  -1.092
   77    HA2  GLY  17           2HA      GLY  17   6.743  -7.201   1.141
   78    HA3  GLY  17           1HA      GLY  17   5.259  -7.983   1.656
   79    H    ILE  18           H        ILE  18   5.378  -9.478  -0.958
   80    HA   ILE  18           HA       ILE  18   6.651 -11.809   0.082
   81    HB   ILE  18           HB       ILE  18   5.738 -11.338  -2.788
   82   HG12  ILE  18          2HG1      ILE  18   4.167 -12.343  -0.381
   83   HG13  ILE  18          1HG1      ILE  18   3.927 -10.840  -1.239
   84   HG21  ILE  18          1HG2      ILE  18   6.110 -13.899  -1.218
   85   HG22  ILE  18          2HG2      ILE  18   7.154 -13.321  -2.517
   86   HG23  ILE  18          3HG2      ILE  18   5.487 -13.782  -2.865
   87   HD11  ILE  18          3HD1      ILE  18   3.236 -12.058  -3.240
   88   HD12  ILE  18          1HD1      ILE  18   2.230 -12.460  -1.847
   89   HD13  ILE  18          2HD1      ILE  18   3.474 -13.585  -2.394
   90    H    SER  19           H        SER  19   7.575  -9.246  -2.051
   91    HA   SER  19           HA       SER  19  10.270 -10.370  -2.185
   92    HB2  SER  19           2HB      SER  19   9.019  -8.284  -3.982
   93    HB3  SER  19           1HB      SER  19  10.580  -9.087  -4.185
   94    HG   SER  19           HG       SER  19   9.018 -11.035  -4.022
   95    H    GLY  20           H        GLY  20  10.905  -9.530  -0.196
   96    HA2  GLY  20           2HA      GLY  20  10.792  -6.602   0.008
   97    HA3  GLY  20           1HA      GLY  20  10.463  -7.649   1.377
   98    H    SER  21           H        SER  21  12.968  -8.086  -1.054
   99    HA   SER  21           HA       SER  21  14.986  -8.595   0.827
  100    HB2  SER  21           2HB      SER  21  15.280  -7.703  -2.049
  101    HB3  SER  21           1HB      SER  21  16.417  -8.678  -1.113
  102    HG   SER  21           HG       SER  21  15.073 -10.368  -1.187
  103    H    SER  22           H        SER  22  14.743  -5.895  -1.495
  104    HA   SER  22           HA       SER  22  16.104  -4.175   0.447
  105    HB2  SER  22           2HB      SER  22  17.091  -4.412  -1.863
  106    HB3  SER  22           1HB      SER  22  15.607  -3.736  -2.521
  107    HG   SER  22           HG       SER  22  17.193  -2.401  -0.603
  108    H    ASN  23           H        ASN  23  13.173  -4.947  -0.960
  109    HA   ASN  23           HA       ASN  23  11.901  -2.367  -0.523
  110    HB2  ASN  23           2HB      ASN  23  11.483  -3.522  -2.654
  111    HB3  ASN  23           1HB      ASN  23  10.992  -4.967  -1.797
  112   HD21  ASN  23          1HD2      ASN  23   8.935  -5.220  -1.304
  113   HD22  ASN  23          2HD2      ASN  23   7.688  -4.064  -1.633
  114    H    THR  24           H        THR  24  12.503  -2.821   1.807
  115    HA   THR  24           HA       THR  24  10.660  -4.678   3.166
  116    HB   THR  24           HB       THR  24  12.977  -3.263   4.469
  117    HG1  THR  24           1HG      THR  24  13.096  -5.693   2.934
  118   HG21  THR  24          3HG2      THR  24  11.704  -5.983   4.890
  119   HG22  THR  24          1HG2      THR  24  11.425  -4.557   5.892
  120   HG23  THR  24          2HG2      THR  24  13.020  -5.307   5.844
  121    H    LEU  25           H        LEU  25  11.712  -1.333   3.063
  122    HA   LEU  25           HA       LEU  25   9.588  -0.548   4.938
  123    HB2  LEU  25           2HB      LEU  25  12.045   0.944   4.009
  124    HB3  LEU  25           1HB      LEU  25  10.748   1.710   4.882
  125    HG   LEU  25           HG       LEU  25  11.235   0.141   6.792
  126   HD11  LEU  25          1HD1      LEU  25  12.434  -1.595   5.601
  127   HD12  LEU  25          2HD1      LEU  25  13.421  -0.916   6.894
  128   HD13  LEU  25          3HD1      LEU  25  13.733  -0.467   5.221
  129   HD21  LEU  25          3HD2      LEU  25  13.186   1.424   7.531
  130   HD22  LEU  25          1HD2      LEU  25  11.938   2.437   6.804
  131   HD23  LEU  25          2HD2      LEU  25  13.387   2.029   5.889
  132    H    THR  26           H        THR  26  10.940  -0.082   1.747
  133    HA   THR  26           HA       THR  26   9.164   1.987   0.974
  134    HB   THR  26           HB       THR  26  10.384   1.366  -1.235
  135    HG1  THR  26           1HG      THR  26  12.017  -0.019  -1.016
  136   HG21  THR  26          3HG2      THR  26  12.377   2.614  -0.488
  137   HG22  THR  26          1HG2      THR  26  11.924   2.341   1.192
  138   HG23  THR  26          2HG2      THR  26  10.914   3.351   0.161
  139    H    THR  27           H        THR  27   8.451  -1.070   1.596
  140    HA   THR  27           HA       THR  27   7.772  -2.538  -0.572
  141    HB   THR  27           HB       THR  27   6.228  -2.379   2.000
  142    HG1  THR  27           1HG      THR  27   8.624  -3.847   1.584
  143   HG21  THR  27          3HG2      THR  27   6.994  -4.687   0.197
  144   HG22  THR  27          1HG2      THR  27   5.382  -3.988   0.361
  145   HG23  THR  27          2HG2      THR  27   6.121  -4.828   1.727
  146    H    CYS  28           H        CYS  28   5.298  -0.831   1.348
  147    HA   CYS  28           HA       CYS  28   3.671  -0.660  -1.017
  148    HB2  CYS  28           2HB      CYS  28   3.043  -0.334   1.883
  149    HB3  CYS  28           1HB      CYS  28   1.899   0.198   0.653
  150    H    ARG  29           H        ARG  29   5.961   1.121   0.178
  151    HA   ARG  29           HA       ARG  29   4.640   3.724   0.012
  152    HB2  ARG  29           2HB      ARG  29   6.087   2.992   1.958
  153    HB3  ARG  29           1HB      ARG  29   7.454   3.111   0.867
  154    HG2  ARG  29           2HG      ARG  29   7.009   5.472   0.542
  155    HG3  ARG  29           1HG      ARG  29   5.616   5.367   1.620
  156    HD2  ARG  29           2HD      ARG  29   7.138   4.598   3.413
  157    HD3  ARG  29           1HD      ARG  29   8.497   4.865   2.322
  158    HE   ARG  29           HE       ARG  29   6.886   7.157   2.494
  159   HH11  ARG  29          1HH1      ARG  29   9.387   5.363   4.232
  160   HH12  ARG  29          2HH1      ARG  29   9.883   6.677   5.185
  161   HH21  ARG  29          1HH2      ARG  29   7.543   8.971   3.823
  162   HH22  ARG  29          2HH2      ARG  29   8.811   8.782   4.933
  163    H    ASN  30           H        ASN  30   5.446   2.012  -2.363
  164    HA   ASN  30           HA       ASN  30   6.916   4.154  -3.682
  165    HB2  ASN  30           2HB      ASN  30   8.300   2.678  -4.958
  166    HB3  ASN  30           1HB      ASN  30   8.428   2.136  -3.292
  167   HD21  ASN  30          1HD2      ASN  30   7.573   0.120  -2.742
  168   HD22  ASN  30          2HD2      ASN  30   7.063  -1.008  -3.931
  169    H    SER  31           H        SER  31   6.637   3.993  -6.108
  170    HA   SER  31           HA       SER  31   3.858   4.262  -6.502
  171    HB2  SER  31           2HB      SER  31   6.097   4.429  -8.503
  172    HB3  SER  31           1HB      SER  31   4.449   5.024  -8.730
  173    HG   SER  31           HG       SER  31   6.438   5.936  -6.942
  174    H    ARG  32           H        ARG  32   5.721   1.437  -6.773
  175    HA   ARG  32           HA       ARG  32   4.110   0.350  -8.911
  176    HB2  ARG  32           2HB      ARG  32   6.328  -0.837  -7.250
  177    HB3  ARG  32           1HB      ARG  32   5.411  -1.767  -8.427
  178    HG2  ARG  32           2HG      ARG  32   6.890   0.747  -9.165
  179    HG3  ARG  32           1HG      ARG  32   7.658  -0.839  -9.175
  180    HD2  ARG  32           2HD      ARG  32   6.902  -0.265 -11.409
  181    HD3  ARG  32           1HD      ARG  32   5.985  -1.631 -10.794
  182    HE   ARG  32           HE       ARG  32   4.887   1.095 -10.681
  183   HH11  ARG  32          1HH1      ARG  32   4.675  -2.222 -11.935
  184   HH12  ARG  32          2HH1      ARG  32   3.120  -2.027 -12.592
  185   HH21  ARG  32          1HH2      ARG  32   2.724   1.334 -11.561
  186   HH22  ARG  32          2HH2      ARG  32   1.950   0.047 -12.342
  187    H    CYS  33           H        CYS  33   3.588   0.941  -5.773
  188    HA   CYS  33           HA       CYS  33   1.983  -1.426  -5.317
  189    HB2  CYS  33           2HB      CYS  33   3.302  -0.556  -3.425
  190    HB3  CYS  33           1HB      CYS  33   2.509   1.003  -3.586
  191    HA   PRO  34           HA       PRO  34  -1.296   0.768  -7.461
  192    HB2  PRO  34           2HB      PRO  34  -3.357  -0.889  -6.576
  193    HB3  PRO  34           1HB      PRO  34  -2.368  -1.179  -8.008
  194    HG2  PRO  34           2HG      PRO  34  -2.124  -2.322  -5.269
  195    HG3  PRO  34           1HG      PRO  34  -1.857  -3.100  -6.840
  196    HD2  PRO  34           2HD      PRO  34   0.184  -2.334  -5.286
  197    HD3  PRO  34           1HD      PRO  34   0.286  -2.209  -7.055
  198    H    CYS  35           H        CYS  35  -1.545  -0.140  -4.114
  199    HA   CYS  35           HA       CYS  35  -3.713   1.507  -3.379
  200    HB2  CYS  35           2HB      CYS  35  -1.389   0.449  -1.812
  201    HB3  CYS  35           1HB      CYS  35  -2.724   1.315  -1.076
  202    H    TYR  36           H        TYR  36  -0.268   1.965  -3.137
  203    HA   TYR  36           HA       TYR  36  -0.243   4.513  -2.001
  204    HB2  TYR  36           2HB      TYR  36   1.681   2.927  -2.135
  205    HB3  TYR  36           1HB      TYR  36   1.824   3.314  -3.843
  206    HD1  TYR  36           1HD      TYR  36   2.105   4.671  -0.436
  207    HD2  TYR  36           2HD      TYR  36   2.972   5.294  -4.547
  208    HE1  TYR  36           1HE      TYR  36   3.598   6.522   0.163
  209    HE2  TYR  36           2HE      TYR  36   4.473   7.154  -3.947
  210    HH   TYR  36           HH       TYR  36   4.691   8.737  -2.066
  211    H    LYS  37           H        LYS  37  -0.146   3.518  -5.440
  212    HA   LYS  37           HA       LYS  37   0.109   6.198  -6.263
  213    HB2  LYS  37           2HB      LYS  37   0.345   3.616  -7.437
  214    HB3  LYS  37           1HB      LYS  37  -0.622   4.641  -8.472
  215    HG2  LYS  37           2HG      LYS  37   2.101   5.444  -7.411
  216    HG3  LYS  37           1HG      LYS  37   1.900   4.571  -8.920
  217    HD2  LYS  37           2HD      LYS  37   2.176   6.904  -9.440
  218    HD3  LYS  37           1HD      LYS  37   0.499   6.491  -9.752
  219    HE2  LYS  37           2HE      LYS  37  -0.149   7.516  -7.621
  220    HE3  LYS  37           1HE      LYS  37   1.551   7.880  -7.289
  221    HZ1  LYS  37           3HZ      LYS  37   1.520   9.347  -9.223
  222    HZ2  LYS  37           1HZ      LYS  37   0.349   9.778  -8.098
  223    HZ3  LYS  37           2HZ      LYS  37  -0.103   8.979  -9.497
  224    H    SER  38           H        SER  38  -2.614   3.964  -5.996
  225    HA   SER  38           HA       SER  38  -4.331   5.871  -7.328
  226    HB2  SER  38           2HB      SER  38  -4.925   3.172  -6.104
  227    HB3  SER  38           1HB      SER  38  -6.086   4.144  -7.007
  228    HG   SER  38           HG       SER  38  -5.108   3.682  -8.819
  229    H    TYR  39           H        TYR  39  -3.015   6.050  -4.520
  230    HA   TYR  39           HA       TYR  39  -3.413   7.072  -2.570
  231    HB2  TYR  39           2HB      TYR  39  -5.661   8.278  -4.184
  232    HB3  TYR  39           1HB      TYR  39  -5.350   8.755  -2.522
  233    HD1  TYR  39           1HD      TYR  39  -3.608   8.482  -5.841
  234    HD2  TYR  39           2HD      TYR  39  -3.898  10.518  -2.116
  235    HE1  TYR  39           1HE      TYR  39  -1.948  10.131  -6.615
  236    HE2  TYR  39           2HE      TYR  39  -2.244  12.157  -2.875
  237    HH   TYR  39           HH       TYR  39  -1.290  12.402  -6.116
  238    H    ASN  40           H        ASN  40  -4.013   4.589  -2.250
  239    HA   ASN  40           HA       ASN  40  -6.381   4.683  -0.534
  240    HB2  ASN  40           2HB      ASN  40  -5.634   2.480  -2.426
  241    HB3  ASN  40           1HB      ASN  40  -6.419   2.082  -0.910
  242   HD21  ASN  40          1HD2      ASN  40  -6.970   4.757  -3.167
  243   HD22  ASN  40          2HD2      ASN  40  -8.633   4.381  -3.431
  244    H    SER  41           H        SER  41  -6.342   3.336   1.257
  245    HA   SER  41           HA       SER  41  -3.696   2.843   2.307
  246    HB2  SER  41           2HB      SER  41  -5.368   2.335   4.357
  247    HB3  SER  41           1HB      SER  41  -4.807   3.962   3.949
  248    HG   SER  41           HG       SER  41  -6.653   4.328   2.824
  249    H    CYS  42           H        CYS  42  -3.420   0.798   3.597
  250    HA   CYS  42           HA       CYS  42  -4.253  -1.277   1.806
  251    HB2  CYS  42           2HB      CYS  42  -1.972  -1.190   3.759
  252    HB3  CYS  42           1HB      CYS  42  -2.437  -2.642   2.878
  253    H    ALA  43           H        ALA  43  -6.250  -1.117   2.696
  254    HA   ALA  43           HA       ALA  43  -6.596  -3.015   4.922
  255    HB1  ALA  43           1HB      ALA  43  -7.777  -0.876   5.270
  256    HB2  ALA  43           2HB      ALA  43  -8.923  -2.196   5.058
  257    HB3  ALA  43           3HB      ALA  43  -8.605  -1.086   3.729
  258    H    GLY  44           H        GLY  44  -7.176  -5.030   4.338
  259    HA2  GLY  44           2HA      GLY  44  -8.347  -6.650   3.117
  260    HA3  GLY  44           1HA      GLY  44  -8.728  -5.431   1.902
  261    H    CYS  45           H        CYS  45  -5.537  -5.485   2.919
  262    HA   CYS  45           HA       CYS  45  -4.740  -6.491   0.300
  263    HB2  CYS  45           2HB      CYS  45  -3.181  -4.960   2.376
  264    HB3  CYS  45           1HB      CYS  45  -2.560  -5.463   0.810
  265    H    HIS  46           H        HIS  46  -2.646  -7.718   0.289
  266    HA   HIS  46           HA       HIS  46  -2.414  -9.522   2.605
  267    HB2  HIS  46           2HB      HIS  46  -2.074 -10.040  -0.335
  268    HB3  HIS  46           1HB      HIS  46  -1.200 -11.018   0.830
  269    HD1  HIS  46           1HD      HIS  46  -2.399 -12.972   1.752
  270    HD2  HIS  46           2HD      HIS  46  -5.000 -10.261  -0.002
  271    HE1  HIS  46           1HE      HIS  46  -4.639 -14.084   1.767
  272    HE2  HIS  46           2HE      HIS  46  -6.143 -12.501   0.533
  273    H    CYS  47           H        CYS  47  -1.205  -6.897   1.952
  274    HA   CYS  47           HA       CYS  47   1.489  -7.405   1.270
  275    HB2  CYS  47           2HB      CYS  47   1.901  -5.036   1.888
  276    HB3  CYS  47           1HB      CYS  47   0.702  -5.321   0.635
  277    H    VAL  48           H        VAL  48   3.054  -7.889   2.309
  278    HA   VAL  48           HA       VAL  48   2.965  -8.127   5.233
  279    HB   VAL  48           HB       VAL  48   4.961  -9.332   3.278
  280   HG11  VAL  48          1HG1      VAL  48   4.511  -9.909   6.198
  281   HG12  VAL  48          2HG1      VAL  48   5.892  -9.062   5.502
  282   HG13  VAL  48          3HG1      VAL  48   5.631 -10.769   5.139
  283   HG21  VAL  48          3HG2      VAL  48   2.732 -10.269   2.920
  284   HG22  VAL  48          1HG2      VAL  48   2.602 -10.648   4.636
  285   HG23  VAL  48          2HG2      VAL  48   3.806 -11.467   3.644
  286    H    GLY  49           H        GLY  49   4.173  -6.772   6.443
  287    HA2  GLY  49           2HA      GLY  49   5.788  -5.250   7.045
  288    HA3  GLY  49           1HA      GLY  49   6.681  -5.716   5.603
  289    H    CYS  50           H        CYS  50   3.464  -4.384   5.895
  290    HA   CYS  50           HA       CYS  50   3.863  -2.616   3.711
  291    HB2  CYS  50           2HB      CYS  50   1.728  -3.569   3.896
  292    HB3  CYS  50           1HB      CYS  50   1.597  -3.135   5.594
  293    H    LYS  51           H        LYS  51   5.179  -0.868   4.085
  294    HA   LYS  51           HA       LYS  51   4.224   0.896   6.233
  295    HB2  LYS  51           2HB      LYS  51   6.733   1.090   4.522
  296    HB3  LYS  51           1HB      LYS  51   6.211   2.347   5.616
  297    HG2  LYS  51           2HG      LYS  51   8.021   1.122   6.597
  298    HG3  LYS  51           1HG      LYS  51   6.554   0.784   7.505
  299    HD2  LYS  51           2HD      LYS  51   6.321  -1.341   6.417
  300    HD3  LYS  51           1HD      LYS  51   7.682  -1.001   5.356
  301    HE2  LYS  51           2HE      LYS  51   9.169  -0.949   7.260
  302    HE3  LYS  51           1HE      LYS  51   7.824  -1.225   8.363
  303    HZ1  LYS  51           3HZ      LYS  51   9.037  -3.232   7.904
  304    HZ2  LYS  51           1HZ      LYS  51   8.732  -3.076   6.239
  305    HZ3  LYS  51           2HZ      LYS  51   7.449  -3.339   7.340
  306    H    ASN  52           H        ASN  52   2.382   1.490   5.238
  307    HA   ASN  52           HA       ASN  52   2.757   2.993   2.783
  308    HB2  ASN  52           2HB      ASN  52   1.205   1.085   2.541
  309    HB3  ASN  52           1HB      ASN  52   0.223   1.727   3.845
  310   HD21  ASN  52          1HD2      ASN  52  -1.513   1.756   2.458
  311   HD22  ASN  52          2HD2      ASN  52  -1.742   2.958   1.236
  312    HA   PRO  53           HA       PRO  53   1.991   6.352   5.635
  313    HB2  PRO  53           2HB      PRO  53   2.274   8.359   3.800
  314    HB3  PRO  53           1HB      PRO  53   3.642   7.567   4.590
  315    HG2  PRO  53           2HG      PRO  53   2.507   7.122   1.875
  316    HG3  PRO  53           1HG      PRO  53   4.203   7.141   2.396
  317    HD2  PRO  53           2HD      PRO  53   2.810   4.854   1.923
  318    HD3  PRO  53           1HD      PRO  53   4.132   4.942   3.102
  319    H    HIS  54           H        HIS  54   0.306   5.296   2.953
  320    HA   HIS  54           HA       HIS  54  -1.733   7.258   2.983
  321    HB2  HIS  54           2HB      HIS  54  -1.349   4.750   1.499
  322    HB3  HIS  54           1HB      HIS  54  -3.001   5.329   1.711
  323    HD1  HIS  54           1HD      HIS  54  -3.612   7.517   0.667
  324    HD2  HIS  54           2HD      HIS  54   0.217   6.213  -0.227
  325    HE1  HIS  54           1HE      HIS  54  -2.803   8.997  -1.230
  326    HE2  HIS  54           2HE      HIS  54  -0.403   8.309  -1.563
  327    H    LYS  55           H        LYS  55  -2.688   7.515   4.650
  328    HA   LYS  55           HA       LYS  55  -4.708   5.612   5.211
  329    HB2  LYS  55           2HB      LYS  55  -4.599   6.138   7.696
  330    HB3  LYS  55           1HB      LYS  55  -3.211   5.239   7.131
  331    HG2  LYS  55           2HG      LYS  55  -2.258   6.758   8.573
  332    HG3  LYS  55           1HG      LYS  55  -2.081   7.591   7.035
  333    HD2  LYS  55           2HD      LYS  55  -4.084   8.915   7.528
  334    HD3  LYS  55           1HD      LYS  55  -4.267   8.064   9.064
  335    HE2  LYS  55           2HE      LYS  55  -2.089   8.907   9.785
  336    HE3  LYS  55           1HE      LYS  55  -1.912   9.750   8.250
  337    HZ1  LYS  55           3HZ      LYS  55  -3.858  11.086   8.812
  338    HZ2  LYS  55           1HZ      LYS  55  -2.661  11.233   9.982
  339    HZ3  LYS  55           2HZ      LYS  55  -4.017  10.283  10.281
  340    H    GLU  56           H        GLU  56  -6.409   6.585   4.577
  341    HA   GLU  56           HA       GLU  56  -6.171   9.278   3.800
  342    HB2  GLU  56           2HB      GLU  56  -8.394   7.288   3.585
  343    HB3  GLU  56           1HB      GLU  56  -8.656   8.973   3.178
  344    HG2  GLU  56           2HG      GLU  56  -8.173   7.650   1.184
  345    HG3  GLU  56           1HG      GLU  56  -6.924   8.853   1.458
  346    H    ASP  57           H        ASP  57  -7.154  11.048   4.437
  347    HA   ASP  57           HA       ASP  57  -7.266  11.164   7.270
  348    HB2  ASP  57           2HB      ASP  57  -6.198  12.917   5.867
  349    HB3  ASP  57           1HB      ASP  57  -7.795  13.389   5.312
  350    H    TYR  58           H        TYR  58  -9.550  11.035   4.842
  351    HA   TYR  58           HA       TYR  58 -11.713  12.011   6.368
  352    HB2  TYR  58           2HB      TYR  58 -13.264  10.836   4.768
  353    HB3  TYR  58           1HB      TYR  58 -12.147  11.944   4.010
  354    HD1  TYR  58           2HD      TYR  58 -12.854   8.354   4.617
  355    HD2  TYR  58           1HD      TYR  58 -10.709  11.178   2.280
  356    HE1  TYR  58           2HE      TYR  58 -12.242   6.580   3.042
  357    HE2  TYR  58           1HE      TYR  58 -10.100   9.415   0.697
  358    HH   TYR  58           HH       TYR  58 -11.617   6.426   0.710
  359    H    VAL  59           H        VAL  59 -12.663  11.290   7.962
  360    HA   VAL  59           HA       VAL  59 -12.306   8.521   8.705
  361    HB   VAL  59           HB       VAL  59 -13.017   9.345  11.043
  362   HG11  VAL  59          1HG1      VAL  59 -10.458  10.397   9.830
  363   HG12  VAL  59          2HG1      VAL  59 -10.707   8.776  10.479
  364   HG13  VAL  59          3HG1      VAL  59 -10.761  10.172  11.552
  365   HG21  VAL  59          3HG2      VAL  59 -12.348  12.020   9.800
  366   HG22  VAL  59          1HG2      VAL  59 -12.640  11.722  11.512
  367   HG23  VAL  59          2HG2      VAL  59 -13.948  11.521  10.346
  Start of MODEL   13
    1    H1   SER   8           1HT      SER   8 -17.487   7.242  -8.079
    2    H2   SER   8           2HT      SER   8 -19.067   6.783  -7.591
    3    H3   SER   8           3HT      SER   8 -18.108   5.721  -8.493
    4    HA   SER   8           HA       SER   8 -17.530   6.678  -5.798
    5    HB2  SER   8           2HB      SER   8 -18.559   4.007  -6.754
    6    HB3  SER   8           1HB      SER   8 -18.323   4.518  -5.074
    7    HG   SER   8           HG       SER   8 -20.535   4.691  -6.102
    8    HA   PRO   9           HA       PRO   9 -13.606   4.908  -7.082
    9    HB2  PRO   9           2HB      PRO   9 -12.185   5.556  -4.854
   10    HB3  PRO   9           1HB      PRO   9 -12.613   6.720  -6.106
   11    HG2  PRO   9           2HG      PRO   9 -13.624   6.506  -3.380
   12    HG3  PRO   9           1HG      PRO   9 -13.812   7.830  -4.536
   13    HD2  PRO   9           2HD      PRO   9 -15.681   5.711  -3.836
   14    HD3  PRO   9           1HD      PRO   9 -15.955   7.183  -4.800
   15    HA   PRO  10           HA       PRO  10 -13.748   0.958  -4.785
   16    HB2  PRO  10           2HB      PRO  10 -12.069  -0.060  -6.940
   17    HB3  PRO  10           1HB      PRO  10 -13.722  -0.527  -6.531
   18    HG2  PRO  10           2HG      PRO  10 -13.087   0.829  -8.800
   19    HG3  PRO  10           1HG      PRO  10 -14.647   0.997  -7.978
   20    HD2  PRO  10           2HD      PRO  10 -12.253   2.795  -7.896
   21    HD3  PRO  10           1HD      PRO  10 -13.986   3.201  -8.009
   22    H    LYS  11           H        LYS  11 -12.037  -0.235  -3.706
   23    HA   LYS  11           HA       LYS  11  -9.521   1.263  -3.700
   24    HB2  LYS  11           2HB      LYS  11 -10.673  -0.430  -1.493
   25    HB3  LYS  11           1HB      LYS  11  -9.159   0.460  -1.414
   26    HG2  LYS  11           2HG      LYS  11 -10.466   2.559  -1.781
   27    HG3  LYS  11           1HG      LYS  11 -11.935   1.600  -1.634
   28    HD2  LYS  11           2HD      LYS  11 -11.481   2.654   0.490
   29    HD3  LYS  11           1HD      LYS  11 -11.197   0.922   0.640
   30    HE2  LYS  11           2HE      LYS  11  -8.819   1.231   0.504
   31    HE3  LYS  11           1HE      LYS  11  -9.018   2.945   0.130
   32    HZ1  LYS  11           3HZ      LYS  11  -9.916   3.286   2.321
   33    HZ2  LYS  11           1HZ      LYS  11  -8.418   2.556   2.463
   34    HZ3  LYS  11           2HZ      LYS  11  -9.824   1.657   2.693
   35    HA   PRO  12           HA       PRO  12  -7.906  -2.515  -5.411
   36    HB2  PRO  12           2HB      PRO  12  -5.413  -1.534  -5.908
   37    HB3  PRO  12           1HB      PRO  12  -6.786  -1.320  -6.992
   38    HG2  PRO  12           2HG      PRO  12  -5.531   0.601  -5.112
   39    HG3  PRO  12           1HG      PRO  12  -6.371   0.913  -6.640
   40    HD2  PRO  12           2HD      PRO  12  -7.429   1.282  -4.090
   41    HD3  PRO  12           1HD      PRO  12  -8.384   1.161  -5.577
   42    H    LYS  13           H        LYS  13  -6.177  -3.946  -4.894
   43    HA   LYS  13           HA       LYS  13  -5.117  -3.551  -2.199
   44    HB2  LYS  13           2HB      LYS  13  -6.462  -6.047  -3.239
   45    HB3  LYS  13           1HB      LYS  13  -5.638  -5.917  -1.688
   46    HG2  LYS  13           2HG      LYS  13  -7.223  -4.260  -0.938
   47    HG3  LYS  13           1HG      LYS  13  -8.000  -4.252  -2.517
   48    HD2  LYS  13           2HD      LYS  13  -8.650  -6.584  -2.201
   49    HD3  LYS  13           1HD      LYS  13  -7.865  -6.586  -0.617
   50    HE2  LYS  13           2HE      LYS  13 -10.273  -6.242  -0.410
   51    HE3  LYS  13           1HE      LYS  13  -9.384  -4.824   0.143
   52    HZ1  LYS  13           3HZ      LYS  13 -11.268  -4.189  -1.227
   53    HZ2  LYS  13           1HZ      LYS  13 -10.726  -5.151  -2.481
   54    HZ3  LYS  13           2HZ      LYS  13  -9.857  -3.778  -2.039
   55    H    CYS  14           H        CYS  14  -3.253  -4.836  -1.716
   56    HA   CYS  14           HA       CYS  14  -1.778  -5.573  -4.140
   57    HB2  CYS  14           2HB      CYS  14   0.190  -4.443  -3.252
   58    HB3  CYS  14           1HB      CYS  14  -1.157  -3.326  -3.470
   59    H    ARG  15           H        ARG  15   0.290  -6.645  -3.549
   60    HA   ARG  15           HA       ARG  15   0.040  -8.435  -1.225
   61    HB2  ARG  15           2HB      ARG  15   0.825  -9.113  -4.068
   62    HB3  ARG  15           1HB      ARG  15   0.918 -10.229  -2.707
   63    HG2  ARG  15           2HG      ARG  15  -1.454 -10.213  -2.441
   64    HG3  ARG  15           1HG      ARG  15  -1.627  -8.917  -3.624
   65    HD2  ARG  15           2HD      ARG  15  -0.823 -10.393  -5.370
   66    HD3  ARG  15           1HD      ARG  15  -0.585 -11.683  -4.188
   67    HE   ARG  15           HE       ARG  15  -3.082 -11.334  -3.778
   68   HH11  ARG  15          1HH1      ARG  15  -1.510 -11.186  -6.949
   69   HH12  ARG  15          2HH1      ARG  15  -2.906 -11.624  -7.816
   70   HH21  ARG  15          1HH2      ARG  15  -5.014 -11.948  -5.010
   71   HH22  ARG  15          2HH2      ARG  15  -4.911 -12.056  -6.696
   72    H    CYS  16           H        CYS  16   1.494  -5.946  -1.819
   73    HA   CYS  16           HA       CYS  16   4.169  -6.180  -2.467
   74    HB2  CYS  16           2HB      CYS  16   2.931  -4.332  -0.421
   75    HB3  CYS  16           1HB      CYS  16   4.524  -4.136  -1.136
   76    H    GLY  17           H        GLY  17   5.700  -7.307  -1.632
   77    HA2  GLY  17           2HA      GLY  17   7.053  -7.615   0.472
   78    HA3  GLY  17           1HA      GLY  17   5.528  -8.126   1.204
   79    H    ILE  18           H        ILE  18   4.476  -9.492  -0.962
   80    HA   ILE  18           HA       ILE  18   6.224 -11.834  -1.088
   81    HB   ILE  18           HB       ILE  18   3.295 -11.631  -1.909
   82   HG12  ILE  18          2HG1      ILE  18   4.466 -12.422   0.771
   83   HG13  ILE  18          1HG1      ILE  18   3.514 -10.997   0.429
   84   HG21  ILE  18          1HG2      ILE  18   4.481 -13.568  -2.813
   85   HG22  ILE  18          2HG2      ILE  18   3.314 -14.079  -1.592
   86   HG23  ILE  18          3HG2      ILE  18   5.029 -14.007  -1.193
   87   HD11  ILE  18          3HD1      ILE  18   2.178 -12.696   1.554
   88   HD12  ILE  18          1HD1      ILE  18   2.500 -13.827   0.241
   89   HD13  ILE  18          2HD1      ILE  18   1.560 -12.365  -0.062
   90    H    SER  19           H        SER  19   5.169  -9.155  -2.738
   91    HA   SER  19           HA       SER  19   4.639  -9.810  -5.336
   92    HB2  SER  19           2HB      SER  19   5.479  -7.353  -5.597
   93    HB3  SER  19           1HB      SER  19   4.024  -7.712  -4.650
   94    HG   SER  19           HG       SER  19   6.223  -6.483  -3.787
   95    H    GLY  20           H        GLY  20   7.809  -9.028  -3.884
   96    HA2  GLY  20           2HA      GLY  20   9.714 -10.215  -4.864
   97    HA3  GLY  20           1HA      GLY  20   9.024  -9.838  -6.443
   98    H    SER  21           H        SER  21   9.030  -7.663  -7.166
   99    HA   SER  21           HA       SER  21  11.312  -6.204  -6.256
  100    HB2  SER  21           2HB      SER  21   9.226  -5.493  -8.323
  101    HB3  SER  21           1HB      SER  21  10.745  -4.636  -8.076
  102    HG   SER  21           HG       SER  21  11.291  -7.205  -8.328
  103    H    SER  22           H        SER  22  10.777  -5.684  -4.161
  104    HA   SER  22           HA       SER  22   9.304  -3.237  -3.847
  105    HB2  SER  22           2HB      SER  22   8.590  -5.721  -2.233
  106    HB3  SER  22           1HB      SER  22   7.932  -4.103  -1.980
  107    HG   SER  22           HG       SER  22   7.646  -4.704  -4.504
  108    H    ASN  23           H        ASN  23  10.515  -2.020  -2.520
  109    HA   ASN  23           HA       ASN  23  12.835  -3.132  -1.311
  110    HB2  ASN  23           2HB      ASN  23  11.689  -0.366  -1.140
  111    HB3  ASN  23           1HB      ASN  23  13.141  -0.817  -0.268
  112   HD21  ASN  23          1HD2      ASN  23  14.969  -1.527  -1.533
  113   HD22  ASN  23          2HD2      ASN  23  15.176  -0.964  -3.142
  114    H    THR  24           H        THR  24  13.470  -2.844   0.954
  115    HA   THR  24           HA       THR  24  11.650  -4.294   2.514
  116    HB   THR  24           HB       THR  24  14.154  -2.873   3.435
  117    HG1  THR  24           1HG      THR  24  13.699  -5.106   1.794
  118   HG21  THR  24          3HG2      THR  24  14.317  -4.805   4.955
  119   HG22  THR  24          1HG2      THR  24  12.819  -5.457   4.295
  120   HG23  THR  24          2HG2      THR  24  12.800  -3.945   5.207
  121    H    LEU  25           H        LEU  25  12.693  -0.918   2.582
  122    HA   LEU  25           HA       LEU  25  10.744  -0.391   4.679
  123    HB2  LEU  25           2HB      LEU  25  11.586   1.864   4.842
  124    HB3  LEU  25           1HB      LEU  25  12.936   0.762   4.862
  125    HG   LEU  25           HG       LEU  25  12.103   2.438   2.476
  126   HD11  LEU  25          1HD1      LEU  25  14.300   2.851   4.467
  127   HD12  LEU  25          2HD1      LEU  25  12.843   3.832   4.299
  128   HD13  LEU  25          3HD1      LEU  25  14.048   3.801   3.008
  129   HD21  LEU  25          3HD2      LEU  25  14.416   1.927   1.687
  130   HD22  LEU  25          1HD2      LEU  25  13.351   0.522   1.717
  131   HD23  LEU  25          2HD2      LEU  25  14.550   0.748   2.988
  132    H    THR  26           H        THR  26  11.293   0.519   1.327
  133    HA   THR  26           HA       THR  26   8.840   2.014   1.188
  134    HB   THR  26           HB       THR  26  10.633   1.300  -1.131
  135    HG1  THR  26           1HG      THR  26  11.852   3.251  -0.333
  136   HG21  THR  26          3HG2      THR  26   8.612   2.700  -1.501
  137   HG22  THR  26          1HG2      THR  26  10.094   3.603  -1.810
  138   HG23  THR  26          2HG2      THR  26   9.210   3.846  -0.307
  139    H    THR  27           H        THR  27   8.322  -0.707   1.839
  140    HA   THR  27           HA       THR  27   7.977  -2.440  -0.336
  141    HB   THR  27           HB       THR  27   6.333  -2.454   2.196
  142    HG1  THR  27           1HG      THR  27   9.059  -3.075   1.727
  143   HG21  THR  27          3HG2      THR  27   5.817  -4.180   0.510
  144   HG22  THR  27          1HG2      THR  27   6.550  -4.891   1.946
  145   HG23  THR  27          2HG2      THR  27   7.515  -4.660   0.487
  146    H    CYS  28           H        CYS  28   5.369  -0.868   1.531
  147    HA   CYS  28           HA       CYS  28   3.766  -0.847  -0.862
  148    HB2  CYS  28           2HB      CYS  28   3.053  -0.410   2.002
  149    HB3  CYS  28           1HB      CYS  28   1.943   0.068   0.718
  150    H    ARG  29           H        ARG  29   5.953   1.156   0.302
  151    HA   ARG  29           HA       ARG  29   4.421   3.580  -0.198
  152    HB2  ARG  29           2HB      ARG  29   5.846   3.358   1.844
  153    HB3  ARG  29           1HB      ARG  29   7.258   3.333   0.803
  154    HG2  ARG  29           2HG      ARG  29   6.773   5.582   0.040
  155    HG3  ARG  29           1HG      ARG  29   5.297   5.605   1.001
  156    HD2  ARG  29           2HD      ARG  29   6.985   6.785   2.211
  157    HD3  ARG  29           1HD      ARG  29   6.657   5.246   3.010
  158    HE   ARG  29           HE       ARG  29   8.929   5.411   1.182
  159   HH11  ARG  29          1HH1      ARG  29   7.719   5.175   4.499
  160   HH12  ARG  29          2HH1      ARG  29   9.207   4.738   5.172
  161   HH21  ARG  29          1HH2      ARG  29  10.985   4.839   2.103
  162   HH22  ARG  29          2HH2      ARG  29  11.107   4.583   3.800
  163    H    ASN  30           H        ASN  30   5.924   1.513  -2.142
  164    HA   ASN  30           HA       ASN  30   7.214   3.630  -3.685
  165    HB2  ASN  30           2HB      ASN  30   8.318   1.974  -5.029
  166    HB3  ASN  30           1HB      ASN  30   8.537   1.500  -3.356
  167   HD21  ASN  30          1HD2      ASN  30   7.590  -0.378  -2.658
  168   HD22  ASN  30          2HD2      ASN  30   6.847  -1.516  -3.718
  169    H    SER  31           H        SER  31   6.840   3.433  -6.141
  170    HA   SER  31           HA       SER  31   4.158   4.058  -6.480
  171    HB2  SER  31           2HB      SER  31   4.972   4.181  -8.927
  172    HB3  SER  31           1HB      SER  31   5.636   5.292  -7.727
  173    HG   SER  31           HG       SER  31   7.291   4.439  -8.877
  174    H    ARG  32           H        ARG  32   5.651   0.985  -6.643
  175    HA   ARG  32           HA       ARG  32   3.828   0.006  -8.647
  176    HB2  ARG  32           2HB      ARG  32   5.778  -1.533  -6.952
  177    HB3  ARG  32           1HB      ARG  32   4.910  -2.148  -8.350
  178    HG2  ARG  32           2HG      ARG  32   6.096  -0.446  -9.741
  179    HG3  ARG  32           1HG      ARG  32   7.046  -0.040  -8.305
  180    HD2  ARG  32           2HD      ARG  32   8.262  -1.611  -9.675
  181    HD3  ARG  32           1HD      ARG  32   7.780  -2.380  -8.159
  182    HE   ARG  32           HE       ARG  32   6.396  -2.741 -10.727
  183   HH11  ARG  32          1HH1      ARG  32   7.410  -4.096  -7.581
  184   HH12  ARG  32          2HH1      ARG  32   6.794  -5.636  -7.948
  185   HH21  ARG  32          1HH2      ARG  32   5.550  -4.822 -11.134
  186   HH22  ARG  32          2HH2      ARG  32   5.682  -6.058  -9.963
  187    H    CYS  33           H        CYS  33   3.493   0.765  -5.503
  188    HA   CYS  33           HA       CYS  33   1.762  -1.455  -4.877
  189    HB2  CYS  33           2HB      CYS  33   3.105  -0.484  -3.062
  190    HB3  CYS  33           1HB      CYS  33   2.372   1.083  -3.347
  191    HA   PRO  34           HA       PRO  34  -1.349   0.665  -7.329
  192    HB2  PRO  34           2HB      PRO  34  -3.433  -1.000  -6.585
  193    HB3  PRO  34           1HB      PRO  34  -2.296  -1.334  -7.892
  194    HG2  PRO  34           2HG      PRO  34  -2.290  -2.315  -5.077
  195    HG3  PRO  34           1HG      PRO  34  -1.926  -3.200  -6.570
  196    HD2  PRO  34           2HD      PRO  34   0.009  -2.354  -4.956
  197    HD3  PRO  34           1HD      PRO  34   0.224  -2.292  -6.718
  198    H    CYS  35           H        CYS  35  -1.678  -0.107  -3.989
  199    HA   CYS  35           HA       CYS  35  -4.008   1.412  -3.397
  200    HB2  CYS  35           2HB      CYS  35  -1.704   0.693  -1.600
  201    HB3  CYS  35           1HB      CYS  35  -3.326   1.143  -1.089
  202    H    TYR  36           H        TYR  36  -0.625   1.949  -2.668
  203    HA   TYR  36           HA       TYR  36  -0.658   4.539  -1.760
  204    HB2  TYR  36           2HB      TYR  36   1.262   3.166  -1.468
  205    HB3  TYR  36           1HB      TYR  36   1.412   2.903  -3.194
  206    HD1  TYR  36           1HD      TYR  36   1.927   5.355  -0.482
  207    HD2  TYR  36           2HD      TYR  36   2.603   4.415  -4.569
  208    HE1  TYR  36           1HE      TYR  36   3.584   7.169  -0.627
  209    HE2  TYR  36           2HE      TYR  36   4.235   6.199  -4.739
  210    HH   TYR  36           HH       TYR  36   5.512   7.750  -2.000
  211    H    LYS  37           H        LYS  37  -0.103   3.378  -5.057
  212    HA   LYS  37           HA       LYS  37   0.350   5.938  -6.126
  213    HB2  LYS  37           2HB      LYS  37   1.110   3.688  -7.023
  214    HB3  LYS  37           1HB      LYS  37  -0.507   3.516  -7.685
  215    HG2  LYS  37           2HG      LYS  37  -0.192   5.494  -9.048
  216    HG3  LYS  37           1HG      LYS  37   1.406   5.743  -8.335
  217    HD2  LYS  37           2HD      LYS  37   2.059   3.493  -9.181
  218    HD3  LYS  37           1HD      LYS  37   0.514   3.416 -10.028
  219    HE2  LYS  37           2HE      LYS  37   1.114   5.390 -11.310
  220    HE3  LYS  37           1HE      LYS  37   2.635   5.514 -10.427
  221    HZ1  LYS  37           3HZ      LYS  37   3.276   3.356 -11.322
  222    HZ2  LYS  37           1HZ      LYS  37   2.942   4.443 -12.572
  223    HZ3  LYS  37           2HZ      LYS  37   1.826   3.251 -12.158
  224    H    SER  38           H        SER  38  -2.581   4.148  -5.531
  225    HA   SER  38           HA       SER  38  -4.110   6.049  -7.156
  226    HB2  SER  38           2HB      SER  38  -5.141   3.605  -5.701
  227    HB3  SER  38           1HB      SER  38  -5.978   4.539  -6.941
  228    HG   SER  38           HG       SER  38  -3.848   2.777  -7.121
  229    H    TYR  39           H        TYR  39  -2.804   6.132  -4.279
  230    HA   TYR  39           HA       TYR  39  -3.071   7.342  -2.416
  231    HB2  TYR  39           2HB      TYR  39  -5.411   8.545  -3.910
  232    HB3  TYR  39           1HB      TYR  39  -4.824   9.141  -2.363
  233    HD1  TYR  39           1HD      TYR  39  -3.919   8.674  -5.920
  234    HD2  TYR  39           2HD      TYR  39  -2.924  10.562  -2.253
  235    HE1  TYR  39           1HE      TYR  39  -2.307  10.097  -7.099
  236    HE2  TYR  39           2HE      TYR  39  -1.304  11.991  -3.415
  237    HH   TYR  39           HH       TYR  39  -1.258  12.312  -6.755
  238    H    ASN  40           H        ASN  40  -4.291   4.738  -2.586
  239    HA   ASN  40           HA       ASN  40  -6.411   5.065  -0.577
  240    HB2  ASN  40           2HB      ASN  40  -5.912   2.756  -2.465
  241    HB3  ASN  40           1HB      ASN  40  -6.979   2.628  -1.074
  242   HD21  ASN  40          1HD2      ASN  40  -6.568   3.862  -4.251
  243   HD22  ASN  40          2HD2      ASN  40  -8.178   4.407  -4.488
  244    H    SER  41           H        SER  41  -6.452   3.510   1.147
  245    HA   SER  41           HA       SER  41  -3.822   3.035   2.212
  246    HB2  SER  41           2HB      SER  41  -5.139   2.419   4.242
  247    HB3  SER  41           1HB      SER  41  -5.475   4.047   3.656
  248    HG   SER  41           HG       SER  41  -7.297   2.722   4.253
  249    H    CYS  42           H        CYS  42  -3.417   0.961   3.322
  250    HA   CYS  42           HA       CYS  42  -4.208  -1.211   1.611
  251    HB2  CYS  42           2HB      CYS  42  -1.966  -0.914   3.591
  252    HB3  CYS  42           1HB      CYS  42  -2.416  -2.480   2.912
  253    H    ALA  43           H        ALA  43  -6.192  -1.064   2.430
  254    HA   ALA  43           HA       ALA  43  -6.517  -2.546   4.956
  255    HB1  ALA  43           1HB      ALA  43  -7.673  -0.381   4.966
  256    HB2  ALA  43           2HB      ALA  43  -8.828  -1.713   5.024
  257    HB3  ALA  43           3HB      ALA  43  -8.559  -0.843   3.514
  258    H    GLY  44           H        GLY  44  -6.526  -4.625   4.445
  259    HA2  GLY  44           2HA      GLY  44  -7.868  -6.499   3.825
  260    HA3  GLY  44           1HA      GLY  44  -8.580  -5.525   2.547
  261    H    CYS  45           H        CYS  45  -5.262  -5.217   2.855
  262    HA   CYS  45           HA       CYS  45  -4.865  -6.496   0.287
  263    HB2  CYS  45           2HB      CYS  45  -2.906  -5.063   2.075
  264    HB3  CYS  45           1HB      CYS  45  -2.635  -5.564   0.410
  265    H    HIS  46           H        HIS  46  -2.661  -7.664   0.166
  266    HA   HIS  46           HA       HIS  46  -2.432  -9.479   2.445
  267    HB2  HIS  46           2HB      HIS  46  -2.231 -10.073  -0.511
  268    HB3  HIS  46           1HB      HIS  46  -1.635 -11.190   0.711
  269    HD1  HIS  46           1HD      HIS  46  -3.408 -12.538   2.036
  270    HD2  HIS  46           2HD      HIS  46  -5.040  -9.846  -0.680
  271    HE1  HIS  46           1HE      HIS  46  -5.839 -13.106   1.890
  272    HE2  HIS  46           2HE      HIS  46  -6.813 -11.227   0.567
  273    H    CYS  47           H        CYS  47  -1.219  -6.953   1.775
  274    HA   CYS  47           HA       CYS  47   1.467  -7.434   1.004
  275    HB2  CYS  47           2HB      CYS  47   1.854  -5.070   1.785
  276    HB3  CYS  47           1HB      CYS  47   0.628  -5.253   0.544
  277    H    VAL  48           H        VAL  48   3.265  -7.483   2.212
  278    HA   VAL  48           HA       VAL  48   2.888  -8.189   5.054
  279    HB   VAL  48           HB       VAL  48   4.974  -9.320   3.172
  280   HG11  VAL  48          1HG1      VAL  48   5.660  -9.327   5.484
  281   HG12  VAL  48          2HG1      VAL  48   5.355 -10.975   4.930
  282   HG13  VAL  48          3HG1      VAL  48   4.172 -10.154   5.948
  283   HG21  VAL  48          3HG2      VAL  48   2.779 -10.092   2.463
  284   HG22  VAL  48          1HG2      VAL  48   2.424 -10.641   4.102
  285   HG23  VAL  48          2HG2      VAL  48   3.712 -11.408   3.159
  286    H    GLY  49           H        GLY  49   3.809  -6.622   6.231
  287    HA2  GLY  49           2HA      GLY  49   5.499  -5.255   6.990
  288    HA3  GLY  49           1HA      GLY  49   6.481  -5.733   5.598
  289    H    CYS  50           H        CYS  50   3.345  -4.273   6.044
  290    HA   CYS  50           HA       CYS  50   3.639  -2.666   3.709
  291    HB2  CYS  50           2HB      CYS  50   1.519  -3.622   4.048
  292    HB3  CYS  50           1HB      CYS  50   1.468  -3.102   5.727
  293    H    LYS  51           H        LYS  51   4.721  -0.822   3.814
  294    HA   LYS  51           HA       LYS  51   4.075   0.926   6.075
  295    HB2  LYS  51           2HB      LYS  51   6.427   1.221   4.156
  296    HB3  LYS  51           1HB      LYS  51   6.070   2.283   5.489
  297    HG2  LYS  51           2HG      LYS  51   7.859   0.973   6.231
  298    HG3  LYS  51           1HG      LYS  51   6.443   0.248   6.998
  299    HD2  LYS  51           2HD      LYS  51   6.374  -1.435   5.190
  300    HD3  LYS  51           1HD      LYS  51   7.831  -0.725   4.501
  301    HE2  LYS  51           2HE      LYS  51   9.046  -1.259   6.549
  302    HE3  LYS  51           1HE      LYS  51   7.581  -1.984   7.224
  303    HZ1  LYS  51           3HZ      LYS  51   7.618  -3.504   5.231
  304    HZ2  LYS  51           1HZ      LYS  51   8.893  -3.712   6.338
  305    HZ3  LYS  51           2HZ      LYS  51   9.168  -2.898   4.905
  306    H    ASN  52           H        ASN  52   2.192   1.596   5.229
  307    HA   ASN  52           HA       ASN  52   2.360   2.978   2.654
  308    HB2  ASN  52           2HB      ASN  52   0.648   1.130   2.903
  309    HB3  ASN  52           1HB      ASN  52  -0.170   2.106   4.105
  310   HD21  ASN  52          1HD2      ASN  52  -1.301   1.198   1.717
  311   HD22  ASN  52          2HD2      ASN  52  -1.714   2.572   0.753
  312    HA   PRO  53           HA       PRO  53   2.103   6.682   5.263
  313    HB2  PRO  53           2HB      PRO  53   1.813   8.009   2.647
  314    HB3  PRO  53           1HB      PRO  53   3.005   8.295   3.917
  315    HG2  PRO  53           2HG      PRO  53   3.662   7.089   1.626
  316    HG3  PRO  53           1HG      PRO  53   4.399   6.621   3.168
  317    HD2  PRO  53           2HD      PRO  53   2.269   5.246   1.588
  318    HD3  PRO  53           1HD      PRO  53   3.617   4.568   2.524
  319    H    HIS  54           H        HIS  54  -0.146   5.456   2.952
  320    HA   HIS  54           HA       HIS  54  -2.048   7.563   3.430
  321    HB2  HIS  54           2HB      HIS  54  -2.341   5.040   1.800
  322    HB3  HIS  54           1HB      HIS  54  -3.605   6.253   1.980
  323    HD1  HIS  54           1HD      HIS  54  -3.132   8.598   0.877
  324    HD2  HIS  54           2HD      HIS  54  -0.357   5.640   0.038
  325    HE1  HIS  54           1HE      HIS  54  -1.823   9.460  -1.059
  326    HE2  HIS  54           2HE      HIS  54  -0.069   7.737  -1.500
  327    H    LYS  55           H        LYS  55  -2.278   7.467   5.457
  328    HA   LYS  55           HA       LYS  55  -4.271   5.596   6.443
  329    HB2  LYS  55           2HB      LYS  55  -1.825   6.524   7.997
  330    HB3  LYS  55           1HB      LYS  55  -3.158   5.594   8.657
  331    HG2  LYS  55           2HG      LYS  55  -2.537   3.711   7.225
  332    HG3  LYS  55           1HG      LYS  55  -1.200   4.660   6.567
  333    HD2  LYS  55           2HD      LYS  55  -0.246   4.857   8.809
  334    HD3  LYS  55           1HD      LYS  55  -1.576   3.896   9.453
  335    HE2  LYS  55           2HE      LYS  55  -0.880   2.011   8.051
  336    HE3  LYS  55           1HE      LYS  55   0.452   2.979   7.422
  337    HZ1  LYS  55           3HZ      LYS  55   1.112   1.462   9.207
  338    HZ2  LYS  55           1HZ      LYS  55   0.097   2.244  10.277
  339    HZ3  LYS  55           2HZ      LYS  55   1.424   3.052   9.628
  340    H    GLU  56           H        GLU  56  -5.346   6.721   8.333
  341    HA   GLU  56           HA       GLU  56  -5.775   9.398   7.555
  342    HB2  GLU  56           2HB      GLU  56  -7.384   9.476   9.522
  343    HB3  GLU  56           1HB      GLU  56  -7.746   8.312   8.268
  344    HG2  GLU  56           2HG      GLU  56  -6.331   7.563  10.820
  345    HG3  GLU  56           1HG      GLU  56  -8.084   7.590  10.687
  346    H    ASP  57           H        ASP  57  -4.465  10.920   7.960
  347    HA   ASP  57           HA       ASP  57  -2.766  10.968  10.268
  348    HB2  ASP  57           2HB      ASP  57  -3.297  13.085   8.153
  349    HB3  ASP  57           1HB      ASP  57  -2.188  13.326   9.495
  350    H    TYR  58           H        TYR  58  -4.126  10.781  11.837
  351    HA   TYR  58           HA       TYR  58  -5.958  12.989  12.483
  352    HB2  TYR  58           2HB      TYR  58  -7.257  11.184  11.609
  353    HB3  TYR  58           1HB      TYR  58  -6.356  10.003  12.526
  354    HD1  TYR  58           1HD      TYR  58  -8.552  12.990  13.146
  355    HD2  TYR  58           2HD      TYR  58  -7.388   9.081  14.333
  356    HE1  TYR  58           1HE      TYR  58 -10.343  12.969  14.819
  357    HE2  TYR  58           2HE      TYR  58  -9.165   9.052  16.012
  358    HH   TYR  58           HH       TYR  58 -10.534  10.619  17.276
  359    H    VAL  59           H        VAL  59  -5.156  13.880  14.287
  360    HA   VAL  59           HA       VAL  59  -4.005  12.074  16.232
  361    HB   VAL  59           HB       VAL  59  -2.834  14.057  17.247
  362   HG11  VAL  59          1HG1      VAL  59  -2.197  13.483  14.362
  363   HG12  VAL  59          2HG1      VAL  59  -1.655  12.557  15.764
  364   HG13  VAL  59          3HG1      VAL  59  -1.097  14.216  15.530
  365   HG21  VAL  59          3HG2      VAL  59  -3.737  15.488  14.739
  366   HG22  VAL  59          1HG2      VAL  59  -2.555  16.101  15.898
  367   HG23  VAL  59          2HG2      VAL  59  -4.229  15.869  16.387
  Start of MODEL   14
    1    H1   SER   8           1HT      SER   8 -19.784   2.549  -5.262
    2    H2   SER   8           2HT      SER   8 -20.411   2.961  -3.740
    3    H3   SER   8           3HT      SER   8 -19.809   1.413  -4.028
    4    HA   SER   8           HA       SER   8 -18.201   3.854  -4.042
    5    HB2  SER   8           2HB      SER   8 -18.374   1.583  -2.038
    6    HB3  SER   8           1HB      SER   8 -17.372   3.038  -1.895
    7    HG   SER   8           HG       SER   8 -19.143   4.229  -1.472
    8    HA   PRO   9           HA       PRO   9 -15.475   0.969  -6.101
    9    HB2  PRO   9           2HB      PRO   9 -13.142   2.335  -5.988
   10    HB3  PRO   9           1HB      PRO   9 -14.477   2.815  -7.036
   11    HG2  PRO   9           2HG      PRO   9 -13.493   4.074  -4.561
   12    HG3  PRO   9           1HG      PRO   9 -14.449   4.775  -5.870
   13    HD2  PRO   9           2HD      PRO   9 -15.374   3.836  -3.316
   14    HD3  PRO   9           1HD      PRO   9 -16.330   4.516  -4.642
   15    HA   PRO  10           HA       PRO  10 -13.529  -1.205  -2.700
   16    HB2  PRO  10           2HB      PRO  10 -12.547  -3.295  -4.188
   17    HB3  PRO  10           1HB      PRO  10 -14.218  -3.219  -3.609
   18    HG2  PRO  10           2HG      PRO  10 -13.115  -2.647  -6.312
   19    HG3  PRO  10           1HG      PRO  10 -14.662  -3.378  -5.862
   20    HD2  PRO  10           2HD      PRO  10 -14.375  -0.772  -6.664
   21    HD3  PRO  10           1HD      PRO  10 -15.687  -1.348  -5.617
   22    H    LYS  11           H        LYS  11 -11.549  -0.904  -1.927
   23    HA   LYS  11           HA       LYS  11  -9.616   0.569  -3.377
   24    HB2  LYS  11           2HB      LYS  11  -9.343  -0.941  -0.795
   25    HB3  LYS  11           1HB      LYS  11  -8.167   0.219  -1.398
   26    HG2  LYS  11           2HG      LYS  11  -9.971   1.943  -1.272
   27    HG3  LYS  11           1HG      LYS  11 -10.987   0.750  -0.484
   28    HD2  LYS  11           2HD      LYS  11  -8.302   1.703   0.540
   29    HD3  LYS  11           1HD      LYS  11  -9.852   2.299   1.106
   30    HE2  LYS  11           2HE      LYS  11  -9.153   0.738   2.738
   31    HE3  LYS  11           1HE      LYS  11 -10.348  -0.121   1.771
   32    HZ1  LYS  11           3HZ      LYS  11  -7.407  -0.355   1.411
   33    HZ2  LYS  11           1HZ      LYS  11  -8.574  -1.293   0.646
   34    HZ3  LYS  11           2HZ      LYS  11  -8.342  -1.457   2.287
   35    HA   PRO  12           HA       PRO  12  -7.312  -2.659  -5.426
   36    HB2  PRO  12           2HB      PRO  12  -4.951  -1.040  -4.622
   37    HB3  PRO  12           1HB      PRO  12  -5.397  -1.630  -6.220
   38    HG2  PRO  12           2HG      PRO  12  -5.721   0.940  -5.586
   39    HG3  PRO  12           1HG      PRO  12  -6.903   0.083  -6.589
   40    HD2  PRO  12           2HD      PRO  12  -7.092   0.889  -3.729
   41    HD3  PRO  12           1HD      PRO  12  -8.355   0.792  -4.979
   42    H    LYS  13           H        LYS  13  -5.990  -4.376  -4.850
   43    HA   LYS  13           HA       LYS  13  -4.990  -4.432  -2.133
   44    HB2  LYS  13           2HB      LYS  13  -5.784  -6.849  -1.984
   45    HB3  LYS  13           1HB      LYS  13  -7.008  -5.602  -1.868
   46    HG2  LYS  13           2HG      LYS  13  -7.631  -5.975  -4.200
   47    HG3  LYS  13           1HG      LYS  13  -6.390  -7.222  -4.333
   48    HD2  LYS  13           2HD      LYS  13  -7.502  -8.602  -2.737
   49    HD3  LYS  13           1HD      LYS  13  -8.641  -7.314  -2.340
   50    HE2  LYS  13           2HE      LYS  13  -9.673  -8.981  -3.786
   51    HE3  LYS  13           1HE      LYS  13  -9.560  -7.420  -4.592
   52    HZ1  LYS  13           3HZ      LYS  13  -8.973  -9.243  -6.037
   53    HZ2  LYS  13           1HZ      LYS  13  -7.730  -9.721  -5.020
   54    HZ3  LYS  13           2HZ      LYS  13  -7.645  -8.233  -5.819
   55    H    CYS  14           H        CYS  14  -3.025  -4.873  -2.071
   56    HA   CYS  14           HA       CYS  14  -1.679  -6.057  -4.395
   57    HB2  CYS  14           2HB      CYS  14   0.263  -4.699  -3.602
   58    HB3  CYS  14           1HB      CYS  14  -1.149  -3.742  -4.009
   59    H    ARG  15           H        ARG  15   0.218  -7.367  -3.900
   60    HA   ARG  15           HA       ARG  15   0.027  -8.713  -1.282
   61    HB2  ARG  15           2HB      ARG  15   1.078  -9.869  -3.892
   62    HB3  ARG  15           1HB      ARG  15   1.088 -10.699  -2.359
   63    HG2  ARG  15           2HG      ARG  15  -0.701 -11.620  -3.551
   64    HG3  ARG  15           1HG      ARG  15  -1.468 -10.529  -2.414
   65    HD2  ARG  15           2HD      ARG  15  -1.567  -8.809  -4.200
   66    HD3  ARG  15           1HD      ARG  15  -0.898  -9.995  -5.322
   67    HE   ARG  15           HE       ARG  15  -3.149 -11.071  -4.103
   68   HH11  ARG  15          1HH1      ARG  15  -2.293  -8.561  -6.448
   69   HH12  ARG  15          2HH1      ARG  15  -3.803  -8.605  -7.245
   70   HH21  ARG  15          1HH2      ARG  15  -5.265 -11.064  -5.175
   71   HH22  ARG  15          2HH2      ARG  15  -5.505 -10.017  -6.507
   72    H    CYS  16           H        CYS  16   1.441  -6.324  -1.897
   73    HA   CYS  16           HA       CYS  16   4.188  -6.622  -2.297
   74    HB2  CYS  16           2HB      CYS  16   2.793  -4.576  -0.547
   75    HB3  CYS  16           1HB      CYS  16   4.430  -4.460  -1.183
   76    H    GLY  17           H        GLY  17   5.832  -7.251  -0.995
   77    HA2  GLY  17           2HA      GLY  17   6.714  -7.521   1.232
   78    HA3  GLY  17           1HA      GLY  17   5.114  -8.098   1.720
   79    H    ILE  18           H        ILE  18   4.452  -9.604  -0.408
   80    HA   ILE  18           HA       ILE  18   5.986 -11.997   0.077
   81    HB   ILE  18           HB       ILE  18   3.630 -11.536  -1.784
   82   HG12  ILE  18          2HG1      ILE  18   3.697 -12.489   1.089
   83   HG13  ILE  18          1HG1      ILE  18   3.063 -10.961   0.509
   84   HG21  ILE  18          1HG2      ILE  18   4.766 -14.103  -0.655
   85   HG22  ILE  18          2HG2      ILE  18   4.878 -13.571  -2.330
   86   HG23  ILE  18          3HG2      ILE  18   3.308 -13.972  -1.634
   87   HD11  ILE  18          3HD1      ILE  18   1.950 -13.668  -0.173
   88   HD12  ILE  18          1HD1      ILE  18   1.309 -12.117  -0.712
   89   HD13  ILE  18          2HD1      ILE  18   1.279 -12.543   1.002
   90    H    SER  19           H        SER  19   5.232  -9.807  -2.564
   91    HA   SER  19           HA       SER  19   7.691 -10.453  -3.951
   92    HB2  SER  19           2HB      SER  19   4.985 -10.599  -5.315
   93    HB3  SER  19           1HB      SER  19   6.550 -10.884  -6.066
   94    HG   SER  19           HG       SER  19   6.742 -12.627  -4.461
   95    H    GLY  20           H        GLY  20   8.339  -8.593  -5.207
   96    HA2  GLY  20           2HA      GLY  20   6.873  -6.685  -6.363
   97    HA3  GLY  20           1HA      GLY  20   6.819  -6.197  -4.677
   98    H    SER  21           H        SER  21   7.890  -4.539  -6.571
   99    HA   SER  21           HA       SER  21  10.752  -4.748  -6.332
  100    HB2  SER  21           2HB      SER  21  10.553  -2.701  -7.861
  101    HB3  SER  21           1HB      SER  21   9.995  -4.239  -8.526
  102    HG   SER  21           HG       SER  21   8.590  -1.980  -7.811
  103    H    SER  22           H        SER  22  11.960  -3.118  -5.290
  104    HA   SER  22           HA       SER  22  12.491  -1.698  -3.585
  105    HB2  SER  22           2HB      SER  22   9.771  -0.441  -4.116
  106    HB3  SER  22           1HB      SER  22  11.164   0.336  -3.366
  107    HG   SER  22           HG       SER  22  12.180  -0.335  -5.540
  108    H    ASN  23           H        ASN  23  11.199  -4.139  -3.089
  109    HA   ASN  23           HA       ASN  23   9.020  -3.949  -1.274
  110    HB2  ASN  23           2HB      ASN  23   9.284  -5.779  -2.876
  111    HB3  ASN  23           1HB      ASN  23  10.759  -6.284  -2.086
  112   HD21  ASN  23          1HD2      ASN  23  10.608  -7.363  -0.104
  113   HD22  ASN  23          2HD2      ASN  23   9.121  -8.003   0.497
  114    H    THR  24           H        THR  24  12.267  -3.757  -0.969
  115    HA   THR  24           HA       THR  24  12.759  -4.957   1.529
  116    HB   THR  24           HB       THR  24  14.788  -3.352   1.432
  117    HG1  THR  24           1HG      THR  24  15.116  -2.503  -0.655
  118   HG21  THR  24          3HG2      THR  24  15.880  -4.825  -0.230
  119   HG22  THR  24          1HG2      THR  24  14.302  -5.439  -0.713
  120   HG23  THR  24          2HG2      THR  24  14.909  -5.750   0.913
  121    H    LEU  25           H        LEU  25  12.593  -1.488   0.740
  122    HA   LEU  25           HA       LEU  25  12.056  -0.981   3.604
  123    HB2  LEU  25           2HB      LEU  25  13.136   0.971   1.565
  124    HB3  LEU  25           1HB      LEU  25  12.760   1.369   3.221
  125    HG   LEU  25           HG       LEU  25  14.561  -0.383   3.827
  126   HD11  LEU  25          1HD1      LEU  25  15.377   0.180   0.989
  127   HD12  LEU  25          2HD1      LEU  25  14.777  -1.354   1.604
  128   HD13  LEU  25          3HD1      LEU  25  16.312  -0.712   2.193
  129   HD21  LEU  25          3HD2      LEU  25  14.801   2.009   4.193
  130   HD22  LEU  25          1HD2      LEU  25  15.319   2.227   2.522
  131   HD23  LEU  25          2HD2      LEU  25  16.321   1.306   3.640
  132    H    THR  26           H        THR  26  11.134   0.180   0.404
  133    HA   THR  26           HA       THR  26   8.830   1.521   1.576
  134    HB   THR  26           HB       THR  26   8.826   2.673  -0.676
  135    HG1  THR  26           1HG      THR  26  10.013   1.007  -1.744
  136   HG21  THR  26          3HG2      THR  26  10.799   4.077  -0.165
  137   HG22  THR  26          1HG2      THR  26  11.381   2.834   0.938
  138   HG23  THR  26          2HG2      THR  26   9.891   3.704   1.302
  139    H    THR  27           H        THR  27   8.376  -1.110   1.603
  140    HA   THR  27           HA       THR  27   7.811  -2.607  -0.559
  141    HB   THR  27           HB       THR  27   6.148  -2.568   1.946
  142    HG1  THR  27           1HG      THR  27   8.713  -3.803   1.758
  143   HG21  THR  27          3HG2      THR  27   5.600  -4.259   0.289
  144   HG22  THR  27          1HG2      THR  27   6.323  -5.010   1.701
  145   HG23  THR  27          2HG2      THR  27   7.282  -4.790   0.235
  146    H    CYS  28           H        CYS  28   5.216  -1.010   1.295
  147    HA   CYS  28           HA       CYS  28   3.644  -0.869  -1.109
  148    HB2  CYS  28           2HB      CYS  28   2.934  -0.618   1.769
  149    HB3  CYS  28           1HB      CYS  28   1.802  -0.043   0.556
  150    H    ARG  29           H        ARG  29   5.837   1.050   0.105
  151    HA   ARG  29           HA       ARG  29   4.353   3.559  -0.141
  152    HB2  ARG  29           2HB      ARG  29   5.739   3.202   1.849
  153    HB3  ARG  29           1HB      ARG  29   7.159   3.031   0.837
  154    HG2  ARG  29           2HG      ARG  29   6.899   5.355   0.110
  155    HG3  ARG  29           1HG      ARG  29   5.482   5.504   1.136
  156    HD2  ARG  29           2HD      ARG  29   6.779   5.163   3.110
  157    HD3  ARG  29           1HD      ARG  29   8.218   4.784   2.159
  158    HE   ARG  29           HE       ARG  29   7.153   7.330   1.515
  159   HH11  ARG  29          1HH1      ARG  29   9.039   5.768   4.049
  160   HH12  ARG  29          2HH1      ARG  29  10.052   7.108   4.321
  161   HH21  ARG  29          1HH2      ARG  29   8.461   9.109   1.839
  162   HH22  ARG  29          2HH2      ARG  29   9.712   9.123   2.995
  163    H    ASN  30           H        ASN  30   5.976   1.649  -2.221
  164    HA   ASN  30           HA       ASN  30   7.349   3.858  -3.546
  165    HB2  ASN  30           2HB      ASN  30   8.414   2.262  -5.009
  166    HB3  ASN  30           1HB      ASN  30   8.562   1.680  -3.362
  167   HD21  ASN  30          1HD2      ASN  30   7.447  -0.182  -2.769
  168   HD22  ASN  30          2HD2      ASN  30   6.761  -1.235  -3.936
  169    H    SER  31           H        SER  31   7.132   4.014  -5.956
  170    HA   SER  31           HA       SER  31   4.434   4.706  -6.417
  171    HB2  SER  31           2HB      SER  31   6.760   4.788  -8.341
  172    HB3  SER  31           1HB      SER  31   5.234   5.663  -8.495
  173    HG   SER  31           HG       SER  31   7.307   6.003  -6.626
  174    H    ARG  32           H        ARG  32   5.752   1.683  -6.719
  175    HA   ARG  32           HA       ARG  32   4.078   1.060  -9.025
  176    HB2  ARG  32           2HB      ARG  32   6.292  -0.560  -7.765
  177    HB3  ARG  32           1HB      ARG  32   5.279  -1.124  -9.086
  178    HG2  ARG  32           2HG      ARG  32   7.045   1.320  -9.231
  179    HG3  ARG  32           1HG      ARG  32   7.530  -0.283  -9.772
  180    HD2  ARG  32           2HD      ARG  32   6.809   1.057 -11.672
  181    HD3  ARG  32           1HD      ARG  32   5.679  -0.263 -11.419
  182    HE   ARG  32           HE       ARG  32   4.875   2.189 -10.149
  183   HH11  ARG  32          1HH1      ARG  32   4.883   0.515 -13.273
  184   HH12  ARG  32          2HH1      ARG  32   3.471   1.256 -13.841
  185   HH21  ARG  32          1HH2      ARG  32   2.958   3.214 -10.918
  186   HH22  ARG  32          2HH2      ARG  32   2.337   2.839 -12.466
  187    H    CYS  33           H        CYS  33   3.710   1.279  -5.843
  188    HA   CYS  33           HA       CYS  33   2.173  -1.153  -5.573
  189    HB2  CYS  33           2HB      CYS  33   3.413  -0.339  -3.591
  190    HB3  CYS  33           1HB      CYS  33   2.510   1.165  -3.634
  191    HA   PRO  34           HA       PRO  34  -1.257   0.784  -7.668
  192    HB2  PRO  34           2HB      PRO  34  -3.186  -0.972  -6.757
  193    HB3  PRO  34           1HB      PRO  34  -2.142  -1.269  -8.146
  194    HG2  PRO  34           2HG      PRO  34  -1.850  -2.207  -5.324
  195    HG3  PRO  34           1HG      PRO  34  -1.570  -3.101  -6.827
  196    HD2  PRO  34           2HD      PRO  34   0.452  -2.157  -5.413
  197    HD3  PRO  34           1HD      PRO  34   0.495  -2.076  -7.190
  198    H    CYS  35           H        CYS  35  -1.512  -0.116  -4.316
  199    HA   CYS  35           HA       CYS  35  -3.849   1.379  -3.734
  200    HB2  CYS  35           2HB      CYS  35  -1.651   0.448  -1.929
  201    HB3  CYS  35           1HB      CYS  35  -3.246   0.993  -1.410
  202    H    TYR  36           H        TYR  36  -0.504   1.915  -2.884
  203    HA   TYR  36           HA       TYR  36  -0.642   4.399  -1.736
  204    HB2  TYR  36           2HB      TYR  36   1.356   3.149  -1.547
  205    HB3  TYR  36           1HB      TYR  36   1.524   3.031  -3.291
  206    HD1  TYR  36           2HD      TYR  36   1.609   5.491  -0.498
  207    HD2  TYR  36           1HD      TYR  36   2.833   4.544  -4.451
  208    HE1  TYR  36           2HE      TYR  36   3.067   7.466  -0.514
  209    HE2  TYR  36           1HE      TYR  36   4.285   6.504  -4.489
  210    HH   TYR  36           HH       TYR  36   4.650   8.511  -3.452
  211    H    LYS  37           H        LYS  37   0.019   3.658  -5.146
  212    HA   LYS  37           HA       LYS  37   0.333   6.348  -5.915
  213    HB2  LYS  37           2HB      LYS  37   1.033   4.059  -7.039
  214    HB3  LYS  37           1HB      LYS  37  -0.515   4.208  -7.839
  215    HG2  LYS  37           2HG      LYS  37   1.706   6.244  -7.963
  216    HG3  LYS  37           1HG      LYS  37   1.387   5.024  -9.184
  217    HD2  LYS  37           2HD      LYS  37  -0.845   6.045  -9.554
  218    HD3  LYS  37           1HD      LYS  37  -0.447   7.276  -8.356
  219    HE2  LYS  37           2HE      LYS  37  -0.072   8.170 -10.557
  220    HE3  LYS  37           1HE      LYS  37   1.482   7.940  -9.755
  221    HZ1  LYS  37           3HZ      LYS  37   1.751   5.863 -11.003
  222    HZ2  LYS  37           1HZ      LYS  37   1.566   7.177 -12.040
  223    HZ3  LYS  37           2HZ      LYS  37   0.287   6.138 -11.785
  224    H    SER  38           H        SER  38  -2.464   4.229  -5.668
  225    HA   SER  38           HA       SER  38  -4.137   6.158  -7.029
  226    HB2  SER  38           2HB      SER  38  -4.431   3.696  -7.402
  227    HB3  SER  38           1HB      SER  38  -4.901   3.533  -5.717
  228    HG   SER  38           HG       SER  38  -6.264   5.449  -7.121
  229    H    TYR  39           H        TYR  39  -2.817   6.163  -4.099
  230    HA   TYR  39           HA       TYR  39  -3.157   7.335  -2.211
  231    HB2  TYR  39           2HB      TYR  39  -5.543   8.414  -3.730
  232    HB3  TYR  39           1HB      TYR  39  -5.119   8.976  -2.122
  233    HD1  TYR  39           2HD      TYR  39  -3.551   8.525  -5.503
  234    HD2  TYR  39           1HD      TYR  39  -3.785  10.862  -1.966
  235    HE1  TYR  39           2HE      TYR  39  -2.014  10.165  -6.489
  236    HE2  TYR  39           1HE      TYR  39  -2.250  12.506  -2.948
  237    HH   TYR  39           HH       TYR  39  -0.524  12.626  -4.690
  238    H    ASN  40           H        ASN  40  -4.308   4.644  -2.548
  239    HA   ASN  40           HA       ASN  40  -6.521   4.754  -0.614
  240    HB2  ASN  40           2HB      ASN  40  -5.761   2.658  -2.637
  241    HB3  ASN  40           1HB      ASN  40  -6.808   2.276  -1.280
  242   HD21  ASN  40          1HD2      ASN  40  -6.560   3.970  -4.330
  243   HD22  ASN  40          2HD2      ASN  40  -8.234   4.352  -4.413
  244    H    SER  41           H        SER  41  -6.574   3.307   1.179
  245    HA   SER  41           HA       SER  41  -3.988   2.868   2.330
  246    HB2  SER  41           2HB      SER  41  -5.397   2.226   4.309
  247    HB3  SER  41           1HB      SER  41  -5.703   3.852   3.700
  248    HG   SER  41           HG       SER  41  -7.588   2.530   4.157
  249    H    CYS  42           H        CYS  42  -3.376   0.791   3.258
  250    HA   CYS  42           HA       CYS  42  -4.135  -1.373   1.459
  251    HB2  CYS  42           2HB      CYS  42  -1.723  -0.938   3.162
  252    HB3  CYS  42           1HB      CYS  42  -2.108  -2.539   2.536
  253    H    ALA  43           H        ALA  43  -5.497  -0.483   4.083
  254    HA   ALA  43           HA       ALA  43  -5.576  -2.866   5.639
  255    HB1  ALA  43           1HB      ALA  43  -6.385  -0.698   6.521
  256    HB2  ALA  43           2HB      ALA  43  -7.648  -1.926   6.586
  257    HB3  ALA  43           3HB      ALA  43  -7.678  -0.703   5.319
  258    H    GLY  44           H        GLY  44  -6.188  -4.748   4.784
  259    HA2  GLY  44           2HA      GLY  44  -8.021  -6.109   3.949
  260    HA3  GLY  44           1HA      GLY  44  -8.487  -4.741   2.948
  261    H    CYS  45           H        CYS  45  -5.162  -5.076   2.990
  262    HA   CYS  45           HA       CYS  45  -5.206  -6.399   0.380
  263    HB2  CYS  45           2HB      CYS  45  -3.003  -4.908   1.801
  264    HB3  CYS  45           1HB      CYS  45  -2.842  -5.674   0.226
  265    H    HIS  46           H        HIS  46  -3.073  -7.722   0.066
  266    HA   HIS  46           HA       HIS  46  -2.875  -9.566   2.333
  267    HB2  HIS  46           2HB      HIS  46  -3.633 -10.242  -0.086
  268    HB3  HIS  46           1HB      HIS  46  -1.919 -10.105  -0.461
  269    HD1  HIS  46           1HD      HIS  46  -0.455 -11.569   1.526
  270    HD2  HIS  46           2HD      HIS  46  -4.268 -12.737   0.462
  271    HE1  HIS  46           1HE      HIS  46  -0.629 -13.981   2.217
  272    HE2  HIS  46           2HE      HIS  46  -3.059 -14.500   1.906
  273    H    CYS  47           H        CYS  47  -1.559  -6.961   1.834
  274    HA   CYS  47           HA       CYS  47   1.151  -7.582   1.202
  275    HB2  CYS  47           2HB      CYS  47   1.599  -5.165   1.724
  276    HB3  CYS  47           1HB      CYS  47   0.432  -5.445   0.441
  277    H    VAL  48           H        VAL  48   2.862  -7.590   2.462
  278    HA   VAL  48           HA       VAL  48   2.381  -7.935   5.352
  279    HB   VAL  48           HB       VAL  48   4.445  -9.376   3.651
  280   HG11  VAL  48          1HG1      VAL  48   3.665  -9.801   6.530
  281   HG12  VAL  48          2HG1      VAL  48   5.167  -9.081   5.948
  282   HG13  VAL  48          3HG1      VAL  48   4.822 -10.777   5.621
  283   HG21  VAL  48          3HG2      VAL  48   2.225 -10.189   3.078
  284   HG22  VAL  48          1HG2      VAL  48   1.857 -10.433   4.786
  285   HG23  VAL  48          2HG2      VAL  48   3.096 -11.413   4.000
  286    H    GLY  49           H        GLY  49   3.418  -6.453   6.498
  287    HA2  GLY  49           2HA      GLY  49   5.083  -5.014   7.198
  288    HA3  GLY  49           1HA      GLY  49   6.113  -5.626   5.901
  289    H    CYS  50           H        CYS  50   2.926  -4.354   5.661
  290    HA   CYS  50           HA       CYS  50   3.509  -2.707   3.449
  291    HB2  CYS  50           2HB      CYS  50   1.340  -3.539   3.531
  292    HB3  CYS  50           1HB      CYS  50   1.144  -3.104   5.227
  293    H    LYS  51           H        LYS  51   4.808  -1.026   3.745
  294    HA   LYS  51           HA       LYS  51   4.098   0.841   5.876
  295    HB2  LYS  51           2HB      LYS  51   6.320   1.115   3.825
  296    HB3  LYS  51           1HB      LYS  51   6.134   2.026   5.317
  297    HG2  LYS  51           2HG      LYS  51   6.795  -0.903   5.086
  298    HG3  LYS  51           1HG      LYS  51   7.907   0.392   5.526
  299    HD2  LYS  51           2HD      LYS  51   6.645   0.829   7.544
  300    HD3  LYS  51           1HD      LYS  51   5.435  -0.365   7.072
  301    HE2  LYS  51           2HE      LYS  51   7.160  -2.114   7.157
  302    HE3  LYS  51           1HE      LYS  51   8.334  -0.911   7.688
  303    HZ1  LYS  51           3HZ      LYS  51   7.047  -0.544   9.662
  304    HZ2  LYS  51           1HZ      LYS  51   7.388  -2.191   9.510
  305    HZ3  LYS  51           2HZ      LYS  51   5.851  -1.615   9.136
  306    H    ASN  52           H        ASN  52   2.160   1.576   5.062
  307    HA   ASN  52           HA       ASN  52   2.274   2.942   2.478
  308    HB2  ASN  52           2HB      ASN  52   0.542   1.113   2.760
  309    HB3  ASN  52           1HB      ASN  52  -0.203   2.098   4.009
  310   HD21  ASN  52          1HD2      ASN  52  -1.418   1.216   1.607
  311   HD22  ASN  52          2HD2      ASN  52  -1.864   2.620   0.700
  312    HA   PRO  53           HA       PRO  53   2.254   6.541   5.247
  313    HB2  PRO  53           2HB      PRO  53   2.089   7.991   2.685
  314    HB3  PRO  53           1HB      PRO  53   3.276   8.149   3.981
  315    HG2  PRO  53           2HG      PRO  53   3.914   6.993   1.663
  316    HG3  PRO  53           1HG      PRO  53   4.546   6.377   3.202
  317    HD2  PRO  53           2HD      PRO  53   2.323   5.309   1.505
  318    HD3  PRO  53           1HD      PRO  53   3.607   4.446   2.380
  319    H    HIS  54           H        HIS  54  -0.060   5.529   2.938
  320    HA   HIS  54           HA       HIS  54  -1.810   7.745   3.379
  321    HB2  HIS  54           2HB      HIS  54  -2.092   5.273   1.753
  322    HB3  HIS  54           1HB      HIS  54  -3.506   6.267   2.113
  323    HD1  HIS  54           1HD      HIS  54  -3.495   8.655   1.240
  324    HD2  HIS  54           2HD      HIS  54  -0.379   6.313  -0.153
  325    HE1  HIS  54           1HE      HIS  54  -2.492   9.946  -0.684
  326    HE2  HIS  54           2HE      HIS  54  -0.405   8.691  -1.188
  327    H    LYS  55           H        LYS  55  -2.251   7.898   5.330
  328    HA   LYS  55           HA       LYS  55  -4.321   6.136   6.258
  329    HB2  LYS  55           2HB      LYS  55  -2.021   5.661   7.395
  330    HB3  LYS  55           1HB      LYS  55  -2.244   7.214   8.171
  331    HG2  LYS  55           2HG      LYS  55  -4.222   4.959   8.395
  332    HG3  LYS  55           1HG      LYS  55  -2.883   5.172   9.518
  333    HD2  LYS  55           2HD      LYS  55  -3.827   7.417  10.102
  334    HD3  LYS  55           1HD      LYS  55  -5.194   7.080   9.042
  335    HE2  LYS  55           2HE      LYS  55  -5.879   5.229  10.401
  336    HE3  LYS  55           1HE      LYS  55  -4.412   5.330  11.369
  337    HZ1  LYS  55           3HZ      LYS  55  -6.276   6.260  12.540
  338    HZ2  LYS  55           1HZ      LYS  55  -6.601   7.399  11.346
  339    HZ3  LYS  55           2HZ      LYS  55  -5.162   7.460  12.217
  340    H    GLU  56           H        GLU  56  -5.167   7.999   5.036
  341    HA   GLU  56           HA       GLU  56  -5.337  10.533   6.265
  342    HB2  GLU  56           2HB      GLU  56  -7.096   9.054   4.287
  343    HB3  GLU  56           1HB      GLU  56  -7.460  10.675   4.842
  344    HG2  GLU  56           2HG      GLU  56  -6.422  10.733   2.653
  345    HG3  GLU  56           1HG      GLU  56  -5.373  11.487   3.841
  346    H    ASP  57           H        ASP  57  -6.714  11.112   7.937
  347    HA   ASP  57           HA       ASP  57  -7.901   8.760   9.141
  348    HB2  ASP  57           2HB      ASP  57  -6.399  10.340  10.473
  349    HB3  ASP  57           1HB      ASP  57  -7.829  11.397  10.387
  350    H    TYR  58           H        TYR  58  -9.444   8.622   7.792
  351    HA   TYR  58           HA       TYR  58 -11.689  10.414   8.234
  352    HB2  TYR  58           2HB      TYR  58 -12.791   9.320   6.277
  353    HB3  TYR  58           1HB      TYR  58 -11.283  10.105   5.847
  354    HD1  TYR  58           1HD      TYR  58  -9.245   8.617   5.485
  355    HD2  TYR  58           2HD      TYR  58 -13.176   7.038   5.789
  356    HE1  TYR  58           1HE      TYR  58  -8.496   6.555   4.386
  357    HE2  TYR  58           2HE      TYR  58 -12.438   4.969   4.699
  358    HH   TYR  58           HH       TYR  58  -9.267   4.134   4.400
  359    H    VAL  59           H        VAL  59 -13.463   9.685   9.241
  360    HA   VAL  59           HA       VAL  59 -13.099   7.143  10.609
  361    HB   VAL  59           HB       VAL  59 -15.099   9.337  11.230
  362   HG11  VAL  59          1HG1      VAL  59 -15.338   8.204  13.385
  363   HG12  VAL  59          2HG1      VAL  59 -14.235   6.940  12.839
  364   HG13  VAL  59          3HG1      VAL  59 -15.793   7.154  12.043
  365   HG21  VAL  59          3HG2      VAL  59 -12.442   8.746  12.530
  366   HG22  VAL  59          1HG2      VAL  59 -13.623   9.929  13.092
  367   HG23  VAL  59          2HG2      VAL  59 -12.827  10.155  11.537
  Start of MODEL   15
    1    H1   SER   8           1HT      SER   8 -17.426  -5.391 -10.253
    2    H2   SER   8           2HT      SER   8 -17.995  -3.859 -10.693
    3    H3   SER   8           3HT      SER   8 -19.069  -5.031 -10.132
    4    HA   SER   8           HA       SER   8 -18.650  -3.435  -8.433
    5    HB2  SER   8           2HB      SER   8 -17.363  -6.115  -7.884
    6    HB3  SER   8           1HB      SER   8 -18.154  -5.058  -6.714
    7    HG   SER   8           HG       SER   8 -20.104  -5.346  -7.974
    8    HA   PRO   9           HA       PRO   9 -14.328  -2.133  -9.056
    9    HB2  PRO   9           2HB      PRO   9 -15.135   0.403  -7.883
   10    HB3  PRO   9           1HB      PRO   9 -14.607   0.079  -9.535
   11    HG2  PRO   9           2HG      PRO   9 -17.152   0.775  -8.898
   12    HG3  PRO   9           1HG      PRO   9 -16.747  -0.240 -10.292
   13    HD2  PRO   9           2HD      PRO   9 -17.765  -1.042  -7.592
   14    HD3  PRO   9           1HD      PRO   9 -18.224  -1.648  -9.198
   15    HA   PRO  10           HA       PRO  10 -13.539  -2.588  -4.666
   16    HB2  PRO  10           2HB      PRO  10 -11.244  -3.948  -4.881
   17    HB3  PRO  10           1HB      PRO  10 -12.802  -4.732  -5.164
   18    HG2  PRO  10           2HG      PRO  10 -10.738  -3.872  -7.112
   19    HG3  PRO  10           1HG      PRO  10 -11.895  -5.211  -7.213
   20    HD2  PRO  10           2HD      PRO  10 -12.135  -2.652  -8.422
   21    HD3  PRO  10           1HD      PRO  10 -13.378  -3.917  -8.333
   22    H    LYS  11           H        LYS  11 -11.984  -1.599  -3.311
   23    HA   LYS  11           HA       LYS  11 -10.441   0.443  -4.592
   24    HB2  LYS  11           2HB      LYS  11  -9.608   0.957  -2.244
   25    HB3  LYS  11           1HB      LYS  11 -11.329   1.144  -2.495
   26    HG2  LYS  11           2HG      LYS  11 -11.773  -0.928  -1.345
   27    HG3  LYS  11           1HG      LYS  11 -10.048  -1.258  -1.197
   28    HD2  LYS  11           2HD      LYS  11 -11.298   1.236  -0.056
   29    HD3  LYS  11           1HD      LYS  11 -11.231  -0.273   0.849
   30    HE2  LYS  11           2HE      LYS  11  -8.765   0.977  -0.353
   31    HE3  LYS  11           1HE      LYS  11  -9.352   1.411   1.251
   32    HZ1  LYS  11           3HZ      LYS  11  -8.877  -1.399   0.510
   33    HZ2  LYS  11           1HZ      LYS  11  -9.003  -0.744   2.035
   34    HZ3  LYS  11           2HZ      LYS  11  -7.609  -0.472   1.094
   35    HA   PRO  12           HA       PRO  12  -7.024  -1.914  -5.745
   36    HB2  PRO  12           2HB      PRO  12  -5.045  -0.062  -4.942
   37    HB3  PRO  12           1HB      PRO  12  -5.718  -0.342  -6.551
   38    HG2  PRO  12           2HG      PRO  12  -6.355   1.766  -4.575
   39    HG3  PRO  12           1HG      PRO  12  -6.586   1.775  -6.324
   40    HD2  PRO  12           2HD      PRO  12  -8.622   1.547  -4.550
   41    HD3  PRO  12           1HD      PRO  12  -8.677   0.851  -6.178
   42    H    LYS  13           H        LYS  13  -5.921  -3.378  -4.927
   43    HA   LYS  13           HA       LYS  13  -4.962  -3.223  -2.188
   44    HB2  LYS  13           2HB      LYS  13  -5.800  -5.505  -1.739
   45    HB3  LYS  13           1HB      LYS  13  -7.096  -4.350  -1.995
   46    HG2  LYS  13           2HG      LYS  13  -7.193  -5.219  -4.380
   47    HG3  LYS  13           1HG      LYS  13  -6.145  -6.527  -3.830
   48    HD2  LYS  13           2HD      LYS  13  -8.869  -5.825  -2.727
   49    HD3  LYS  13           1HD      LYS  13  -8.484  -7.206  -3.745
   50    HE2  LYS  13           2HE      LYS  13  -7.058  -8.133  -1.979
   51    HE3  LYS  13           1HE      LYS  13  -7.348  -6.710  -0.991
   52    HZ1  LYS  13           3HZ      LYS  13  -8.754  -8.519  -0.282
   53    HZ2  LYS  13           1HZ      LYS  13  -9.431  -8.656  -1.830
   54    HZ3  LYS  13           2HZ      LYS  13  -9.682  -7.276  -0.921
   55    H    CYS  14           H        CYS  14  -3.300  -4.751  -1.724
   56    HA   CYS  14           HA       CYS  14  -1.918  -5.668  -4.134
   57    HB2  CYS  14           2HB      CYS  14   0.173  -4.723  -3.242
   58    HB3  CYS  14           1HB      CYS  14  -1.032  -3.481  -3.582
   59    H    ARG  15           H        ARG  15   0.075  -6.871  -3.426
   60    HA   ARG  15           HA       ARG  15  -0.299  -8.448  -0.985
   61    HB2  ARG  15           2HB      ARG  15   0.298 -10.465  -2.366
   62    HB3  ARG  15           1HB      ARG  15  -1.287  -9.780  -2.718
   63    HG2  ARG  15           2HG      ARG  15  -0.360  -8.661  -4.668
   64    HG3  ARG  15           1HG      ARG  15   1.219  -9.376  -4.325
   65    HD2  ARG  15           2HD      ARG  15   0.321 -11.579  -4.636
   66    HD3  ARG  15           1HD      ARG  15  -1.305 -10.918  -4.844
   67    HE   ARG  15           HE       ARG  15   0.397  -9.733  -6.707
   68   HH11  ARG  15          1HH1      ARG  15  -1.010 -12.899  -6.042
   69   HH12  ARG  15          2HH1      ARG  15  -1.073 -13.374  -7.673
   70   HH21  ARG  15          1HH2      ARG  15   0.275 -10.331  -8.914
   71   HH22  ARG  15          2HH2      ARG  15  -0.319 -11.862  -9.375
   72    H    CYS  16           H        CYS  16   1.403  -6.300  -1.463
   73    HA   CYS  16           HA       CYS  16   4.002  -6.918  -2.321
   74    HB2  CYS  16           2HB      CYS  16   3.170  -4.906  -0.222
   75    HB3  CYS  16           1HB      CYS  16   4.693  -4.938  -1.103
   76    H    GLY  17           H        GLY  17   5.838  -7.521  -1.208
   77    HA2  GLY  17           2HA      GLY  17   7.093  -8.094   0.696
   78    HA3  GLY  17           1HA      GLY  17   5.602  -8.223   1.617
   79    H    ILE  18           H        ILE  18   4.531  -9.825  -0.756
   80    HA   ILE  18           HA       ILE  18   5.230 -12.360   0.365
   81    HB   ILE  18           HB       ILE  18   3.437 -11.725  -1.991
   82   HG12  ILE  18          2HG1      ILE  18   2.853 -12.235   0.928
   83   HG13  ILE  18          1HG1      ILE  18   2.569 -10.758   0.028
   84   HG21  ILE  18          1HG2      ILE  18   2.543 -13.996  -1.724
   85   HG22  ILE  18          2HG2      ILE  18   3.725 -14.311  -0.458
   86   HG23  ILE  18          3HG2      ILE  18   4.266 -14.027  -2.111
   87   HD11  ILE  18          3HD1      ILE  18   1.110 -13.372  -0.283
   88   HD12  ILE  18          1HD1      ILE  18   0.898 -11.987  -1.355
   89   HD13  ILE  18          2HD1      ILE  18   0.479 -11.852   0.348
   90    H    SER  19           H        SER  19   5.652 -10.865  -2.851
   91    HA   SER  19           HA       SER  19   7.697 -12.887  -3.368
   92    HB2  SER  19           2HB      SER  19   5.719 -11.876  -5.417
   93    HB3  SER  19           1HB      SER  19   6.933 -13.134  -5.646
   94    HG   SER  19           HG       SER  19   5.797 -14.238  -3.865
   95    H    GLY  20           H        GLY  20   9.093 -11.140  -2.609
   96    HA2  GLY  20           2HA      GLY  20  10.864  -9.804  -3.175
   97    HA3  GLY  20           1HA      GLY  20  10.306  -9.827  -4.834
   98    H    SER  21           H        SER  21   8.162  -8.564  -5.040
   99    HA   SER  21           HA       SER  21   7.169  -6.567  -5.249
  100    HB2  SER  21           2HB      SER  21   8.282  -6.009  -2.474
  101    HB3  SER  21           1HB      SER  21   7.005  -5.085  -3.273
  102    HG   SER  21           HG       SER  21   6.025  -7.304  -3.485
  103    H    SER  22           H        SER  22   7.751  -3.980  -5.054
  104    HA   SER  22           HA       SER  22  10.001  -3.711  -6.750
  105    HB2  SER  22           2HB      SER  22   8.340  -1.613  -5.354
  106    HB3  SER  22           1HB      SER  22   9.371  -1.378  -6.772
  107    HG   SER  22           HG       SER  22   8.049  -3.070  -7.752
  108    H    ASN  23           H        ASN  23   9.276  -3.031  -3.420
  109    HA   ASN  23           HA       ASN  23  12.059  -3.124  -2.752
  110    HB2  ASN  23           2HB      ASN  23  11.547  -0.678  -3.133
  111    HB3  ASN  23           1HB      ASN  23  10.284  -0.794  -1.916
  112   HD21  ASN  23          1HD2      ASN  23  12.677   0.870  -2.004
  113   HD22  ASN  23          2HD2      ASN  23  13.593   0.496  -0.585
  114    H    THR  24           H        THR  24  12.162  -4.341  -0.927
  115    HA   THR  24           HA       THR  24   9.724  -5.424   0.062
  116    HB   THR  24           HB       THR  24  12.556  -5.888   1.032
  117    HG1  THR  24           1HG      THR  24  11.012  -6.935  -1.114
  118   HG21  THR  24          3HG2      THR  24  10.064  -7.613   1.216
  119   HG22  THR  24          1HG2      THR  24  10.792  -6.736   2.556
  120   HG23  THR  24          2HG2      THR  24  11.673  -8.057   1.801
  121    H    LEU  25           H        LEU  25  11.893  -2.912   1.148
  122    HA   LEU  25           HA       LEU  25  10.778  -2.899   3.832
  123    HB2  LEU  25           2HB      LEU  25  12.602  -0.896   2.491
  124    HB3  LEU  25           1HB      LEU  25  12.098  -0.830   4.158
  125    HG   LEU  25           HG       LEU  25  13.332  -3.046   4.458
  126   HD11  LEU  25          1HD1      LEU  25  14.530  -2.217   1.825
  127   HD12  LEU  25          2HD1      LEU  25  13.558  -3.660   2.113
  128   HD13  LEU  25          3HD1      LEU  25  15.139  -3.489   2.882
  129   HD21  LEU  25          3HD2      LEU  25  14.865  -0.557   3.749
  130   HD22  LEU  25          1HD2      LEU  25  15.464  -1.898   4.722
  131   HD23  LEU  25          2HD2      LEU  25  14.125  -0.914   5.307
  132    H    THR  26           H        THR  26  10.666  -1.086   0.904
  133    HA   THR  26           HA       THR  26   8.712   0.836   1.969
  134    HB   THR  26           HB       THR  26  10.461   1.022  -0.514
  135    HG1  THR  26           1HG      THR  26  12.005   1.952   0.790
  136   HG21  THR  26          3HG2      THR  26   8.572   2.638  -0.365
  137   HG22  THR  26          1HG2      THR  26  10.138   3.438  -0.245
  138   HG23  THR  26          2HG2      THR  26   9.192   3.164   1.209
  139    H    THR  27           H        THR  27   7.759  -1.643   1.390
  140    HA   THR  27           HA       THR  27   7.136  -2.547  -1.094
  141    HB   THR  27           HB       THR  27   5.076  -3.358   0.176
  142    HG1  THR  27           1HG      THR  27   6.088  -3.071   2.627
  143   HG21  THR  27          3HG2      THR  27   7.845  -4.053   1.206
  144   HG22  THR  27          1HG2      THR  27   7.063  -4.763  -0.211
  145   HG23  THR  27          2HG2      THR  27   6.391  -5.037   1.390
  146    H    CYS  28           H        CYS  28   4.925  -0.948   1.003
  147    HA   CYS  28           HA       CYS  28   3.167  -0.289  -1.166
  148    HB2  CYS  28           2HB      CYS  28   2.809  -0.162   1.798
  149    HB3  CYS  28           1HB      CYS  28   1.531   0.162   0.612
  150    H    ARG  29           H        ARG  29   5.637   1.270   0.170
  151    HA   ARG  29           HA       ARG  29   4.333   3.879   0.194
  152    HB2  ARG  29           2HB      ARG  29   5.683   3.332   2.151
  153    HB3  ARG  29           1HB      ARG  29   7.092   3.069   1.142
  154    HG2  ARG  29           2HG      ARG  29   7.030   5.478   0.528
  155    HG3  ARG  29           1HG      ARG  29   5.670   5.675   1.613
  156    HD2  ARG  29           2HD      ARG  29   6.961   5.117   3.516
  157    HD3  ARG  29           1HD      ARG  29   8.326   4.597   2.528
  158    HE   ARG  29           HE       ARG  29   8.069   7.128   1.781
  159   HH11  ARG  29          1HH1      ARG  29   8.096   5.735   5.034
  160   HH12  ARG  29          2HH1      ARG  29   8.900   7.046   5.754
  161   HH21  ARG  29          1HH2      ARG  29   9.245   8.935   2.780
  162   HH22  ARG  29          2HH2      ARG  29   9.588   8.873   4.448
  163    H    ASN  30           H        ASN  30   5.852   2.025  -2.022
  164    HA   ASN  30           HA       ASN  30   7.017   4.379  -3.322
  165    HB2  ASN  30           2HB      ASN  30   8.428   3.004  -4.670
  166    HB3  ASN  30           1HB      ASN  30   8.523   2.325  -3.055
  167   HD21  ASN  30          1HD2      ASN  30   7.658   0.288  -2.677
  168   HD22  ASN  30          2HD2      ASN  30   7.162  -0.733  -3.977
  169    H    SER  31           H        SER  31   6.694   4.538  -5.686
  170    HA   SER  31           HA       SER  31   3.932   4.712  -6.106
  171    HB2  SER  31           2HB      SER  31   6.189   5.158  -8.037
  172    HB3  SER  31           1HB      SER  31   4.521   5.705  -8.234
  173    HG   SER  31           HG       SER  31   4.763   7.150  -6.759
  174    H    ARG  32           H        ARG  32   5.831   1.945  -6.595
  175    HA   ARG  32           HA       ARG  32   4.280   1.156  -8.907
  176    HB2  ARG  32           2HB      ARG  32   6.390  -0.390  -7.397
  177    HB3  ARG  32           1HB      ARG  32   5.606  -0.918  -8.878
  178    HG2  ARG  32           2HG      ARG  32   6.574   0.977 -10.075
  179    HG3  ARG  32           1HG      ARG  32   7.326   1.524  -8.576
  180    HD2  ARG  32           2HD      ARG  32   8.518  -0.653  -8.467
  181    HD3  ARG  32           1HD      ARG  32   7.874  -1.038 -10.063
  182    HE   ARG  32           HE       ARG  32   9.011   1.193 -10.653
  183   HH11  ARG  32          1HH1      ARG  32  10.304  -1.418  -8.650
  184   HH12  ARG  32          2HH1      ARG  32  11.930  -0.918  -8.746
  185   HH21  ARG  32          1HH2      ARG  32  11.294   1.845 -10.876
  186   HH22  ARG  32          2HH2      ARG  32  12.488   0.960 -10.055
  187    H    CYS  33           H        CYS  33   3.835   1.196  -5.642
  188    HA   CYS  33           HA       CYS  33   2.317  -1.250  -5.504
  189    HB2  CYS  33           2HB      CYS  33   3.457  -0.410  -3.476
  190    HB3  CYS  33           1HB      CYS  33   2.508   1.069  -3.549
  191    HA   PRO  34           HA       PRO  34  -1.141   0.615  -7.581
  192    HB2  PRO  34           2HB      PRO  34  -3.070  -1.133  -6.613
  193    HB3  PRO  34           1HB      PRO  34  -2.063  -1.420  -8.033
  194    HG2  PRO  34           2HG      PRO  34  -1.736  -2.413  -5.245
  195    HG3  PRO  34           1HG      PRO  34  -1.431  -3.251  -6.773
  196    HD2  PRO  34           2HD      PRO  34   0.561  -2.275  -5.290
  197    HD3  PRO  34           1HD      PRO  34   0.627  -2.223  -7.067
  198    H    CYS  35           H        CYS  35  -1.310  -0.194  -4.198
  199    HA   CYS  35           HA       CYS  35  -3.603   1.317  -3.549
  200    HB2  CYS  35           2HB      CYS  35  -1.273   0.469  -1.871
  201    HB3  CYS  35           1HB      CYS  35  -2.744   1.186  -1.226
  202    H    TYR  36           H        TYR  36  -0.203   2.012  -3.062
  203    HA   TYR  36           HA       TYR  36  -0.413   4.609  -2.108
  204    HB2  TYR  36           2HB      TYR  36   1.630   3.266  -2.013
  205    HB3  TYR  36           1HB      TYR  36   1.767   3.348  -3.764
  206    HD1  TYR  36           2HD      TYR  36   2.538   5.368  -4.846
  207    HD2  TYR  36           1HD      TYR  36   2.184   5.176  -0.625
  208    HE1  TYR  36           2HE      TYR  36   3.905   7.372  -4.672
  209    HE2  TYR  36           1HE      TYR  36   3.564   7.197  -0.410
  210    HH   TYR  36           HH       TYR  36   4.208   9.220  -2.966
  211    H    LYS  37           H        LYS  37   0.060   3.468  -5.433
  212    HA   LYS  37           HA       LYS  37   0.192   6.086  -6.521
  213    HB2  LYS  37           2HB      LYS  37   1.017   3.690  -7.382
  214    HB3  LYS  37           1HB      LYS  37  -0.514   3.740  -8.232
  215    HG2  LYS  37           2HG      LYS  37   1.598   5.878  -8.437
  216    HG3  LYS  37           1HG      LYS  37   1.485   4.516  -9.542
  217    HD2  LYS  37           2HD      LYS  37  -0.748   5.256 -10.234
  218    HD3  LYS  37           1HD      LYS  37  -0.659   6.596  -9.092
  219    HE2  LYS  37           2HE      LYS  37  -0.155   7.351 -11.355
  220    HE3  LYS  37           1HE      LYS  37   1.260   7.506 -10.321
  221    HZ1  LYS  37           3HZ      LYS  37   2.182   5.537 -11.308
  222    HZ2  LYS  37           1HZ      LYS  37   1.773   6.632 -12.507
  223    HZ3  LYS  37           2HZ      LYS  37   0.800   5.285 -12.256
  224    H    SER  38           H        SER  38  -2.463   3.845  -5.914
  225    HA   SER  38           HA       SER  38  -4.269   5.702  -7.245
  226    HB2  SER  38           2HB      SER  38  -4.738   2.879  -6.290
  227    HB3  SER  38           1HB      SER  38  -5.942   3.886  -7.100
  228    HG   SER  38           HG       SER  38  -4.264   4.060  -8.807
  229    H    TYR  39           H        TYR  39  -2.969   5.955  -4.540
  230    HA   TYR  39           HA       TYR  39  -3.429   7.240  -2.714
  231    HB2  TYR  39           2HB      TYR  39  -6.097   7.736  -4.031
  232    HB3  TYR  39           1HB      TYR  39  -5.357   8.729  -2.787
  233    HD1  TYR  39           2HD      TYR  39  -2.945   9.663  -3.429
  234    HD2  TYR  39           1HD      TYR  39  -5.847   8.330  -6.234
  235    HE1  TYR  39           2HE      TYR  39  -1.827  10.947  -5.191
  236    HE2  TYR  39           1HE      TYR  39  -4.734   9.609  -8.000
  237    HH   TYR  39           HH       TYR  39  -3.285  11.567  -8.157
  238    H    ASN  40           H        ASN  40  -4.102   4.413  -2.520
  239    HA   ASN  40           HA       ASN  40  -6.279   4.567  -0.549
  240    HB2  ASN  40           2HB      ASN  40  -5.754   2.535  -2.645
  241    HB3  ASN  40           1HB      ASN  40  -6.443   1.997  -1.117
  242   HD21  ASN  40          1HD2      ASN  40  -6.954   4.071  -3.916
  243   HD22  ASN  40          2HD2      ASN  40  -8.652   4.159  -3.723
  244    H    SER  41           H        SER  41  -6.187   3.313   1.329
  245    HA   SER  41           HA       SER  41  -3.670   2.803   2.405
  246    HB2  SER  41           2HB      SER  41  -6.337   1.958   3.396
  247    HB3  SER  41           1HB      SER  41  -4.932   2.542   4.268
  248    HG   SER  41           HG       SER  41  -5.292   4.560   3.718
  249    H    CYS  42           H        CYS  42  -3.664   0.583   3.680
  250    HA   CYS  42           HA       CYS  42  -4.136  -1.479   1.669
  251    HB2  CYS  42           2HB      CYS  42  -1.923  -1.218   3.656
  252    HB3  CYS  42           1HB      CYS  42  -2.288  -2.747   2.857
  253    H    ALA  43           H        ALA  43  -5.801  -0.517   4.002
  254    HA   ALA  43           HA       ALA  43  -6.228  -2.772   5.599
  255    HB1  ALA  43           1HB      ALA  43  -8.436  -1.809   6.032
  256    HB2  ALA  43           2HB      ALA  43  -8.216  -0.693   4.683
  257    HB3  ALA  43           3HB      ALA  43  -7.184  -0.569   6.111
  258    H    GLY  44           H        GLY  44  -6.526  -4.701   4.768
  259    HA2  GLY  44           2HA      GLY  44  -8.108  -6.246   3.833
  260    HA3  GLY  44           1HA      GLY  44  -8.577  -4.997   2.688
  261    H    CYS  45           H        CYS  45  -5.215  -5.212   3.168
  262    HA   CYS  45           HA       CYS  45  -4.956  -6.475   0.534
  263    HB2  CYS  45           2HB      CYS  45  -2.979  -4.864   2.140
  264    HB3  CYS  45           1HB      CYS  45  -2.644  -5.595   0.577
  265    H    HIS  46           H        HIS  46  -2.820  -7.703   0.277
  266    HA   HIS  46           HA       HIS  46  -2.599  -9.682   2.460
  267    HB2  HIS  46           2HB      HIS  46  -2.067  -9.873  -0.507
  268    HB3  HIS  46           1HB      HIS  46  -1.496 -11.092   0.612
  269    HD1  HIS  46           1HD      HIS  46  -3.236 -12.757   1.486
  270    HD2  HIS  46           2HD      HIS  46  -4.825  -9.858  -1.020
  271    HE1  HIS  46           1HE      HIS  46  -5.516 -13.572   0.885
  272    HE2  HIS  46           2HE      HIS  46  -6.228 -12.025  -0.933
  273    H    CYS  47           H        CYS  47  -1.246  -6.999   1.901
  274    HA   CYS  47           HA       CYS  47   1.467  -7.699   1.326
  275    HB2  CYS  47           2HB      CYS  47   1.950  -5.314   1.804
  276    HB3  CYS  47           1HB      CYS  47   0.808  -5.588   0.502
  277    H    VAL  48           H        VAL  48   3.071  -7.891   2.584
  278    HA   VAL  48           HA       VAL  48   2.709  -7.637   5.495
  279    HB   VAL  48           HB       VAL  48   4.490  -9.657   4.068
  280   HG11  VAL  48          1HG1      VAL  48   3.770  -9.380   6.982
  281   HG12  VAL  48          2HG1      VAL  48   5.336  -9.023   6.253
  282   HG13  VAL  48          3HG1      VAL  48   4.733 -10.682   6.287
  283   HG21  VAL  48          3HG2      VAL  48   1.834 -10.138   5.435
  284   HG22  VAL  48          1HG2      VAL  48   2.916 -11.391   4.824
  285   HG23  VAL  48          2HG2      VAL  48   2.159 -10.256   3.707
  286    H    GLY  49           H        GLY  49   4.238  -6.368   6.442
  287    HA2  GLY  49           2HA      GLY  49   6.228  -5.184   6.642
  288    HA3  GLY  49           1HA      GLY  49   6.726  -5.797   5.067
  289    H    CYS  50           H        CYS  50   3.642  -4.388   5.648
  290    HA   CYS  50           HA       CYS  50   3.858  -2.645   3.433
  291    HB2  CYS  50           2HB      CYS  50   1.797  -3.662   3.657
  292    HB3  CYS  50           1HB      CYS  50   1.726  -3.387   5.388
  293    H    LYS  51           H        LYS  51   4.932  -0.803   3.631
  294    HA   LYS  51           HA       LYS  51   4.282   0.908   5.946
  295    HB2  LYS  51           2HB      LYS  51   6.185   1.550   3.683
  296    HB3  LYS  51           1HB      LYS  51   6.063   2.359   5.228
  297    HG2  LYS  51           2HG      LYS  51   7.160  -0.391   4.726
  298    HG3  LYS  51           1HG      LYS  51   8.097   1.065   5.003
  299    HD2  LYS  51           2HD      LYS  51   7.003   1.213   7.257
  300    HD3  LYS  51           1HD      LYS  51   6.306  -0.381   6.937
  301    HE2  LYS  51           2HE      LYS  51   9.231   0.329   7.033
  302    HE3  LYS  51           1HE      LYS  51   8.352  -0.648   8.204
  303    HZ1  LYS  51           3HZ      LYS  51   7.979  -2.296   6.473
  304    HZ2  LYS  51           1HZ      LYS  51   9.618  -2.036   6.700
  305    HZ3  LYS  51           2HZ      LYS  51   8.855  -1.386   5.351
  306    H    ASN  52           H        ASN  52   2.141   1.433   5.177
  307    HA   ASN  52           HA       ASN  52   2.203   2.859   2.617
  308    HB2  ASN  52           2HB      ASN  52   0.537   0.947   2.873
  309    HB3  ASN  52           1HB      ASN  52  -0.284   1.940   4.070
  310   HD21  ASN  52          1HD2      ASN  52  -1.354   0.997   1.638
  311   HD22  ASN  52          2HD2      ASN  52  -1.794   2.385   0.701
  312    HA   PRO  53           HA       PRO  53   1.989   6.443   5.374
  313    HB2  PRO  53           2HB      PRO  53   1.971   7.879   2.790
  314    HB3  PRO  53           1HB      PRO  53   3.061   8.063   4.164
  315    HG2  PRO  53           2HG      PRO  53   3.873   6.902   1.907
  316    HG3  PRO  53           1HG      PRO  53   4.422   6.320   3.490
  317    HD2  PRO  53           2HD      PRO  53   2.366   5.183   1.651
  318    HD3  PRO  53           1HD      PRO  53   3.585   4.361   2.641
  319    H    HIS  54           H        HIS  54  -0.165   5.332   2.992
  320    HA   HIS  54           HA       HIS  54  -2.116   7.412   3.529
  321    HB2  HIS  54           2HB      HIS  54  -2.356   4.955   1.757
  322    HB3  HIS  54           1HB      HIS  54  -3.608   6.172   1.956
  323    HD1  HIS  54           1HD      HIS  54  -3.522   8.138   0.368
  324    HD2  HIS  54           2HD      HIS  54   0.030   5.971   0.437
  325    HE1  HIS  54           1HE      HIS  54  -2.129   9.055  -1.487
  326    HE2  HIS  54           2HE      HIS  54   0.102   8.021  -1.114
  327    H    LYS  55           H        LYS  55  -2.713   7.145   5.565
  328    HA   LYS  55           HA       LYS  55  -3.228   4.550   6.694
  329    HB2  LYS  55           2HB      LYS  55  -3.938   7.284   7.823
  330    HB3  LYS  55           1HB      LYS  55  -4.154   5.767   8.654
  331    HG2  LYS  55           2HG      LYS  55  -2.215   6.805   9.565
  332    HG3  LYS  55           1HG      LYS  55  -1.668   5.447   8.596
  333    HD2  LYS  55           2HD      LYS  55  -0.233   7.359   8.229
  334    HD3  LYS  55           1HD      LYS  55  -1.147   7.023   6.759
  335    HE2  LYS  55           2HE      LYS  55  -2.759   8.812   7.482
  336    HE3  LYS  55           1HE      LYS  55  -1.651   9.179   8.798
  337    HZ1  LYS  55           3HZ      LYS  55   0.048   9.729   7.165
  338    HZ2  LYS  55           1HZ      LYS  55  -1.362  10.609   6.892
  339    HZ3  LYS  55           2HZ      LYS  55  -0.987   9.289   5.916
  340    H    GLU  56           H        GLU  56  -5.189   3.684   7.101
  341    HA   GLU  56           HA       GLU  56  -7.198   4.472   5.292
  342    HB2  GLU  56           2HB      GLU  56  -8.551   2.644   6.690
  343    HB3  GLU  56           1HB      GLU  56  -7.380   2.206   5.466
  344    HG2  GLU  56           2HG      GLU  56  -6.732   2.410   8.374
  345    HG3  GLU  56           1HG      GLU  56  -7.291   0.907   7.627
  346    H    ASP  57           H        ASP  57  -8.536   5.905   5.474
  347    HA   ASP  57           HA       ASP  57  -8.870   7.456   7.838
  348    HB2  ASP  57           2HB      ASP  57 -10.511   7.552   5.288
  349    HB3  ASP  57           1HB      ASP  57 -10.539   8.764   6.558
  350    H    TYR  58           H        TYR  58 -10.462   4.897   6.479
  351    HA   TYR  58           HA       TYR  58 -12.735   5.148   8.270
  352    HB2  TYR  58           2HB      TYR  58 -13.783   3.299   6.994
  353    HB3  TYR  58           1HB      TYR  58 -13.297   4.594   5.918
  354    HD1  TYR  58           1HD      TYR  58 -11.089   4.251   4.581
  355    HD2  TYR  58           2HD      TYR  58 -13.096   1.101   6.622
  356    HE1  TYR  58           1HE      TYR  58  -9.876   2.597   3.223
  357    HE2  TYR  58           2HE      TYR  58 -11.896  -0.546   5.274
  358    HH   TYR  58           HH       TYR  58 -10.759  -0.743   3.317
  359    H    VAL  59           H        VAL  59 -12.174   4.534  10.221
  360    HA   VAL  59           HA       VAL  59 -11.049   1.877  10.465
  361    HB   VAL  59           HB       VAL  59 -10.017   2.695  12.710
  362   HG11  VAL  59          1HG1      VAL  59  -8.880   3.692  10.095
  363   HG12  VAL  59          2HG1      VAL  59  -8.667   2.076  10.767
  364   HG13  VAL  59          3HG1      VAL  59  -7.969   3.472  11.590
  365   HG21  VAL  59          3HG2      VAL  59 -11.143   4.875  12.781
  366   HG22  VAL  59          1HG2      VAL  59 -10.308   5.363  11.309
  367   HG23  VAL  59          2HG2      VAL  59  -9.391   5.068  12.790
  Start of MODEL   16
    1    H1   SER   8           1HT      SER   8 -19.266  -0.219  -2.085
    2    H2   SER   8           2HT      SER   8 -19.882   0.108  -3.630
    3    H3   SER   8           3HT      SER   8 -19.760   1.339  -2.491
    4    HA   SER   8           HA       SER   8 -18.035   1.519  -4.088
    5    HB2  SER   8           2HB      SER   8 -17.664   2.240  -1.735
    6    HB3  SER   8           1HB      SER   8 -17.087   0.624  -1.338
    7    HG   SER   8           HG       SER   8 -15.274   0.971  -2.416
    8    HA   PRO   9           HA       PRO   9 -16.897  -2.536  -5.636
    9    HB2  PRO   9           2HB      PRO   9 -15.128  -1.632  -7.531
   10    HB3  PRO   9           1HB      PRO   9 -16.875  -1.663  -7.781
   11    HG2  PRO   9           2HG      PRO   9 -15.119   0.614  -6.970
   12    HG3  PRO   9           1HG      PRO   9 -16.458   0.597  -8.132
   13    HD2  PRO   9           2HD      PRO   9 -16.746   1.560  -5.646
   14    HD3  PRO   9           1HD      PRO   9 -18.065   0.694  -6.465
   15    HA   PRO  10           HA       PRO  10 -13.270  -3.438  -3.212
   16    HB2  PRO  10           2HB      PRO  10 -12.551  -5.109  -5.583
   17    HB3  PRO  10           1HB      PRO  10 -12.548  -5.538  -3.866
   18    HG2  PRO  10           2HG      PRO  10 -14.512  -6.370  -5.428
   19    HG3  PRO  10           1HG      PRO  10 -14.856  -5.783  -3.790
   20    HD2  PRO  10           2HD      PRO  10 -15.322  -4.440  -6.412
   21    HD3  PRO  10           1HD      PRO  10 -16.267  -4.373  -4.910
   22    H    LYS  11           H        LYS  11 -11.572  -2.265  -3.006
   23    HA   LYS  11           HA       LYS  11 -10.411  -0.724  -5.133
   24    HB2  LYS  11           2HB      LYS  11  -8.883   0.093  -3.378
   25    HB3  LYS  11           1HB      LYS  11 -10.553   0.134  -2.829
   26    HG2  LYS  11           2HG      LYS  11 -10.228  -1.838  -1.500
   27    HG3  LYS  11           1HG      LYS  11  -8.611  -2.063  -2.152
   28    HD2  LYS  11           2HD      LYS  11  -8.378  -1.154   0.047
   29    HD3  LYS  11           1HD      LYS  11  -7.963   0.112  -1.091
   30    HE2  LYS  11           2HE      LYS  11 -10.684  -0.127   0.203
   31    HE3  LYS  11           1HE      LYS  11  -9.371   0.793   0.916
   32    HZ1  LYS  11           3HZ      LYS  11  -9.390   2.222  -1.095
   33    HZ2  LYS  11           1HZ      LYS  11 -10.842   2.212  -0.264
   34    HZ3  LYS  11           2HZ      LYS  11 -10.735   1.367  -1.687
   35    HA   PRO  12           HA       PRO  12  -7.246  -3.643  -6.121
   36    HB2  PRO  12           2HB      PRO  12  -5.086  -1.798  -6.203
   37    HB3  PRO  12           1HB      PRO  12  -5.919  -2.588  -7.532
   38    HG2  PRO  12           2HG      PRO  12  -6.092   0.143  -6.982
   39    HG3  PRO  12           1HG      PRO  12  -7.261  -0.772  -7.940
   40    HD2  PRO  12           2HD      PRO  12  -7.446   0.156  -5.123
   41    HD3  PRO  12           1HD      PRO  12  -8.726  -0.121  -6.317
   42    H    LYS  13           H        LYS  13  -6.202  -4.883  -4.943
   43    HA   LYS  13           HA       LYS  13  -5.154  -3.868  -2.418
   44    HB2  LYS  13           2HB      LYS  13  -5.735  -6.099  -1.415
   45    HB3  LYS  13           1HB      LYS  13  -7.091  -5.078  -1.853
   46    HG2  LYS  13           2HG      LYS  13  -7.258  -6.444  -3.989
   47    HG3  LYS  13           1HG      LYS  13  -6.111  -7.562  -3.252
   48    HD2  LYS  13           2HD      LYS  13  -8.798  -6.770  -2.110
   49    HD3  LYS  13           1HD      LYS  13  -8.424  -8.300  -2.901
   50    HE2  LYS  13           2HE      LYS  13  -6.909  -8.902  -1.150
   51    HE3  LYS  13           1HE      LYS  13  -7.048  -7.306  -0.413
   52    HZ1  LYS  13           3HZ      LYS  13  -9.209  -9.336  -0.613
   53    HZ2  LYS  13           1HZ      LYS  13  -9.381  -7.779   0.017
   54    HZ3  LYS  13           2HZ      LYS  13  -8.373  -8.865   0.771
   55    H    CYS  14           H        CYS  14  -3.190  -4.025  -2.061
   56    HA   CYS  14           HA       CYS  14  -1.512  -5.243  -4.049
   57    HB2  CYS  14           2HB      CYS  14   0.322  -4.032  -2.902
   58    HB3  CYS  14           1HB      CYS  14  -1.020  -3.008  -3.358
   59    H    ARG  15           H        ARG  15   0.360  -6.444  -3.546
   60    HA   ARG  15           HA       ARG  15  -0.014  -8.419  -1.376
   61    HB2  ARG  15           2HB      ARG  15   0.868  -8.886  -4.241
   62    HB3  ARG  15           1HB      ARG  15   0.633 -10.122  -3.011
   63    HG2  ARG  15           2HG      ARG  15  -1.712  -9.760  -2.969
   64    HG3  ARG  15           1HG      ARG  15  -1.571  -8.320  -3.972
   65    HD2  ARG  15           2HD      ARG  15  -2.391 -10.157  -5.302
   66    HD3  ARG  15           1HD      ARG  15  -0.762  -9.733  -5.820
   67    HE   ARG  15           HE       ARG  15  -0.747 -11.797  -3.887
   68   HH11  ARG  15          1HH1      ARG  15  -1.362 -11.154  -7.316
   69   HH12  ARG  15          2HH1      ARG  15  -0.968 -12.714  -7.845
   70   HH21  ARG  15          1HH2      ARG  15  -0.209 -14.010  -4.630
   71   HH22  ARG  15          2HH2      ARG  15  -0.326 -14.367  -6.295
   72    H    CYS  16           H        CYS  16   1.571  -6.019  -1.646
   73    HA   CYS  16           HA       CYS  16   4.239  -6.279  -2.372
   74    HB2  CYS  16           2HB      CYS  16   3.161  -4.633  -0.081
   75    HB3  CYS  16           1HB      CYS  16   4.637  -4.346  -0.996
   76    H    GLY  17           H        GLY  17   5.861  -7.423  -1.556
   77    HA2  GLY  17           2HA      GLY  17   7.222  -7.914   0.435
   78    HA3  GLY  17           1HA      GLY  17   5.708  -8.293   1.263
   79    H    ILE  18           H        ILE  18   4.380  -9.614  -0.603
   80    HA   ILE  18           HA       ILE  18   5.738 -12.171  -0.774
   81    HB   ILE  18           HB       ILE  18   3.024 -11.354  -1.879
   82   HG12  ILE  18          2HG1      ILE  18   3.692 -12.527   0.830
   83   HG13  ILE  18          1HG1      ILE  18   3.175 -10.881   0.524
   84   HG21  ILE  18          1HG2      ILE  18   4.154 -14.069  -1.161
   85   HG22  ILE  18          2HG2      ILE  18   3.909 -13.449  -2.791
   86   HG23  ILE  18          3HG2      ILE  18   2.519 -13.760  -1.748
   87   HD11  ILE  18          3HD1      ILE  18   1.027 -11.663  -0.269
   88   HD12  ILE  18          1HD1      ILE  18   1.351 -12.238   1.368
   89   HD13  ILE  18          2HD1      ILE  18   1.531 -13.334  -0.007
   90    H    SER  19           H        SER  19   4.378  -9.659  -2.778
   91    HA   SER  19           HA       SER  19   5.878 -10.606  -5.089
   92    HB2  SER  19           2HB      SER  19   3.331 -10.254  -5.198
   93    HB3  SER  19           1HB      SER  19   3.655  -8.538  -4.975
   94    HG   SER  19           HG       SER  19   4.480 -10.222  -7.073
   95    H    GLY  20           H        GLY  20   7.416  -9.177  -5.964
   96    HA2  GLY  20           2HA      GLY  20   8.415  -7.193  -4.114
   97    HA3  GLY  20           1HA      GLY  20   9.190  -7.723  -5.602
   98    H    SER  21           H        SER  21   9.263  -5.111  -5.054
   99    HA   SER  21           HA       SER  21   7.703  -3.990  -7.182
  100    HB2  SER  21           2HB      SER  21   6.276  -3.976  -4.994
  101    HB3  SER  21           1HB      SER  21   7.352  -2.670  -4.491
  102    HG   SER  21           HG       SER  21   6.361  -1.357  -5.856
  103    H    SER  22           H        SER  22   9.646  -3.094  -4.302
  104    HA   SER  22           HA       SER  22  11.620  -1.874  -6.024
  105    HB2  SER  22           2HB      SER  22  11.642   0.184  -4.523
  106    HB3  SER  22           1HB      SER  22  10.209   0.044  -5.541
  107    HG   SER  22           HG       SER  22  10.275   0.278  -2.902
  108    H    ASN  23           H        ASN  23  10.892  -1.751  -2.603
  109    HA   ASN  23           HA       ASN  23  13.068  -3.564  -1.943
  110    HB2  ASN  23           2HB      ASN  23  12.765  -0.753  -0.838
  111    HB3  ASN  23           1HB      ASN  23  13.775  -1.978  -0.101
  112   HD21  ASN  23          1HD2      ASN  23  15.651  -2.641  -1.220
  113   HD22  ASN  23          2HD2      ASN  23  16.381  -1.608  -2.390
  114    H    THR  24           H        THR  24  12.840  -4.243   0.313
  115    HA   THR  24           HA       THR  24  10.157  -4.800   0.948
  116    HB   THR  24           HB       THR  24  12.625  -5.127   2.684
  117    HG1  THR  24           1HG      THR  24  13.175  -6.766   1.420
  118   HG21  THR  24          3HG2      THR  24  10.046  -6.718   2.491
  119   HG22  THR  24          1HG2      THR  24  10.453  -5.594   3.790
  120   HG23  THR  24          2HG2      THR  24  11.395  -7.071   3.568
  121    H    LEU  25           H        LEU  25  12.517  -2.442   1.989
  122    HA   LEU  25           HA       LEU  25  11.160  -1.423   4.261
  123    HB2  LEU  25           2HB      LEU  25  13.111  -0.039   2.423
  124    HB3  LEU  25           1HB      LEU  25  12.586   0.580   3.973
  125    HG   LEU  25           HG       LEU  25  14.210  -1.927   3.520
  126   HD11  LEU  25          1HD1      LEU  25  14.970   0.739   4.694
  127   HD12  LEU  25          2HD1      LEU  25  15.476   0.104   3.128
  128   HD13  LEU  25          3HD1      LEU  25  16.000  -0.691   4.613
  129   HD21  LEU  25          3HD2      LEU  25  14.435  -1.951   5.960
  130   HD22  LEU  25          1HD2      LEU  25  12.765  -2.186   5.446
  131   HD23  LEU  25          2HD2      LEU  25  13.284  -0.620   6.072
  132    H    THR  26           H        THR  26  10.709  -0.898   0.855
  133    HA   THR  26           HA       THR  26   8.832   1.254   1.472
  134    HB   THR  26           HB       THR  26   9.350   2.041  -0.895
  135    HG1  THR  26           1HG      THR  26  11.778   1.328  -1.172
  136   HG21  THR  26          3HG2      THR  26  11.358   3.267  -0.175
  137   HG22  THR  26          1HG2      THR  26  11.548   2.151   1.179
  138   HG23  THR  26          2HG2      THR  26  10.143   3.214   1.101
  139    H    THR  27           H        THR  27   8.121  -1.541   1.419
  140    HA   THR  27           HA       THR  27   7.268  -2.695  -0.869
  141    HB   THR  27           HB       THR  27   5.282  -3.364   0.788
  142    HG1  THR  27           1HG      THR  27   6.903  -3.214   2.856
  143   HG21  THR  27          3HG2      THR  27   8.152  -4.268   1.113
  144   HG22  THR  27          1HG2      THR  27   7.010  -4.877  -0.095
  145   HG23  THR  27          2HG2      THR  27   6.699  -5.160   1.609
  146    H    CYS  28           H        CYS  28   5.104  -0.858   1.200
  147    HA   CYS  28           HA       CYS  28   3.370  -0.352  -1.045
  148    HB2  CYS  28           2HB      CYS  28   3.012   0.134   1.888
  149    HB3  CYS  28           1HB      CYS  28   1.830   0.605   0.663
  150    H    ARG  29           H        ARG  29   5.982   1.108   0.045
  151    HA   ARG  29           HA       ARG  29   4.953   3.858  -0.038
  152    HB2  ARG  29           2HB      ARG  29   6.387   2.927   1.876
  153    HB3  ARG  29           1HB      ARG  29   7.729   2.990   0.747
  154    HG2  ARG  29           2HG      ARG  29   7.364   5.425   0.501
  155    HG3  ARG  29           1HG      ARG  29   6.071   5.314   1.678
  156    HD2  ARG  29           2HD      ARG  29   7.622   4.490   3.363
  157    HD3  ARG  29           1HD      ARG  29   8.945   4.574   2.207
  158    HE   ARG  29           HE       ARG  29   7.595   7.053   2.474
  159   HH11  ARG  29          1HH1      ARG  29  10.027   5.013   4.066
  160   HH12  ARG  29          2HH1      ARG  29  10.824   6.305   4.820
  161   HH21  ARG  29          1HH2      ARG  29   8.705   8.836   3.509
  162   HH22  ARG  29          2HH2      ARG  29  10.082   8.547   4.459
  163    H    ASN  30           H        ASN  30   5.327   2.243  -2.462
  164    HA   ASN  30           HA       ASN  30   7.138   4.079  -3.834
  165    HB2  ASN  30           2HB      ASN  30   8.047   2.336  -5.272
  166    HB3  ASN  30           1HB      ASN  30   8.331   1.890  -3.595
  167   HD21  ASN  30          1HD2      ASN  30   7.243   0.174  -2.753
  168   HD22  ASN  30          2HD2      ASN  30   6.341  -0.956  -3.660
  169    H    SER  31           H        SER  31   6.700   4.148  -6.193
  170    HA   SER  31           HA       SER  31   4.001   4.799  -6.541
  171    HB2  SER  31           2HB      SER  31   6.181   4.594  -8.590
  172    HB3  SER  31           1HB      SER  31   4.692   5.539  -8.712
  173    HG   SER  31           HG       SER  31   6.865   6.471  -7.908
  174    H    ARG  32           H        ARG  32   5.347   1.710  -6.797
  175    HA   ARG  32           HA       ARG  32   3.612   0.947  -9.022
  176    HB2  ARG  32           2HB      ARG  32   5.605  -0.695  -7.470
  177    HB3  ARG  32           1HB      ARG  32   4.731  -1.218  -8.897
  178    HG2  ARG  32           2HG      ARG  32   5.888   0.458 -10.231
  179    HG3  ARG  32           1HG      ARG  32   6.756   1.007  -8.789
  180    HD2  ARG  32           2HD      ARG  32   8.127  -0.520 -10.118
  181    HD3  ARG  32           1HD      ARG  32   7.747  -1.206  -8.537
  182    HE   ARG  32           HE       ARG  32   5.877  -1.913 -10.559
  183   HH11  ARG  32          1HH1      ARG  32   8.970  -2.883  -9.102
  184   HH12  ARG  32          2HH1      ARG  32   8.894  -4.461  -9.742
  185   HH21  ARG  32          1HH2      ARG  32   5.769  -4.049 -11.311
  186   HH22  ARG  32          2HH2      ARG  32   7.021  -5.167 -11.007
  187    H    CYS  33           H        CYS  33   3.310   1.411  -5.836
  188    HA   CYS  33           HA       CYS  33   1.722  -0.953  -5.325
  189    HB2  CYS  33           2HB      CYS  33   3.201  -0.173  -3.523
  190    HB3  CYS  33           1HB      CYS  33   2.392   1.390  -3.521
  191    HA   PRO  34           HA       PRO  34  -1.904   1.192  -6.883
  192    HB2  PRO  34           2HB      PRO  34  -3.688  -0.585  -5.787
  193    HB3  PRO  34           1HB      PRO  34  -2.936  -0.782  -7.378
  194    HG2  PRO  34           2HG      PRO  34  -2.287  -2.045  -4.761
  195    HG3  PRO  34           1HG      PRO  34  -2.157  -2.726  -6.391
  196    HD2  PRO  34           2HD      PRO  34  -0.013  -1.900  -4.988
  197    HD3  PRO  34           1HD      PRO  34  -0.089  -1.768  -6.759
  198    H    CYS  35           H        CYS  35  -1.148   0.618  -3.682
  199    HA   CYS  35           HA       CYS  35  -3.412   2.103  -2.677
  200    HB2  CYS  35           2HB      CYS  35  -1.047   0.828  -1.379
  201    HB3  CYS  35           1HB      CYS  35  -2.189   1.823  -0.481
  202    H    TYR  36           H        TYR  36   0.047   2.422  -2.794
  203    HA   TYR  36           HA       TYR  36   0.214   5.037  -1.818
  204    HB2  TYR  36           2HB      TYR  36   2.124   3.477  -1.984
  205    HB3  TYR  36           1HB      TYR  36   2.075   3.632  -3.734
  206    HD1  TYR  36           1HD      TYR  36   2.871   5.659  -4.830
  207    HD2  TYR  36           2HD      TYR  36   2.975   5.266  -0.600
  208    HE1  TYR  36           1HE      TYR  36   4.355   7.575  -4.718
  209    HE2  TYR  36           2HE      TYR  36   4.477   7.195  -0.449
  210    HH   TYR  36           HH       TYR  36   5.981   8.464  -1.762
  211    H    LYS  37           H        LYS  37   0.322   3.889  -5.208
  212    HA   LYS  37           HA       LYS  37   0.417   6.625  -6.101
  213    HB2  LYS  37           2HB      LYS  37   1.736   4.719  -7.119
  214    HB3  LYS  37           1HB      LYS  37   0.235   4.146  -7.819
  215    HG2  LYS  37           2HG      LYS  37   1.355   6.882  -8.363
  216    HG3  LYS  37           1HG      LYS  37   1.804   5.477  -9.315
  217    HD2  LYS  37           2HD      LYS  37  -0.559   5.152  -9.964
  218    HD3  LYS  37           1HD      LYS  37  -1.014   6.541  -8.981
  219    HE2  LYS  37           2HE      LYS  37   0.860   6.653 -11.342
  220    HE3  LYS  37           1HE      LYS  37  -0.854   7.039 -11.407
  221    HZ1  LYS  37           3HZ      LYS  37  -0.478   8.868  -9.873
  222    HZ2  LYS  37           1HZ      LYS  37   0.540   9.004 -11.196
  223    HZ3  LYS  37           2HZ      LYS  37   1.152   8.477  -9.728
  224    H    SER  38           H        SER  38  -2.027   4.057  -6.103
  225    HA   SER  38           HA       SER  38  -3.807   5.700  -7.681
  226    HB2  SER  38           2HB      SER  38  -4.282   3.034  -6.359
  227    HB3  SER  38           1HB      SER  38  -5.318   3.783  -7.572
  228    HG   SER  38           HG       SER  38  -3.535   3.714  -8.989
  229    H    TYR  39           H        TYR  39  -2.892   5.777  -4.612
  230    HA   TYR  39           HA       TYR  39  -3.571   6.651  -2.728
  231    HB2  TYR  39           2HB      TYR  39  -5.696   7.992  -4.389
  232    HB3  TYR  39           1HB      TYR  39  -5.316   8.427  -2.728
  233    HD1  TYR  39           1HD      TYR  39  -3.132   9.490  -2.211
  234    HD2  TYR  39           2HD      TYR  39  -4.324   8.687  -6.202
  235    HE1  TYR  39           1HE      TYR  39  -1.393  11.042  -3.042
  236    HE2  TYR  39           2HE      TYR  39  -2.613  10.218  -7.037
  237    HH   TYR  39           HH       TYR  39  -0.111  11.434  -5.090
  238    H    ASN  40           H        ASN  40  -4.082   4.355  -2.409
  239    HA   ASN  40           HA       ASN  40  -6.743   4.255  -1.180
  240    HB2  ASN  40           2HB      ASN  40  -5.354   1.927  -2.562
  241    HB3  ASN  40           1HB      ASN  40  -6.697   1.742  -1.454
  242   HD21  ASN  40          1HD2      ASN  40  -5.705   2.549  -4.622
  243   HD22  ASN  40          2HD2      ASN  40  -7.281   2.757  -5.291
  244    H    SER  41           H        SER  41  -6.828   2.849   0.702
  245    HA   SER  41           HA       SER  41  -4.308   2.898   2.133
  246    HB2  SER  41           2HB      SER  41  -5.919   2.591   4.107
  247    HB3  SER  41           1HB      SER  41  -5.983   4.132   3.244
  248    HG   SER  41           HG       SER  41  -8.042   3.104   3.710
  249    H    CYS  42           H        CYS  42  -3.819   1.004   3.491
  250    HA   CYS  42           HA       CYS  42  -4.435  -1.397   2.044
  251    HB2  CYS  42           2HB      CYS  42  -2.457  -0.841   4.236
  252    HB3  CYS  42           1HB      CYS  42  -2.789  -2.478   3.668
  253    H    ALA  43           H        ALA  43  -6.581  -1.052   2.705
  254    HA   ALA  43           HA       ALA  43  -7.200  -2.309   5.274
  255    HB1  ALA  43           1HB      ALA  43  -8.425  -0.244   4.758
  256    HB2  ALA  43           2HB      ALA  43  -9.523  -1.620   4.860
  257    HB3  ALA  43           3HB      ALA  43  -9.051  -0.983   3.285
  258    H    GLY  44           H        GLY  44  -6.815  -4.420   4.952
  259    HA2  GLY  44           2HA      GLY  44  -7.684  -6.535   4.454
  260    HA3  GLY  44           1HA      GLY  44  -8.631  -5.822   3.157
  261    H    CYS  45           H        CYS  45  -5.427  -4.784   3.084
  262    HA   CYS  45           HA       CYS  45  -4.900  -6.295   0.684
  263    HB2  CYS  45           2HB      CYS  45  -3.050  -4.479   2.250
  264    HB3  CYS  45           1HB      CYS  45  -2.727  -5.156   0.667
  265    H    HIS  46           H        HIS  46  -3.134  -7.771   0.429
  266    HA   HIS  46           HA       HIS  46  -2.565  -9.172   2.934
  267    HB2  HIS  46           2HB      HIS  46  -2.735 -10.232   0.123
  268    HB3  HIS  46           1HB      HIS  46  -2.050 -11.168   1.443
  269    HD1  HIS  46           1HD      HIS  46  -3.731 -11.770   3.430
  270    HD2  HIS  46           2HD      HIS  46  -5.493 -10.259  -0.012
  271    HE1  HIS  46           1HE      HIS  46  -6.175 -12.317   3.621
  272    HE2  HIS  46           2HE      HIS  46  -7.229 -11.218   1.620
  273    H    CYS  47           H        CYS  47  -1.170  -6.939   1.859
  274    HA   CYS  47           HA       CYS  47   1.425  -7.880   1.130
  275    HB2  CYS  47           2HB      CYS  47   2.052  -5.465   1.716
  276    HB3  CYS  47           1HB      CYS  47   1.008  -5.695   0.330
  277    H    VAL  48           H        VAL  48   3.261  -7.854   2.460
  278    HA   VAL  48           HA       VAL  48   2.553  -8.385   5.258
  279    HB   VAL  48           HB       VAL  48   4.940  -9.398   3.684
  280   HG11  VAL  48          1HG1      VAL  48   5.311 -10.909   5.574
  281   HG12  VAL  48          2HG1      VAL  48   3.975 -10.158   6.438
  282   HG13  VAL  48          3HG1      VAL  48   5.424  -9.220   6.072
  283   HG21  VAL  48          3HG2      VAL  48   3.811 -11.582   3.748
  284   HG22  VAL  48          1HG2      VAL  48   2.862 -10.378   2.877
  285   HG23  VAL  48          2HG2      VAL  48   2.417 -10.829   4.521
  286    H    GLY  49           H        GLY  49   3.088  -6.868   6.632
  287    HA2  GLY  49           2HA      GLY  49   4.245  -5.257   7.777
  288    HA3  GLY  49           1HA      GLY  49   5.690  -5.919   7.035
  289    H    CYS  50           H        CYS  50   2.939  -4.426   5.448
  290    HA   CYS  50           HA       CYS  50   4.552  -3.048   3.614
  291    HB2  CYS  50           2HB      CYS  50   2.563  -2.124   2.765
  292    HB3  CYS  50           1HB      CYS  50   2.178  -3.772   3.260
  293    H    LYS  51           H        LYS  51   5.284  -1.025   3.586
  294    HA   LYS  51           HA       LYS  51   4.485   0.685   5.814
  295    HB2  LYS  51           2HB      LYS  51   6.884   0.925   3.982
  296    HB3  LYS  51           1HB      LYS  51   6.488   2.031   5.288
  297    HG2  LYS  51           2HG      LYS  51   7.205  -0.873   5.576
  298    HG3  LYS  51           1HG      LYS  51   8.225   0.511   5.971
  299    HD2  LYS  51           2HD      LYS  51   6.634   1.206   7.700
  300    HD3  LYS  51           1HD      LYS  51   5.575  -0.137   7.280
  301    HE2  LYS  51           2HE      LYS  51   8.367  -0.350   8.378
  302    HE3  LYS  51           1HE      LYS  51   6.872  -0.644   9.263
  303    HZ1  LYS  51           3HZ      LYS  51   6.402  -2.482   7.735
  304    HZ2  LYS  51           1HZ      LYS  51   7.857  -2.698   8.558
  305    HZ3  LYS  51           2HZ      LYS  51   7.866  -2.208   6.947
  306    H    ASN  52           H        ASN  52   2.644   1.446   5.088
  307    HA   ASN  52           HA       ASN  52   2.703   2.916   2.557
  308    HB2  ASN  52           2HB      ASN  52   0.935   1.134   2.758
  309    HB3  ASN  52           1HB      ASN  52   0.288   1.973   4.155
  310   HD21  ASN  52          1HD2      ASN  52  -1.092   1.353   1.733
  311   HD22  ASN  52          2HD2      ASN  52  -1.580   2.866   1.044
  312    HA   PRO  53           HA       PRO  53   3.092   6.387   5.349
  313    HB2  PRO  53           2HB      PRO  53   2.159   7.723   2.856
  314    HB3  PRO  53           1HB      PRO  53   3.487   8.177   3.934
  315    HG2  PRO  53           2HG      PRO  53   4.000   6.994   1.631
  316    HG3  PRO  53           1HG      PRO  53   4.891   6.530   3.092
  317    HD2  PRO  53           2HD      PRO  53   2.718   5.090   1.659
  318    HD3  PRO  53           1HD      PRO  53   4.127   4.451   2.518
  319    H    HIS  54           H        HIS  54   0.275   5.837   3.237
  320    HA   HIS  54           HA       HIS  54  -1.259   7.238   5.241
  321    HB2  HIS  54           2HB      HIS  54  -2.891   7.760   3.516
  322    HB3  HIS  54           1HB      HIS  54  -1.342   8.571   3.317
  323    HD1  HIS  54           1HD      HIS  54  -3.884   6.809   1.528
  324    HD2  HIS  54           2HD      HIS  54   0.225   7.149   1.128
  325    HE1  HIS  54           1HE      HIS  54  -3.393   6.187  -0.840
  326    HE2  HIS  54           2HE      HIS  54  -1.009   6.930  -1.090
  327    H    LYS  55           H        LYS  55  -2.026   5.855   6.461
  328    HA   LYS  55           HA       LYS  55  -4.137   4.217   5.746
  329    HB2  LYS  55           2HB      LYS  55  -3.143   2.019   6.530
  330    HB3  LYS  55           1HB      LYS  55  -2.586   2.554   4.956
  331    HG2  LYS  55           2HG      LYS  55  -0.693   1.672   6.028
  332    HG3  LYS  55           1HG      LYS  55  -0.513   3.415   6.171
  333    HD2  LYS  55           2HD      LYS  55  -1.395   3.268   8.479
  334    HD3  LYS  55           1HD      LYS  55  -1.486   1.514   8.305
  335    HE2  LYS  55           2HE      LYS  55   0.551   2.076   9.462
  336    HE3  LYS  55           1HE      LYS  55   0.946   1.480   7.854
  337    HZ1  LYS  55           3HZ      LYS  55   1.240   3.786   7.116
  338    HZ2  LYS  55           1HZ      LYS  55   2.238   3.413   8.425
  339    HZ3  LYS  55           2HZ      LYS  55   0.854   4.314   8.694
  340    H    GLU  56           H        GLU  56  -4.469   2.691   7.953
  341    HA   GLU  56           HA       GLU  56  -4.637   4.820   9.882
  342    HB2  GLU  56           2HB      GLU  56  -6.622   3.467   9.302
  343    HB3  GLU  56           1HB      GLU  56  -5.823   2.044   9.949
  344    HG2  GLU  56           2HG      GLU  56  -5.986   2.821  12.149
  345    HG3  GLU  56           1HG      GLU  56  -6.337   4.468  11.630
  346    H    ASP  57           H        ASP  57  -2.868   5.129  10.934
  347    HA   ASP  57           HA       ASP  57  -1.167   2.978  11.884
  348    HB2  ASP  57           2HB      ASP  57  -0.982   5.991  12.039
  349    HB3  ASP  57           1HB      ASP  57   0.132   4.950  12.907
  350    H    TYR  58           H        TYR  58  -1.225   2.132  13.926
  351    HA   TYR  58           HA       TYR  58  -3.214   3.305  15.628
  352    HB2  TYR  58           2HB      TYR  58  -1.930   0.581  15.682
  353    HB3  TYR  58           1HB      TYR  58  -3.078   1.168  16.878
  354    HD1  TYR  58           2HD      TYR  58  -5.400   1.752  16.176
  355    HD2  TYR  58           1HD      TYR  58  -2.664  -0.162  13.560
  356    HE1  TYR  58           2HE      TYR  58  -7.264   1.126  14.706
  357    HE2  TYR  58           1HE      TYR  58  -4.519  -0.793  12.069
  358    HH   TYR  58           HH       TYR  58  -7.576   0.593  12.345
  359    H    VAL  59           H        VAL  59  -2.673   4.640  16.979
  360    HA   VAL  59           HA       VAL  59  -0.200   4.368  18.438
  361    HB   VAL  59           HB       VAL  59   0.124   6.227  16.935
  362   HG11  VAL  59          1HG1      VAL  59  -1.367   8.169  16.788
  363   HG12  VAL  59          2HG1      VAL  59  -2.513   7.354  17.849
  364   HG13  VAL  59          3HG1      VAL  59  -2.153   6.678  16.262
  365   HG21  VAL  59          3HG2      VAL  59  -0.605   7.262  19.670
  366   HG22  VAL  59          1HG2      VAL  59   0.353   8.140  18.481
  367   HG23  VAL  59          2HG2      VAL  59   0.960   6.631  19.155
  Start of MODEL   17
    1    H1   SER   8           1HT      SER   8 -19.652   2.179   0.385
    2    H2   SER   8           2HT      SER   8 -19.545   1.575  -1.199
    3    H3   SER   8           3HT      SER   8 -19.254   3.214  -0.901
    4    HA   SER   8           HA       SER   8 -17.316   2.661   0.333
    5    HB2  SER   8           2HB      SER   8 -16.582   0.270   0.305
    6    HB3  SER   8           1HB      SER   8 -18.052   0.524   1.241
    7    HG   SER   8           HG       SER   8 -17.670  -0.693  -1.247
    8    HA   PRO   9           HA       PRO   9 -15.798   2.929  -3.862
    9    HB2  PRO   9           2HB      PRO   9 -13.414   4.104  -3.303
   10    HB3  PRO   9           1HB      PRO   9 -14.930   5.002  -3.311
   11    HG2  PRO   9           2HG      PRO   9 -13.336   4.000  -1.027
   12    HG3  PRO   9           1HG      PRO   9 -14.319   5.469  -1.149
   13    HD2  PRO   9           2HD      PRO   9 -15.073   3.101   0.119
   14    HD3  PRO   9           1HD      PRO   9 -16.175   4.391  -0.392
   15    HA   PRO  10           HA       PRO  10 -13.522  -0.935  -3.708
   16    HB2  PRO  10           2HB      PRO  10 -12.905  -0.450  -6.532
   17    HB3  PRO  10           1HB      PRO  10 -13.836  -1.757  -5.796
   18    HG2  PRO  10           2HG      PRO  10 -14.984   0.199  -7.257
   19    HG3  PRO  10           1HG      PRO  10 -15.802  -0.591  -5.894
   20    HD2  PRO  10           2HD      PRO  10 -14.488   2.082  -6.033
   21    HD3  PRO  10           1HD      PRO  10 -15.973   1.561  -5.196
   22    H    LYS  11           H        LYS  11 -11.510  -1.194  -3.040
   23    HA   LYS  11           HA       LYS  11  -9.435   0.614  -4.057
   24    HB2  LYS  11           2HB      LYS  11  -9.526  -0.929  -1.458
   25    HB3  LYS  11           1HB      LYS  11  -8.227   0.134  -1.969
   26    HG2  LYS  11           2HG      LYS  11  -9.756   2.041  -1.877
   27    HG3  LYS  11           1HG      LYS  11 -11.058   0.962  -1.372
   28    HD2  LYS  11           2HD      LYS  11  -9.752   0.348   0.618
   29    HD3  LYS  11           1HD      LYS  11  -8.485   1.472   0.122
   30    HE2  LYS  11           2HE      LYS  11 -10.085   3.319   0.258
   31    HE3  LYS  11           1HE      LYS  11 -11.338   2.190   0.775
   32    HZ1  LYS  11           3HZ      LYS  11 -10.410   3.261   2.699
   33    HZ2  LYS  11           1HZ      LYS  11  -8.836   2.825   2.265
   34    HZ3  LYS  11           2HZ      LYS  11  -9.961   1.658   2.705
   35    HA   PRO  12           HA       PRO  12  -7.717  -3.193  -5.697
   36    HB2  PRO  12           2HB      PRO  12  -5.205  -1.757  -5.945
   37    HB3  PRO  12           1HB      PRO  12  -6.193  -2.482  -7.211
   38    HG2  PRO  12           2HG      PRO  12  -5.984   0.220  -6.914
   39    HG3  PRO  12           1HG      PRO  12  -7.435  -0.573  -7.548
   40    HD2  PRO  12           2HD      PRO  12  -6.915   0.540  -4.830
   41    HD3  PRO  12           1HD      PRO  12  -8.412   0.537  -5.788
   42    H    LYS  13           H        LYS  13  -6.707  -4.705  -4.680
   43    HA   LYS  13           HA       LYS  13  -5.480  -3.967  -2.153
   44    HB2  LYS  13           2HB      LYS  13  -6.083  -6.193  -1.334
   45    HB3  LYS  13           1HB      LYS  13  -7.476  -5.205  -1.750
   46    HG2  LYS  13           2HG      LYS  13  -7.435  -6.496  -4.000
   47    HG3  LYS  13           1HG      LYS  13  -6.397  -7.642  -3.149
   48    HD2  LYS  13           2HD      LYS  13  -9.215  -6.841  -2.404
   49    HD3  LYS  13           1HD      LYS  13  -8.690  -8.398  -3.032
   50    HE2  LYS  13           2HE      LYS  13  -7.414  -8.819  -1.014
   51    HE3  LYS  13           1HE      LYS  13  -7.796  -7.212  -0.407
   52    HZ1  LYS  13           3HZ      LYS  13 -10.158  -7.864  -0.387
   53    HZ2  LYS  13           1HZ      LYS  13  -9.217  -8.849   0.616
   54    HZ3  LYS  13           2HZ      LYS  13  -9.708  -9.420  -0.873
   55    H    CYS  14           H        CYS  14  -3.517  -4.034  -2.084
   56    HA   CYS  14           HA       CYS  14  -1.983  -5.496  -4.047
   57    HB2  CYS  14           2HB      CYS  14  -0.040  -4.199  -3.105
   58    HB3  CYS  14           1HB      CYS  14  -1.318  -3.228  -3.804
   59    H    ARG  15           H        ARG  15  -0.501  -7.030  -3.669
   60    HA   ARG  15           HA       ARG  15  -0.673  -8.392  -1.062
   61    HB2  ARG  15           2HB      ARG  15  -1.780  -9.443  -3.088
   62    HB3  ARG  15           1HB      ARG  15  -0.199  -9.536  -3.832
   63    HG2  ARG  15           2HG      ARG  15   0.542 -11.094  -2.125
   64    HG3  ARG  15           1HG      ARG  15  -1.008 -10.941  -1.291
   65    HD2  ARG  15           2HD      ARG  15  -2.164 -11.816  -3.220
   66    HD3  ARG  15           1HD      ARG  15  -0.651 -11.934  -4.116
   67    HE   ARG  15           HE       ARG  15  -0.027 -13.518  -2.211
   68   HH11  ARG  15          1HH1      ARG  15  -3.349 -13.195  -3.471
   69   HH12  ARG  15          2HH1      ARG  15  -3.732 -14.830  -3.192
   70   HH21  ARG  15          1HH2      ARG  15  -0.575 -15.746  -1.891
   71   HH22  ARG  15          2HH2      ARG  15  -2.130 -16.320  -2.305
   72    H    CYS  16           H        CYS  16   0.989  -6.335  -1.606
   73    HA   CYS  16           HA       CYS  16   3.556  -6.832  -2.636
   74    HB2  CYS  16           2HB      CYS  16   2.768  -4.850  -0.496
   75    HB3  CYS  16           1HB      CYS  16   4.173  -4.774  -1.550
   76    H    GLY  17           H        GLY  17   5.541  -7.229  -1.511
   77    HA2  GLY  17           2HA      GLY  17   6.860  -7.620   0.398
   78    HA3  GLY  17           1HA      GLY  17   5.392  -7.842   1.343
   79    H    ILE  18           H        ILE  18   4.114  -9.633  -0.361
   80    HA   ILE  18           HA       ILE  18   5.480 -12.091   0.231
   81    HB   ILE  18           HB       ILE  18   3.036 -11.662  -1.536
   82   HG12  ILE  18          2HG1      ILE  18   3.275 -11.995   1.456
   83   HG13  ILE  18          1HG1      ILE  18   2.595 -10.653   0.580
   84   HG21  ILE  18          1HG2      ILE  18   4.044 -13.877  -1.774
   85   HG22  ILE  18          2HG2      ILE  18   2.498 -13.987  -0.935
   86   HG23  ILE  18          3HG2      ILE  18   4.005 -14.100  -0.023
   87   HD11  ILE  18          3HD1      ILE  18   0.841 -12.008   1.575
   88   HD12  ILE  18          1HD1      ILE  18   1.406 -13.410   0.667
   89   HD13  ILE  18          2HD1      ILE  18   0.732 -12.019  -0.187
   90    H    SER  19           H        SER  19   5.133  -9.906  -2.335
   91    HA   SER  19           HA       SER  19   7.204 -11.258  -3.793
   92    HB2  SER  19           2HB      SER  19   5.058 -11.813  -4.941
   93    HB3  SER  19           1HB      SER  19   4.685 -10.099  -5.052
   94    HG   SER  19           HG       SER  19   7.113 -11.024  -6.072
   95    H    GLY  20           H        GLY  20   8.777  -9.834  -4.010
   96    HA2  GLY  20           2HA      GLY  20   8.577  -7.181  -4.818
   97    HA3  GLY  20           1HA      GLY  20   8.669  -7.212  -3.053
   98    H    SER  21           H        SER  21  10.508  -6.908  -5.696
   99    HA   SER  21           HA       SER  21  12.635  -8.673  -5.038
  100    HB2  SER  21           2HB      SER  21  12.659  -6.299  -6.897
  101    HB3  SER  21           1HB      SER  21  13.766  -7.670  -6.916
  102    HG   SER  21           HG       SER  21  11.733  -8.944  -7.180
  103    H    SER  22           H        SER  22  13.345  -8.213  -2.967
  104    HA   SER  22           HA       SER  22  14.841  -7.468  -1.483
  105    HB2  SER  22           2HB      SER  22  16.335  -7.139  -3.404
  106    HB3  SER  22           1HB      SER  22  15.719  -5.506  -3.619
  107    HG   SER  22           HG       SER  22  16.798  -4.843  -1.945
  108    H    ASN  23           H        ASN  23  12.989  -4.893  -2.978
  109    HA   ASN  23           HA       ASN  23  13.302  -3.108  -0.755
  110    HB2  ASN  23           2HB      ASN  23  12.816  -2.327  -3.111
  111    HB3  ASN  23           1HB      ASN  23  11.192  -2.971  -2.929
  112   HD21  ASN  23          1HD2      ASN  23  12.077  -0.245  -3.413
  113   HD22  ASN  23          2HD2      ASN  23  11.439   0.723  -2.140
  114    H    THR  24           H        THR  24  12.703  -4.130   1.016
  115    HA   THR  24           HA       THR  24   9.919  -4.984   1.274
  116    HB   THR  24           HB       THR  24  11.733  -6.677   1.679
  117    HG1  THR  24           1HG      THR  24   9.808  -7.007   2.677
  118   HG21  THR  24          3HG2      THR  24  12.411  -4.913   4.037
  119   HG22  THR  24          1HG2      THR  24  13.444  -5.241   2.649
  120   HG23  THR  24          2HG2      THR  24  13.048  -6.535   3.783
  121    H    LEU  25           H        LEU  25  11.655  -2.351   1.684
  122    HA   LEU  25           HA       LEU  25  10.646  -1.694   4.359
  123    HB2  LEU  25           2HB      LEU  25  12.313   0.036   4.577
  124    HB3  LEU  25           1HB      LEU  25  13.073  -1.488   4.206
  125    HG   LEU  25           HG       LEU  25  12.646   0.691   2.143
  126   HD11  LEU  25          1HD1      LEU  25  15.067   0.151   3.848
  127   HD12  LEU  25          2HD1      LEU  25  14.011   1.558   3.953
  128   HD13  LEU  25          3HD1      LEU  25  14.985   1.291   2.507
  129   HD21  LEU  25          3HD2      LEU  25  14.442  -1.750   2.207
  130   HD22  LEU  25          1HD2      LEU  25  14.523  -0.476   0.991
  131   HD23  LEU  25          2HD2      LEU  25  13.083  -1.453   1.111
  132    H    THR  26           H        THR  26  10.502  -0.699   1.021
  133    HA   THR  26           HA       THR  26   8.706   1.490   1.806
  134    HB   THR  26           HB       THR  26  10.510   1.447  -0.644
  135    HG1  THR  26           1HG      THR  26  11.115   1.734   1.947
  136   HG21  THR  26          3HG2      THR  26   8.621   3.076  -0.638
  137   HG22  THR  26          1HG2      THR  26  10.192   3.879  -0.592
  138   HG23  THR  26          2HG2      THR  26   9.235   3.741   0.879
  139    H    THR  27           H        THR  27   8.315  -1.405   1.155
  140    HA   THR  27           HA       THR  27   7.612  -2.222  -1.275
  141    HB   THR  27           HB       THR  27   5.827  -2.840   1.009
  142    HG1  THR  27           1HG      THR  27   7.471  -3.509   2.249
  143   HG21  THR  27          3HG2      THR  27   7.610  -4.573  -0.716
  144   HG22  THR  27          1HG2      THR  27   5.944  -4.146  -1.122
  145   HG23  THR  27          2HG2      THR  27   6.278  -5.085   0.332
  146    H    CYS  28           H        CYS  28   5.215  -1.014   1.055
  147    HA   CYS  28           HA       CYS  28   3.389  -0.435  -1.089
  148    HB2  CYS  28           2HB      CYS  28   2.999  -0.527   1.880
  149    HB3  CYS  28           1HB      CYS  28   1.782   0.187   0.826
  150    H    ARG  29           H        ARG  29   5.795   1.282   0.155
  151    HA   ARG  29           HA       ARG  29   4.298   3.806   0.128
  152    HB2  ARG  29           2HB      ARG  29   5.671   3.297   2.166
  153    HB3  ARG  29           1HB      ARG  29   7.113   3.310   1.165
  154    HG2  ARG  29           2HG      ARG  29   6.666   5.665   0.596
  155    HG3  ARG  29           1HG      ARG  29   5.258   5.631   1.650
  156    HD2  ARG  29           2HD      ARG  29   6.680   5.253   3.578
  157    HD3  ARG  29           1HD      ARG  29   8.108   5.166   2.536
  158    HE   ARG  29           HE       ARG  29   6.737   7.536   2.036
  159   HH11  ARG  29          1HH1      ARG  29   8.709   6.160   4.637
  160   HH12  ARG  29          2HH1      ARG  29   9.321   7.665   5.134
  161   HH21  ARG  29          1HH2      ARG  29   7.593   9.591   2.723
  162   HH22  ARG  29          2HH2      ARG  29   8.706   9.650   4.007
  163    H    ASN  30           H        ASN  30   5.411   2.137  -2.247
  164    HA   ASN  30           HA       ASN  30   6.680   4.470  -3.450
  165    HB2  ASN  30           2HB      ASN  30   8.413   3.286  -4.538
  166    HB3  ASN  30           1HB      ASN  30   8.406   2.657  -2.901
  167   HD21  ASN  30          1HD2      ASN  30   7.684   0.530  -2.580
  168   HD22  ASN  30          2HD2      ASN  30   7.551  -0.593  -3.879
  169    H    SER  31           H        SER  31   6.723   4.334  -5.894
  170    HA   SER  31           HA       SER  31   4.068   4.401  -6.710
  171    HB2  SER  31           2HB      SER  31   6.527   4.443  -8.435
  172    HB3  SER  31           1HB      SER  31   4.955   5.180  -8.779
  173    HG   SER  31           HG       SER  31   5.365   6.761  -7.391
  174    H    ARG  32           H        ARG  32   6.106   1.647  -6.638
  175    HA   ARG  32           HA       ARG  32   4.926   0.319  -8.918
  176    HB2  ARG  32           2HB      ARG  32   6.561  -0.815  -6.637
  177    HB3  ARG  32           1HB      ARG  32   6.124  -1.681  -8.102
  178    HG2  ARG  32           2HG      ARG  32   7.518  -0.296  -9.430
  179    HG3  ARG  32           1HG      ARG  32   7.777   0.832  -8.095
  180    HD2  ARG  32           2HD      ARG  32   8.858  -1.034  -6.836
  181    HD3  ARG  32           1HD      ARG  32   8.726  -2.020  -8.293
  182    HE   ARG  32           HE       ARG  32  10.376  -0.796  -9.290
  183   HH11  ARG  32          1HH1      ARG  32   9.514   0.732  -6.204
  184   HH12  ARG  32          2HH1      ARG  32  10.962   1.606  -6.039
  185   HH21  ARG  32          1HH2      ARG  32  12.415   0.415  -9.047
  186   HH22  ARG  32          2HH2      ARG  32  12.662   1.419  -7.695
  187    H    CYS  33           H        CYS  33   3.974   1.017  -5.788
  188    HA   CYS  33           HA       CYS  33   2.343  -1.343  -5.438
  189    HB2  CYS  33           2HB      CYS  33   3.528  -0.443  -3.501
  190    HB3  CYS  33           1HB      CYS  33   2.758   1.119  -3.724
  191    HA   PRO  34           HA       PRO  34  -0.890   0.799  -7.733
  192    HB2  PRO  34           2HB      PRO  34  -2.761  -1.164  -7.535
  193    HB3  PRO  34           1HB      PRO  34  -1.391  -1.265  -8.654
  194    HG2  PRO  34           2HG      PRO  34  -1.742  -2.498  -5.949
  195    HG3  PRO  34           1HG      PRO  34  -1.101  -3.227  -7.434
  196    HD2  PRO  34           2HD      PRO  34   0.495  -2.340  -5.459
  197    HD3  PRO  34           1HD      PRO  34   0.976  -2.244  -7.164
  198    H    CYS  35           H        CYS  35  -0.945  -0.160  -4.526
  199    HA   CYS  35           HA       CYS  35  -3.601   0.857  -3.862
  200    HB2  CYS  35           2HB      CYS  35  -2.331  -1.115  -2.761
  201    HB3  CYS  35           1HB      CYS  35  -1.362   0.119  -1.992
  202    H    TYR  36           H        TYR  36  -0.217   1.624  -3.357
  203    HA   TYR  36           HA       TYR  36  -0.534   4.028  -1.903
  204    HB2  TYR  36           2HB      TYR  36   1.518   2.748  -1.792
  205    HB3  TYR  36           1HB      TYR  36   1.768   2.962  -3.516
  206    HD1  TYR  36           2HD      TYR  36   1.810   4.684  -0.249
  207    HD2  TYR  36           1HD      TYR  36   2.742   4.961  -4.388
  208    HE1  TYR  36           2HE      TYR  36   3.118   6.722   0.180
  209    HE2  TYR  36           1HE      TYR  36   4.036   6.980  -3.980
  210    HH   TYR  36           HH       TYR  36   4.143   8.779  -2.298
  211    H    LYS  37           H        LYS  37   0.136   3.398  -5.344
  212    HA   LYS  37           HA       LYS  37   0.361   6.184  -5.888
  213    HB2  LYS  37           2HB      LYS  37   1.387   4.197  -7.198
  214    HB3  LYS  37           1HB      LYS  37  -0.173   4.124  -8.010
  215    HG2  LYS  37           2HG      LYS  37   0.129   6.544  -8.613
  216    HG3  LYS  37           1HG      LYS  37   1.761   6.430  -7.967
  217    HD2  LYS  37           2HD      LYS  37   1.925   6.149 -10.325
  218    HD3  LYS  37           1HD      LYS  37   2.165   4.556  -9.605
  219    HE2  LYS  37           2HE      LYS  37   0.691   4.393 -11.536
  220    HE3  LYS  37           1HE      LYS  37  -0.195   4.009 -10.066
  221    HZ1  LYS  37           3HZ      LYS  37  -1.118   6.278 -10.098
  222    HZ2  LYS  37           1HZ      LYS  37  -1.471   5.460 -11.523
  223    HZ3  LYS  37           2HZ      LYS  37  -0.260   6.623 -11.488
  224    H    SER  38           H        SER  38  -2.271   4.171  -5.409
  225    HA   SER  38           HA       SER  38  -4.068   5.908  -6.919
  226    HB2  SER  38           2HB      SER  38  -4.236   3.349  -7.012
  227    HB3  SER  38           1HB      SER  38  -4.777   3.414  -5.342
  228    HG   SER  38           HG       SER  38  -6.478   4.854  -6.138
  229    H    TYR  39           H        TYR  39  -2.485   5.950  -4.142
  230    HA   TYR  39           HA       TYR  39  -2.551   7.052  -2.215
  231    HB2  TYR  39           2HB      TYR  39  -4.973   8.507  -3.317
  232    HB3  TYR  39           1HB      TYR  39  -3.818   9.105  -2.126
  233    HD1  TYR  39           2HD      TYR  39  -1.298   9.177  -2.964
  234    HD2  TYR  39           1HD      TYR  39  -4.689   9.109  -5.522
  235    HE1  TYR  39           2HE      TYR  39   0.078  10.049  -4.804
  236    HE2  TYR  39           1HE      TYR  39  -3.334   9.957  -7.363
  237    HH   TYR  39           HH       TYR  39  -1.274  11.202  -7.703
  238    H    ASN  40           H        ASN  40  -3.971   4.603  -2.484
  239    HA   ASN  40           HA       ASN  40  -6.273   4.837  -0.715
  240    HB2  ASN  40           2HB      ASN  40  -5.248   2.674  -2.513
  241    HB3  ASN  40           1HB      ASN  40  -6.461   2.314  -1.310
  242   HD21  ASN  40          1HD2      ASN  40  -6.558   2.184  -4.179
  243   HD22  ASN  40          2HD2      ASN  40  -7.847   3.207  -4.705
  244    H    SER  41           H        SER  41  -6.484   3.462   1.047
  245    HA   SER  41           HA       SER  41  -4.045   3.026   2.488
  246    HB2  SER  41           2HB      SER  41  -5.900   2.458   4.243
  247    HB3  SER  41           1HB      SER  41  -5.620   4.136   3.757
  248    HG   SER  41           HG       SER  41  -7.456   4.211   2.892
  249    H    CYS  42           H        CYS  42  -3.629   1.005   3.541
  250    HA   CYS  42           HA       CYS  42  -4.369  -1.227   1.899
  251    HB2  CYS  42           2HB      CYS  42  -2.265  -0.939   4.032
  252    HB3  CYS  42           1HB      CYS  42  -2.684  -2.494   3.327
  253    H    ALA  43           H        ALA  43  -6.416  -1.000   2.593
  254    HA   ALA  43           HA       ALA  43  -7.020  -2.407   5.107
  255    HB1  ALA  43           1HB      ALA  43  -8.201  -0.282   4.768
  256    HB2  ALA  43           2HB      ALA  43  -9.328  -1.636   4.767
  257    HB3  ALA  43           3HB      ALA  43  -8.845  -0.889   3.245
  258    H    GLY  44           H        GLY  44  -6.956  -4.539   4.742
  259    HA2  GLY  44           2HA      GLY  44  -8.004  -6.506   4.023
  260    HA3  GLY  44           1HA      GLY  44  -8.712  -5.617   2.680
  261    H    CYS  45           H        CYS  45  -5.564  -4.780   2.920
  262    HA   CYS  45           HA       CYS  45  -4.863  -6.259   0.541
  263    HB2  CYS  45           2HB      CYS  45  -3.148  -4.405   2.218
  264    HB3  CYS  45           1HB      CYS  45  -2.756  -5.020   0.623
  265    H    HIS  46           H        HIS  46  -3.101  -7.708   0.422
  266    HA   HIS  46           HA       HIS  46  -2.658  -9.138   2.964
  267    HB2  HIS  46           2HB      HIS  46  -2.608 -10.095   0.099
  268    HB3  HIS  46           1HB      HIS  46  -1.948 -11.057   1.416
  269    HD1  HIS  46           1HD      HIS  46  -3.569 -12.823   1.986
  270    HD2  HIS  46           2HD      HIS  46  -5.478  -9.256   1.079
  271    HE1  HIS  46           1HE      HIS  46  -6.022 -13.269   2.301
  272    HE2  HIS  46           2HE      HIS  46  -7.020 -10.982   2.180
  273    H    CYS  47           H        CYS  47  -1.278  -6.829   2.124
  274    HA   CYS  47           HA       CYS  47   1.305  -7.564   1.180
  275    HB2  CYS  47           2HB      CYS  47   1.856  -5.195   1.690
  276    HB3  CYS  47           1HB      CYS  47   0.522  -5.433   0.567
  277    H    VAL  48           H        VAL  48   3.105  -7.763   2.203
  278    HA   VAL  48           HA       VAL  48   3.145  -7.777   5.162
  279    HB   VAL  48           HB       VAL  48   4.917  -9.391   3.281
  280   HG11  VAL  48          1HG1      VAL  48   5.574 -10.638   5.282
  281   HG12  VAL  48          2HG1      VAL  48   4.550  -9.596   6.264
  282   HG13  VAL  48          3HG1      VAL  48   5.954  -8.921   5.436
  283   HG21  VAL  48          3HG2      VAL  48   2.546 -10.340   4.878
  284   HG22  VAL  48          1HG2      VAL  48   3.648 -11.373   3.969
  285   HG23  VAL  48          2HG2      VAL  48   2.629 -10.201   3.124
  286    H    GLY  49           H        GLY  49   4.914  -6.663   6.112
  287    HA2  GLY  49           2HA      GLY  49   6.633  -5.117   6.216
  288    HA3  GLY  49           1HA      GLY  49   7.127  -5.678   4.621
  289    H    CYS  50           H        CYS  50   4.202  -4.101   5.839
  290    HA   CYS  50           HA       CYS  50   4.192  -2.444   3.485
  291    HB2  CYS  50           2HB      CYS  50   2.196  -3.641   3.671
  292    HB3  CYS  50           1HB      CYS  50   2.096  -3.373   5.408
  293    H    LYS  51           H        LYS  51   4.788  -0.415   3.765
  294    HA   LYS  51           HA       LYS  51   3.961   0.894   6.241
  295    HB2  LYS  51           2HB      LYS  51   6.337   1.634   4.490
  296    HB3  LYS  51           1HB      LYS  51   5.826   2.486   5.936
  297    HG2  LYS  51           2HG      LYS  51   6.368   0.490   7.277
  298    HG3  LYS  51           1HG      LYS  51   6.927  -0.320   5.811
  299    HD2  LYS  51           2HD      LYS  51   8.587   1.505   5.501
  300    HD3  LYS  51           1HD      LYS  51   8.069   2.188   7.041
  301    HE2  LYS  51           2HE      LYS  51   8.759   0.132   8.181
  302    HE3  LYS  51           1HE      LYS  51   9.242  -0.558   6.633
  303    HZ1  LYS  51           3HZ      LYS  51  10.857   1.257   6.419
  304    HZ2  LYS  51           1HZ      LYS  51  11.162   0.323   7.783
  305    HZ3  LYS  51           2HZ      LYS  51  10.440   1.826   7.934
  306    H    ASN  52           H        ASN  52   2.014   1.508   5.387
  307    HA   ASN  52           HA       ASN  52   2.141   3.097   2.924
  308    HB2  ASN  52           2HB      ASN  52   0.553   1.117   2.996
  309    HB3  ASN  52           1HB      ASN  52  -0.354   1.977   4.230
  310   HD21  ASN  52          1HD2      ASN  52  -1.338   1.152   1.694
  311   HD22  ASN  52          2HD2      ASN  52  -1.818   2.586   0.859
  312    HA   PRO  53           HA       PRO  53   1.658   6.511   5.850
  313    HB2  PRO  53           2HB      PRO  53   1.664   8.104   3.360
  314    HB3  PRO  53           1HB      PRO  53   2.722   8.226   4.768
  315    HG2  PRO  53           2HG      PRO  53   3.608   7.239   2.439
  316    HG3  PRO  53           1HG      PRO  53   4.165   6.597   3.993
  317    HD2  PRO  53           2HD      PRO  53   2.152   5.460   2.094
  318    HD3  PRO  53           1HD      PRO  53   3.412   4.640   3.045
  319    H    HIS  54           H        HIS  54  -0.233   5.693   3.049
  320    HA   HIS  54           HA       HIS  54  -2.221   7.742   3.518
  321    HB2  HIS  54           2HB      HIS  54  -2.235   5.432   1.557
  322    HB3  HIS  54           1HB      HIS  54  -3.481   6.666   1.665
  323    HD1  HIS  54           1HD      HIS  54  -3.022   8.910   0.493
  324    HD2  HIS  54           2HD      HIS  54   0.252   6.334   0.510
  325    HE1  HIS  54           1HE      HIS  54  -1.364   9.926  -1.026
  326    HE2  HIS  54           2HE      HIS  54   0.649   8.510  -0.896
  327    H    LYS  55           H        LYS  55  -4.009   7.528   4.566
  328    HA   LYS  55           HA       LYS  55  -4.775   4.893   5.582
  329    HB2  LYS  55           2HB      LYS  55  -5.040   7.596   6.945
  330    HB3  LYS  55           1HB      LYS  55  -5.589   6.057   7.589
  331    HG2  LYS  55           2HG      LYS  55  -2.727   6.841   7.078
  332    HG3  LYS  55           1HG      LYS  55  -3.524   6.783   8.653
  333    HD2  LYS  55           2HD      LYS  55  -3.871   4.359   8.359
  334    HD3  LYS  55           1HD      LYS  55  -3.035   4.437   6.807
  335    HE2  LYS  55           2HE      LYS  55  -1.833   5.160   9.477
  336    HE3  LYS  55           1HE      LYS  55  -1.573   3.641   8.625
  337    HZ1  LYS  55           3HZ      LYS  55  -0.802   6.338   7.640
  338    HZ2  LYS  55           1HZ      LYS  55  -0.489   4.865   6.843
  339    HZ3  LYS  55           2HZ      LYS  55   0.228   5.210   8.324
  340    H    GLU  56           H        GLU  56  -7.249   5.694   6.557
  341    HA   GLU  56           HA       GLU  56  -8.683   6.216   4.152
  342    HB2  GLU  56           2HB      GLU  56  -9.449   4.841   6.189
  343    HB3  GLU  56           1HB      GLU  56  -9.819   6.388   6.945
  344    HG2  GLU  56           2HG      GLU  56 -11.796   5.427   5.935
  345    HG3  GLU  56           1HG      GLU  56 -11.322   6.915   5.098
  346    H    ASP  57           H        ASP  57  -8.334   8.122   3.322
  347    HA   ASP  57           HA       ASP  57  -8.111  10.303   2.918
  348    HB2  ASP  57           2HB      ASP  57 -10.346  10.667   4.006
  349    HB3  ASP  57           1HB      ASP  57  -9.461  10.830   5.536
  350    H    TYR  58           H        TYR  58  -6.323  11.203   2.928
  351    HA   TYR  58           HA       TYR  58  -4.851  11.476   5.427
  352    HB2  TYR  58           2HB      TYR  58  -4.163   9.321   4.684
  353    HB3  TYR  58           1HB      TYR  58  -3.865   9.904   3.053
  354    HD1  TYR  58           1HD      TYR  58  -2.749  10.484   6.564
  355    HD2  TYR  58           2HD      TYR  58  -1.688  10.393   2.450
  356    HE1  TYR  58           1HE      TYR  58  -0.397  10.894   7.159
  357    HE2  TYR  58           2HE      TYR  58   0.650  10.796   3.032
  358    HH   TYR  58           HH       TYR  58   1.843  11.841   4.876
  359    H    VAL  59           H        VAL  59  -4.499  13.542   5.497
  360    HA   VAL  59           HA       VAL  59  -2.793  14.745   3.487
  361    HB   VAL  59           HB       VAL  59  -5.147  16.275   4.683
  362   HG11  VAL  59          1HG1      VAL  59  -3.152  17.031   2.559
  363   HG12  VAL  59          2HG1      VAL  59  -3.230  17.663   4.203
  364   HG13  VAL  59          3HG1      VAL  59  -4.523  18.015   3.057
  365   HG21  VAL  59          3HG2      VAL  59  -6.136  16.342   2.431
  366   HG22  VAL  59          1HG2      VAL  59  -6.035  14.696   3.055
  367   HG23  VAL  59          2HG2      VAL  59  -4.872  15.255   1.852
  Start of MODEL   18
    1    H1   SER   8           1HT      SER   8 -20.816   2.181  -4.865
    2    H2   SER   8           2HT      SER   8 -19.982   0.706  -4.997
    3    H3   SER   8           3HT      SER   8 -20.298   1.640  -6.382
    4    HA   SER   8           HA       SER   8 -18.918   3.352  -5.611
    5    HB2  SER   8           2HB      SER   8 -18.329   1.505  -3.288
    6    HB3  SER   8           1HB      SER   8 -17.752   3.159  -3.519
    7    HG   SER   8           HG       SER   8 -19.505   3.014  -2.090
    8    HA   PRO   9           HA       PRO   9 -15.897   0.874  -7.771
    9    HB2  PRO   9           2HB      PRO   9 -13.822   2.855  -7.143
   10    HB3  PRO   9           1HB      PRO   9 -14.523   2.449  -8.710
   11    HG2  PRO   9           2HG      PRO   9 -15.013   4.799  -7.485
   12    HG3  PRO   9           1HG      PRO   9 -16.218   3.990  -8.500
   13    HD2  PRO   9           2HD      PRO   9 -16.000   4.057  -5.514
   14    HD3  PRO   9           1HD      PRO   9 -17.434   4.217  -6.553
   15    HA   PRO  10           HA       PRO  10 -13.716  -1.027  -4.330
   16    HB2  PRO  10           2HB      PRO  10 -12.278  -2.737  -6.169
   17    HB3  PRO  10           1HB      PRO  10 -13.616  -3.157  -5.099
   18    HG2  PRO  10           2HG      PRO  10 -13.832  -3.125  -7.815
   19    HG3  PRO  10           1HG      PRO  10 -15.194  -2.844  -6.721
   20    HD2  PRO  10           2HD      PRO  10 -13.511  -0.865  -8.203
   21    HD3  PRO  10           1HD      PRO  10 -15.277  -0.904  -7.964
   22    H    LYS  11           H        LYS  11 -11.674  -0.944  -3.412
   23    HA   LYS  11           HA       LYS  11  -9.898   0.893  -4.748
   24    HB2  LYS  11           2HB      LYS  11  -8.765   1.105  -2.611
   25    HB3  LYS  11           1HB      LYS  11 -10.493   1.286  -2.382
   26    HG2  LYS  11           2HG      LYS  11 -10.627  -0.979  -1.501
   27    HG3  LYS  11           1HG      LYS  11  -8.899  -1.199  -1.786
   28    HD2  LYS  11           2HD      LYS  11  -8.436   0.680  -0.249
   29    HD3  LYS  11           1HD      LYS  11 -10.165   0.816   0.064
   30    HE2  LYS  11           2HE      LYS  11 -10.187  -1.462   0.952
   31    HE3  LYS  11           1HE      LYS  11  -8.467  -1.613   0.614
   32    HZ1  LYS  11           3HZ      LYS  11  -8.810  -1.115   2.904
   33    HZ2  LYS  11           1HZ      LYS  11  -9.705   0.267   2.582
   34    HZ3  LYS  11           2HZ      LYS  11  -8.082   0.232   2.215
   35    HA   PRO  12           HA       PRO  12  -7.001  -2.224  -6.026
   36    HB2  PRO  12           2HB      PRO  12  -4.840  -0.412  -5.124
   37    HB3  PRO  12           1HB      PRO  12  -5.143  -1.090  -6.727
   38    HG2  PRO  12           2HG      PRO  12  -5.609   1.484  -6.213
   39    HG3  PRO  12           1HG      PRO  12  -6.662   0.546  -7.284
   40    HD2  PRO  12           2HD      PRO  12  -7.107   1.371  -4.448
   41    HD3  PRO  12           1HD      PRO  12  -8.247   1.304  -5.812
   42    H    LYS  13           H        LYS  13  -5.645  -3.752  -5.164
   43    HA   LYS  13           HA       LYS  13  -4.929  -3.577  -2.377
   44    HB2  LYS  13           2HB      LYS  13  -5.687  -6.033  -2.184
   45    HB3  LYS  13           1HB      LYS  13  -6.914  -4.782  -2.107
   46    HG2  LYS  13           2HG      LYS  13  -7.460  -5.181  -4.463
   47    HG3  LYS  13           1HG      LYS  13  -6.241  -6.453  -4.522
   48    HD2  LYS  13           2HD      LYS  13  -7.426  -7.784  -2.972
   49    HD3  LYS  13           1HD      LYS  13  -8.535  -6.475  -2.576
   50    HE2  LYS  13           2HE      LYS  13  -8.309  -7.817  -5.272
   51    HE3  LYS  13           1HE      LYS  13  -9.547  -8.161  -4.069
   52    HZ1  LYS  13           3HZ      LYS  13 -10.392  -6.646  -5.707
   53    HZ2  LYS  13           1HZ      LYS  13  -9.127  -5.567  -5.455
   54    HZ3  LYS  13           2HZ      LYS  13 -10.269  -5.835  -4.246
   55    H    CYS  14           H        CYS  14  -3.266  -5.137  -1.815
   56    HA   CYS  14           HA       CYS  14  -1.736  -5.971  -4.141
   57    HB2  CYS  14           2HB      CYS  14   0.248  -4.751  -3.338
   58    HB3  CYS  14           1HB      CYS  14  -1.093  -3.682  -3.710
   59    H    ARG  15           H        ARG  15   0.069  -7.264  -3.569
   60    HA   ARG  15           HA       ARG  15  -0.143  -8.612  -0.963
   61    HB2  ARG  15           2HB      ARG  15   0.574  -9.843  -3.641
   62    HB3  ARG  15           1HB      ARG  15   0.420 -10.699  -2.111
   63    HG2  ARG  15           2HG      ARG  15  -1.975 -10.117  -2.055
   64    HG3  ARG  15           1HG      ARG  15  -1.796  -9.324  -3.617
   65    HD2  ARG  15           2HD      ARG  15  -1.036 -11.484  -4.558
   66    HD3  ARG  15           1HD      ARG  15  -1.382 -12.240  -3.004
   67    HE   ARG  15           HE       ARG  15  -3.473 -10.810  -4.472
   68   HH11  ARG  15          1HH1      ARG  15  -2.392 -13.770  -2.825
   69   HH12  ARG  15          2HH1      ARG  15  -3.756 -14.681  -3.301
   70   HH21  ARG  15          1HH2      ARG  15  -5.356 -12.075  -5.059
   71   HH22  ARG  15          2HH2      ARG  15  -5.461 -13.718  -4.572
   72    H    CYS  16           H        CYS  16   1.387  -6.369  -1.652
   73    HA   CYS  16           HA       CYS  16   4.032  -6.753  -2.423
   74    HB2  CYS  16           2HB      CYS  16   2.941  -4.791  -0.395
   75    HB3  CYS  16           1HB      CYS  16   4.541  -4.709  -1.115
   76    H    GLY  17           H        GLY  17   5.896  -7.231  -1.333
   77    HA2  GLY  17           2HA      GLY  17   7.185  -7.832   0.526
   78    HA3  GLY  17           1HA      GLY  17   5.706  -8.105   1.444
   79    H    ILE  18           H        ILE  18   4.381  -9.621  -0.526
   80    HA   ILE  18           HA       ILE  18   5.649 -12.180  -0.045
   81    HB   ILE  18           HB       ILE  18   3.063 -11.599  -1.511
   82   HG12  ILE  18          2HG1      ILE  18   3.561 -12.089   1.432
   83   HG13  ILE  18          1HG1      ILE  18   2.933 -10.644   0.687
   84   HG21  ILE  18          1HG2      ILE  18   4.094 -14.117  -0.192
   85   HG22  ILE  18          2HG2      ILE  18   3.948 -13.832  -1.925
   86   HG23  ILE  18          3HG2      ILE  18   2.500 -13.925  -0.922
   87   HD11  ILE  18          3HD1      ILE  18   1.513 -13.298   0.726
   88   HD12  ILE  18          1HD1      ILE  18   0.915 -11.806  -0.004
   89   HD13  ILE  18          2HD1      ILE  18   1.148 -11.900   1.739
   90    H    SER  19           H        SER  19   4.549 -10.212  -2.773
   91    HA   SER  19           HA       SER  19   5.435 -11.984  -4.775
   92    HB2  SER  19           2HB      SER  19   4.968  -9.894  -6.189
   93    HB3  SER  19           1HB      SER  19   3.616 -10.587  -5.286
   94    HG   SER  19           HG       SER  19   3.703  -8.355  -4.996
   95    H    GLY  20           H        GLY  20   6.805  -9.104  -3.260
   96    HA2  GLY  20           2HA      GLY  20   9.380  -9.803  -4.397
   97    HA3  GLY  20           1HA      GLY  20   8.725  -8.225  -4.813
   98    H    SER  21           H        SER  21  11.106  -8.885  -3.323
   99    HA   SER  21           HA       SER  21  10.470  -7.545  -0.797
  100    HB2  SER  21           2HB      SER  21  12.682  -9.544  -1.349
  101    HB3  SER  21           1HB      SER  21  12.348  -8.755   0.193
  102    HG   SER  21           HG       SER  21  10.221 -10.040  -0.971
  103    H    SER  22           H        SER  22  11.341  -6.657  -3.649
  104    HA   SER  22           HA       SER  22  13.983  -5.670  -3.476
  105    HB2  SER  22           2HB      SER  22  11.659  -4.502  -5.031
  106    HB3  SER  22           1HB      SER  22  13.372  -4.299  -5.387
  107    HG   SER  22           HG       SER  22  13.374  -6.695  -5.546
  108    H    ASN  23           H        ASN  23  10.869  -4.491  -2.536
  109    HA   ASN  23           HA       ASN  23  12.100  -2.207  -1.168
  110    HB2  ASN  23           2HB      ASN  23   9.244  -2.670  -2.069
  111    HB3  ASN  23           1HB      ASN  23   9.745  -1.320  -1.058
  112   HD21  ASN  23          1HD2      ASN  23   9.701  -2.660  -4.238
  113   HD22  ASN  23          2HD2      ASN  23  10.311  -1.271  -5.050
  114    H    THR  24           H        THR  24  12.323  -2.578   0.945
  115    HA   THR  24           HA       THR  24  10.706  -4.688   2.138
  116    HB   THR  24           HB       THR  24  12.427  -4.462   4.012
  117    HG1  THR  24           1HG      THR  24  14.168  -3.346   2.131
  118   HG21  THR  24          3HG2      THR  24  12.468  -6.306   2.411
  119   HG22  THR  24          1HG2      THR  24  14.113  -5.778   2.748
  120   HG23  THR  24          2HG2      THR  24  13.326  -5.303   1.244
  121    H    LEU  25           H        LEU  25  11.741  -1.360   2.653
  122    HA   LEU  25           HA       LEU  25   9.765  -1.005   4.723
  123    HB2  LEU  25           2HB      LEU  25  12.232  -0.332   4.841
  124    HB3  LEU  25           1HB      LEU  25  11.839   0.907   3.672
  125    HG   LEU  25           HG       LEU  25  10.472   0.654   6.276
  126   HD11  LEU  25          1HD1      LEU  25  12.842   0.893   6.747
  127   HD12  LEU  25          2HD1      LEU  25  12.074   2.445   7.091
  128   HD13  LEU  25          3HD1      LEU  25  12.971   2.212   5.589
  129   HD21  LEU  25          3HD2      LEU  25   9.344   2.118   4.684
  130   HD22  LEU  25          1HD2      LEU  25  10.833   3.030   4.436
  131   HD23  LEU  25          2HD2      LEU  25  10.014   3.086   5.996
  132    H    THR  26           H        THR  26  10.748   0.046   1.502
  133    HA   THR  26           HA       THR  26   8.570   1.899   1.314
  134    HB   THR  26           HB       THR  26   9.588   2.169  -1.048
  135    HG1  THR  26           1HG      THR  26  11.131   0.812  -1.481
  136   HG21  THR  26          3HG2      THR  26   9.920   3.791   0.759
  137   HG22  THR  26          1HG2      THR  26  11.417   3.573  -0.146
  138   HG23  THR  26          2HG2      THR  26  11.214   2.800   1.426
  139    H    THR  27           H        THR  27   8.086  -1.074   1.513
  140    HA   THR  27           HA       THR  27   7.569  -2.506  -0.725
  141    HB   THR  27           HB       THR  27   5.565  -2.695   1.378
  142    HG1  THR  27           1HG      THR  27   7.157  -3.053   3.031
  143   HG21  THR  27          3HG2      THR  27   6.235  -4.582  -0.069
  144   HG22  THR  27          1HG2      THR  27   6.541  -4.939   1.627
  145   HG23  THR  27          2HG2      THR  27   7.877  -4.486   0.564
  146    H    CYS  28           H        CYS  28   5.104  -0.909   1.183
  147    HA   CYS  28           HA       CYS  28   3.399  -0.660  -1.114
  148    HB2  CYS  28           2HB      CYS  28   2.853  -0.410   1.815
  149    HB3  CYS  28           1HB      CYS  28   1.635  -0.054   0.592
  150    H    ARG  29           H        ARG  29   5.690   1.118   0.102
  151    HA   ARG  29           HA       ARG  29   4.291   3.679   0.143
  152    HB2  ARG  29           2HB      ARG  29   5.871   2.878   1.956
  153    HB3  ARG  29           1HB      ARG  29   7.166   3.128   0.791
  154    HG2  ARG  29           2HG      ARG  29   6.571   5.502   0.693
  155    HG3  ARG  29           1HG      ARG  29   5.319   5.216   1.898
  156    HD2  ARG  29           2HD      ARG  29   7.055   4.363   3.453
  157    HD3  ARG  29           1HD      ARG  29   8.283   4.807   2.271
  158    HE   ARG  29           HE       ARG  29   6.445   6.807   3.376
  159   HH11  ARG  29          1HH1      ARG  29   9.785   5.694   2.856
  160   HH12  ARG  29          2HH1      ARG  29  10.492   7.106   3.472
  161   HH21  ARG  29          1HH2      ARG  29   7.408   8.693   4.244
  162   HH22  ARG  29          2HH2      ARG  29   9.114   8.889   4.258
  163    H    ASN  30           H        ASN  30   5.755   1.861  -2.153
  164    HA   ASN  30           HA       ASN  30   6.923   4.221  -3.464
  165    HB2  ASN  30           2HB      ASN  30   8.316   2.835  -4.825
  166    HB3  ASN  30           1HB      ASN  30   8.432   2.172  -3.205
  167   HD21  ASN  30          1HD2      ASN  30   7.449   0.183  -2.791
  168   HD22  ASN  30          2HD2      ASN  30   7.026  -0.910  -4.054
  169    H    SER  31           H        SER  31   6.626   4.357  -5.854
  170    HA   SER  31           HA       SER  31   3.899   4.605  -6.341
  171    HB2  SER  31           2HB      SER  31   6.220   4.794  -8.237
  172    HB3  SER  31           1HB      SER  31   4.602   5.469  -8.494
  173    HG   SER  31           HG       SER  31   4.891   6.807  -6.774
  174    H    ARG  32           H        ARG  32   5.735   1.774  -6.675
  175    HA   ARG  32           HA       ARG  32   4.029   0.796  -8.815
  176    HB2  ARG  32           2HB      ARG  32   6.445  -0.452  -7.512
  177    HB3  ARG  32           1HB      ARG  32   5.450  -1.283  -8.699
  178    HG2  ARG  32           2HG      ARG  32   6.981   1.272  -9.156
  179    HG3  ARG  32           1HG      ARG  32   7.440  -0.335  -9.731
  180    HD2  ARG  32           2HD      ARG  32   5.341  -0.437 -11.032
  181    HD3  ARG  32           1HD      ARG  32   4.942   1.187 -10.489
  182    HE   ARG  32           HE       ARG  32   7.423   1.340 -11.627
  183   HH11  ARG  32          1HH1      ARG  32   4.122   0.546 -12.631
  184   HH12  ARG  32          2HH1      ARG  32   4.334   1.016 -14.254
  185   HH21  ARG  32          1HH2      ARG  32   7.721   1.991 -13.871
  186   HH22  ARG  32          2HH2      ARG  32   6.431   1.873 -14.966
  187    H    CYS  33           H        CYS  33   3.663   1.165  -5.677
  188    HA   CYS  33           HA       CYS  33   2.238  -1.323  -5.301
  189    HB2  CYS  33           2HB      CYS  33   3.407  -0.319  -3.349
  190    HB3  CYS  33           1HB      CYS  33   2.426   1.130  -3.516
  191    HA   PRO  34           HA       PRO  34  -1.069   0.492  -7.610
  192    HB2  PRO  34           2HB      PRO  34  -3.028  -1.305  -6.894
  193    HB3  PRO  34           1HB      PRO  34  -1.825  -1.590  -8.153
  194    HG2  PRO  34           2HG      PRO  34  -1.857  -2.515  -5.318
  195    HG3  PRO  34           1HG      PRO  34  -1.356  -3.383  -6.783
  196    HD2  PRO  34           2HD      PRO  34   0.424  -2.333  -5.073
  197    HD3  PRO  34           1HD      PRO  34   0.726  -2.378  -6.819
  198    H    CYS  35           H        CYS  35  -1.271  -0.118  -4.249
  199    HA   CYS  35           HA       CYS  35  -3.725   1.288  -3.779
  200    HB2  CYS  35           2HB      CYS  35  -1.485   0.550  -1.924
  201    HB3  CYS  35           1HB      CYS  35  -3.061   1.152  -1.419
  202    H    TYR  36           H        TYR  36  -0.372   1.983  -3.023
  203    HA   TYR  36           HA       TYR  36  -0.528   4.480  -1.916
  204    HB2  TYR  36           2HB      TYR  36   1.509   3.209  -1.864
  205    HB3  TYR  36           1HB      TYR  36   1.654   3.279  -3.615
  206    HD1  TYR  36           1HD      TYR  36   1.916   5.249  -0.508
  207    HD2  TYR  36           2HD      TYR  36   2.639   5.167  -4.688
  208    HE1  TYR  36           1HE      TYR  36   3.296   7.267  -0.300
  209    HE2  TYR  36           2HE      TYR  36   4.019   7.182  -4.509
  210    HH   TYR  36           HH       TYR  36   4.207   9.077  -3.011
  211    H    LYS  37           H        LYS  37   0.105   3.795  -5.335
  212    HA   LYS  37           HA       LYS  37   0.240   6.563  -5.991
  213    HB2  LYS  37           2HB      LYS  37   1.452   4.702  -7.164
  214    HB3  LYS  37           1HB      LYS  37  -0.087   4.245  -7.881
  215    HG2  LYS  37           2HG      LYS  37  -0.242   6.464  -8.918
  216    HG3  LYS  37           1HG      LYS  37   1.328   6.874  -8.232
  217    HD2  LYS  37           2HD      LYS  37   1.604   6.218 -10.537
  218    HD3  LYS  37           1HD      LYS  37   2.321   4.989  -9.492
  219    HE2  LYS  37           2HE      LYS  37   0.392   3.572  -9.766
  220    HE3  LYS  37           1HE      LYS  37  -0.440   4.826 -10.687
  221    HZ1  LYS  37           3HZ      LYS  37   1.314   4.653 -12.346
  222    HZ2  LYS  37           1HZ      LYS  37   0.459   3.211 -12.156
  223    HZ3  LYS  37           2HZ      LYS  37   1.998   3.349 -11.492
  224    H    SER  38           H        SER  38  -2.353   4.401  -5.608
  225    HA   SER  38           HA       SER  38  -4.125   6.043  -7.256
  226    HB2  SER  38           2HB      SER  38  -4.670   3.386  -5.939
  227    HB3  SER  38           1HB      SER  38  -5.676   4.190  -7.143
  228    HG   SER  38           HG       SER  38  -3.529   2.610  -7.441
  229    H    TYR  39           H        TYR  39  -2.950   6.386  -4.376
  230    HA   TYR  39           HA       TYR  39  -3.533   7.616  -2.562
  231    HB2  TYR  39           2HB      TYR  39  -6.245   7.912  -3.873
  232    HB3  TYR  39           1HB      TYR  39  -5.696   8.817  -2.471
  233    HD1  TYR  39           2HD      TYR  39  -3.987  10.565  -2.732
  234    HD2  TYR  39           1HD      TYR  39  -5.513   8.449  -6.079
  235    HE1  TYR  39           2HE      TYR  39  -3.063  12.269  -4.226
  236    HE2  TYR  39           1HE      TYR  39  -4.595  10.136  -7.587
  237    HH   TYR  39           HH       TYR  39  -3.913  12.428  -7.537
  238    H    ASN  40           H        ASN  40  -4.086   4.651  -2.705
  239    HA   ASN  40           HA       ASN  40  -6.123   4.618  -0.605
  240    HB2  ASN  40           2HB      ASN  40  -5.514   2.519  -2.659
  241    HB3  ASN  40           1HB      ASN  40  -6.375   2.140  -1.172
  242   HD21  ASN  40          1HD2      ASN  40  -6.511   3.785  -4.211
  243   HD22  ASN  40          2HD2      ASN  40  -8.206   4.071  -4.189
  244    H    SER  41           H        SER  41  -5.941   3.281   1.172
  245    HA   SER  41           HA       SER  41  -3.314   2.889   2.098
  246    HB2  SER  41           2HB      SER  41  -5.878   2.281   3.473
  247    HB3  SER  41           1HB      SER  41  -4.400   3.050   4.064
  248    HG   SER  41           HG       SER  41  -5.740   4.798   3.809
  249    H    CYS  42           H        CYS  42  -3.365   0.691   3.567
  250    HA   CYS  42           HA       CYS  42  -4.061  -1.389   1.628
  251    HB2  CYS  42           2HB      CYS  42  -1.700  -1.207   3.436
  252    HB3  CYS  42           1HB      CYS  42  -2.168  -2.705   2.631
  253    H    ALA  43           H        ALA  43  -5.614  -0.474   4.091
  254    HA   ALA  43           HA       ALA  43  -5.639  -2.843   5.697
  255    HB1  ALA  43           1HB      ALA  43  -7.755  -0.704   5.410
  256    HB2  ALA  43           2HB      ALA  43  -6.444  -0.689   6.589
  257    HB3  ALA  43           3HB      ALA  43  -7.695  -1.932   6.674
  258    H    GLY  44           H        GLY  44  -6.360  -4.740   5.038
  259    HA2  GLY  44           2HA      GLY  44  -8.199  -6.082   4.206
  260    HA3  GLY  44           1HA      GLY  44  -8.515  -4.808   3.046
  261    H    CYS  45           H        CYS  45  -5.356  -4.775   2.916
  262    HA   CYS  45           HA       CYS  45  -5.223  -6.432   0.547
  263    HB2  CYS  45           2HB      CYS  45  -3.046  -4.934   2.019
  264    HB3  CYS  45           1HB      CYS  45  -2.864  -5.709   0.458
  265    H    HIS  46           H        HIS  46  -3.065  -7.806   0.438
  266    HA   HIS  46           HA       HIS  46  -2.850  -9.303   2.953
  267    HB2  HIS  46           2HB      HIS  46  -2.685 -10.342   0.118
  268    HB3  HIS  46           1HB      HIS  46  -2.109 -11.263   1.501
  269    HD1  HIS  46           1HD      HIS  46  -4.010 -11.878   3.325
  270    HD2  HIS  46           2HD      HIS  46  -5.363 -10.557  -0.370
  271    HE1  HIS  46           1HE      HIS  46  -6.419 -12.530   3.216
  272    HE2  HIS  46           2HE      HIS  46  -7.111 -11.980   0.868
  273    H    CYS  47           H        CYS  47  -1.439  -6.996   1.816
  274    HA   CYS  47           HA       CYS  47   1.197  -7.779   1.175
  275    HB2  CYS  47           2HB      CYS  47   1.739  -5.354   1.672
  276    HB3  CYS  47           1HB      CYS  47   0.582  -5.635   0.388
  277    H    VAL  48           H        VAL  48   2.995  -7.848   2.326
  278    HA   VAL  48           HA       VAL  48   2.752  -7.966   5.258
  279    HB   VAL  48           HB       VAL  48   4.566  -9.578   3.424
  280   HG11  VAL  48          1HG1      VAL  48   5.639  -9.098   5.549
  281   HG12  VAL  48          2HG1      VAL  48   5.214 -10.806   5.437
  282   HG13  VAL  48          3HG1      VAL  48   4.233  -9.715   6.417
  283   HG21  VAL  48          3HG2      VAL  48   3.265 -11.527   4.169
  284   HG22  VAL  48          1HG2      VAL  48   2.270 -10.356   3.299
  285   HG23  VAL  48          2HG2      VAL  48   2.190 -10.442   5.057
  286    H    GLY  49           H        GLY  49   4.157  -6.695   6.347
  287    HA2  GLY  49           2HA      GLY  49   5.867  -5.222   6.739
  288    HA3  GLY  49           1HA      GLY  49   6.615  -5.733   5.222
  289    H    CYS  50           H        CYS  50   3.460  -4.418   5.909
  290    HA   CYS  50           HA       CYS  50   3.647  -2.758   3.585
  291    HB2  CYS  50           2HB      CYS  50   1.582  -3.824   3.848
  292    HB3  CYS  50           1HB      CYS  50   1.462  -3.356   5.539
  293    H    LYS  51           H        LYS  51   4.852  -0.971   3.859
  294    HA   LYS  51           HA       LYS  51   3.924   0.805   5.985
  295    HB2  LYS  51           2HB      LYS  51   6.335   1.024   4.150
  296    HB3  LYS  51           1HB      LYS  51   5.795   2.335   5.174
  297    HG2  LYS  51           2HG      LYS  51   7.670   1.291   6.218
  298    HG3  LYS  51           1HG      LYS  51   6.231   0.890   7.144
  299    HD2  LYS  51           2HD      LYS  51   6.178  -1.326   6.165
  300    HD3  LYS  51           1HD      LYS  51   7.534  -0.921   5.114
  301    HE2  LYS  51           2HE      LYS  51   8.313  -2.227   7.004
  302    HE3  LYS  51           1HE      LYS  51   8.951  -0.595   7.086
  303    HZ1  LYS  51           3HZ      LYS  51   6.657  -1.651   8.645
  304    HZ2  LYS  51           1HZ      LYS  51   7.214  -0.056   8.732
  305    HZ3  LYS  51           2HZ      LYS  51   8.191  -1.316   9.252
  306    H    ASN  52           H        ASN  52   2.023   1.364   5.146
  307    HA   ASN  52           HA       ASN  52   2.091   2.722   2.561
  308    HB2  ASN  52           2HB      ASN  52   0.490   0.847   2.629
  309    HB3  ASN  52           1HB      ASN  52  -0.298   1.562   4.027
  310   HD21  ASN  52          1HD2      ASN  52   0.090   1.701   0.571
  311   HD22  ASN  52          2HD2      ASN  52  -1.193   2.834   0.320
  312    HA   PRO  53           HA       PRO  53   1.920   6.286   5.300
  313    HB2  PRO  53           2HB      PRO  53   1.605   7.714   2.739
  314    HB3  PRO  53           1HB      PRO  53   2.802   7.946   4.014
  315    HG2  PRO  53           2HG      PRO  53   3.502   6.805   1.737
  316    HG3  PRO  53           1HG      PRO  53   4.106   6.180   3.288
  317    HD2  PRO  53           2HD      PRO  53   1.892   5.128   1.561
  318    HD3  PRO  53           1HD      PRO  53   3.222   4.262   2.372
  319    H    HIS  54           H        HIS  54  -0.601   5.157   3.340
  320    HA   HIS  54           HA       HIS  54  -2.291   7.450   3.970
  321    HB2  HIS  54           2HB      HIS  54  -2.791   5.090   2.154
  322    HB3  HIS  54           1HB      HIS  54  -4.032   6.256   2.574
  323    HD1  HIS  54           1HD      HIS  54  -4.138   8.332   1.183
  324    HD2  HIS  54           2HD      HIS  54  -0.634   6.188   0.588
  325    HE1  HIS  54           1HE      HIS  54  -3.028   9.398  -0.777
  326    HE2  HIS  54           2HE      HIS  54  -0.783   8.347  -0.834
  327    H    LYS  55           H        LYS  55  -3.833   7.380   5.372
  328    HA   LYS  55           HA       LYS  55  -4.263   4.977   6.986
  329    HB2  LYS  55           2HB      LYS  55  -3.811   7.188   8.053
  330    HB3  LYS  55           1HB      LYS  55  -5.191   7.861   7.212
  331    HG2  LYS  55           2HG      LYS  55  -5.775   7.500   9.501
  332    HG3  LYS  55           1HG      LYS  55  -6.651   6.330   8.514
  333    HD2  LYS  55           2HD      LYS  55  -5.080   4.591   9.132
  334    HD3  LYS  55           1HD      LYS  55  -4.092   5.762  10.005
  335    HE2  LYS  55           2HE      LYS  55  -5.906   6.189  11.558
  336    HE3  LYS  55           1HE      LYS  55  -6.956   5.094  10.672
  337    HZ1  LYS  55           3HZ      LYS  55  -4.439   4.292  12.024
  338    HZ2  LYS  55           1HZ      LYS  55  -5.555   3.255  11.306
  339    HZ3  LYS  55           2HZ      LYS  55  -5.963   4.125  12.695
  340    H    GLU  56           H        GLU  56  -6.568   4.187   7.114
  341    HA   GLU  56           HA       GLU  56  -8.038   4.449   4.721
  342    HB2  GLU  56           2HB      GLU  56  -8.921   3.596   7.489
  343    HB3  GLU  56           1HB      GLU  56  -9.948   3.509   6.071
  344    HG2  GLU  56           2HG      GLU  56  -7.306   2.120   6.286
  345    HG3  GLU  56           1HG      GLU  56  -8.836   1.355   6.751
  346    H    ASP  57           H        ASP  57  -8.864   6.196   4.048
  347    HA   ASP  57           HA       ASP  57  -9.027   8.565   5.610
  348    HB2  ASP  57           2HB      ASP  57  -8.420   8.510   3.177
  349    HB3  ASP  57           1HB      ASP  57 -10.126   8.076   2.938
  350    H    TYR  58           H        TYR  58 -10.426   7.832   7.071
  351    HA   TYR  58           HA       TYR  58 -13.096   8.836   6.534
  352    HB2  TYR  58           2HB      TYR  58 -12.933   6.187   6.469
  353    HB3  TYR  58           1HB      TYR  58 -12.919   6.365   8.220
  354    HD1  TYR  58           1HD      TYR  58 -14.840   7.197   5.179
  355    HD2  TYR  58           2HD      TYR  58 -14.965   6.669   9.394
  356    HE1  TYR  58           1HE      TYR  58 -17.283   7.316   5.107
  357    HE2  TYR  58           2HE      TYR  58 -17.426   6.791   9.337
  358    HH   TYR  58           HH       TYR  58 -19.158   7.763   7.830
  359    H    VAL  59           H        VAL  59 -12.277  10.588   7.637
  360    HA   VAL  59           HA       VAL  59 -11.300  10.303  10.332
  361    HB   VAL  59           HB       VAL  59 -12.002  12.836   8.801
  362   HG11  VAL  59          1HG1      VAL  59 -10.351  12.454  11.301
  363   HG12  VAL  59          2HG1      VAL  59 -11.951  13.186  11.212
  364   HG13  VAL  59          3HG1      VAL  59 -10.572  13.978  10.438
  365   HG21  VAL  59          3HG2      VAL  59  -9.320  11.491   9.159
  366   HG22  VAL  59          1HG2      VAL  59  -9.590  13.048   8.377
  367   HG23  VAL  59          2HG2      VAL  59 -10.242  11.575   7.660
  Start of MODEL   19
    1    H1   SER   8           1HT      SER   8 -18.862   3.035   2.026
    2    H2   SER   8           2HT      SER   8 -19.045   1.889   0.787
    3    H3   SER   8           3HT      SER   8 -18.838   3.497   0.394
    4    HA   SER   8           HA       SER   8 -16.628   3.464   1.258
    5    HB2  SER   8           2HB      SER   8 -17.034   1.706   2.998
    6    HB3  SER   8           1HB      SER   8 -17.181   0.511   1.713
    7    HG   SER   8           HG       SER   8 -15.106   0.315   1.844
    8    HA   PRO   9           HA       PRO   9 -16.122   2.195  -3.004
    9    HB2  PRO   9           2HB      PRO   9 -13.804   3.518  -3.461
   10    HB3  PRO   9           1HB      PRO   9 -15.361   4.349  -3.442
   11    HG2  PRO   9           2HG      PRO   9 -13.238   4.252  -1.353
   12    HG3  PRO   9           1HG      PRO   9 -14.312   5.587  -1.797
   13    HD2  PRO   9           2HD      PRO   9 -14.669   3.932   0.388
   14    HD3  PRO   9           1HD      PRO   9 -15.949   4.886  -0.380
   15    HA   PRO  10           HA       PRO  10 -13.381  -1.203  -1.983
   16    HB2  PRO  10           2HB      PRO  10 -13.140  -2.207  -4.546
   17    HB3  PRO  10           1HB      PRO  10 -14.494  -2.575  -3.472
   18    HG2  PRO  10           2HG      PRO  10 -14.328  -0.603  -5.702
   19    HG3  PRO  10           1HG      PRO  10 -15.681  -1.644  -5.232
   20    HD2  PRO  10           2HD      PRO  10 -15.591   0.982  -4.634
   21    HD3  PRO  10           1HD      PRO  10 -16.366  -0.211  -3.571
   22    H    LYS  11           H        LYS  11 -11.250  -1.034  -1.753
   23    HA   LYS  11           HA       LYS  11  -9.900   0.698  -3.637
   24    HB2  LYS  11           2HB      LYS  11  -8.220   1.107  -1.830
   25    HB3  LYS  11           1HB      LYS  11  -9.847   1.666  -1.490
   26    HG2  LYS  11           2HG      LYS  11 -10.178  -0.325  -0.047
   27    HG3  LYS  11           1HG      LYS  11  -8.499  -0.785  -0.349
   28    HD2  LYS  11           2HD      LYS  11  -8.670   0.404   1.781
   29    HD3  LYS  11           1HD      LYS  11  -7.755   1.369   0.623
   30    HE2  LYS  11           2HE      LYS  11  -9.817   2.668   0.138
   31    HE3  LYS  11           1HE      LYS  11 -10.668   1.729   1.359
   32    HZ1  LYS  11           3HZ      LYS  11  -8.347   3.524   1.824
   33    HZ2  LYS  11           1HZ      LYS  11  -9.154   2.692   3.044
   34    HZ3  LYS  11           2HZ      LYS  11  -9.932   3.899   2.151
   35    HA   PRO  12           HA       PRO  12  -7.322  -2.378  -5.323
   36    HB2  PRO  12           2HB      PRO  12  -4.942  -0.772  -4.677
   37    HB3  PRO  12           1HB      PRO  12  -5.512  -1.326  -6.244
   38    HG2  PRO  12           2HG      PRO  12  -5.726   1.242  -5.538
   39    HG3  PRO  12           1HG      PRO  12  -6.953   0.431  -6.524
   40    HD2  PRO  12           2HD      PRO  12  -7.023   1.185  -3.652
   41    HD3  PRO  12           1HD      PRO  12  -8.329   1.157  -4.851
   42    H    LYS  13           H        LYS  13  -6.119  -4.098  -4.706
   43    HA   LYS  13           HA       LYS  13  -4.938  -3.973  -2.063
   44    HB2  LYS  13           2HB      LYS  13  -5.584  -6.367  -1.701
   45    HB3  LYS  13           1HB      LYS  13  -6.931  -5.245  -1.735
   46    HG2  LYS  13           2HG      LYS  13  -7.334  -5.949  -4.089
   47    HG3  LYS  13           1HG      LYS  13  -6.101  -7.203  -3.873
   48    HD2  LYS  13           2HD      LYS  13  -7.376  -8.110  -2.002
   49    HD3  LYS  13           1HD      LYS  13  -8.589  -6.845  -2.208
   50    HE2  LYS  13           2HE      LYS  13  -8.971  -7.728  -4.519
   51    HE3  LYS  13           1HE      LYS  13  -7.911  -9.072  -4.111
   52    HZ1  LYS  13           3HZ      LYS  13  -9.447  -9.595  -2.249
   53    HZ2  LYS  13           1HZ      LYS  13 -10.181  -9.700  -3.761
   54    HZ3  LYS  13           2HZ      LYS  13 -10.470  -8.377  -2.785
   55    H    CYS  14           H        CYS  14  -3.137  -5.298  -1.711
   56    HA   CYS  14           HA       CYS  14  -1.734  -5.974  -4.193
   57    HB2  CYS  14           2HB      CYS  14   0.209  -4.664  -3.397
   58    HB3  CYS  14           1HB      CYS  14  -1.217  -3.686  -3.614
   59    H    ARG  15           H        ARG  15   0.307  -7.149  -3.756
   60    HA   ARG  15           HA       ARG  15   0.175  -8.853  -1.357
   61    HB2  ARG  15           2HB      ARG  15   0.902  -9.501  -4.228
   62    HB3  ARG  15           1HB      ARG  15   1.470 -10.494  -2.907
   63    HG2  ARG  15           2HG      ARG  15  -0.473 -11.473  -4.007
   64    HG3  ARG  15           1HG      ARG  15  -0.818 -11.080  -2.326
   65    HD2  ARG  15           2HD      ARG  15  -2.688 -10.552  -3.819
   66    HD3  ARG  15           1HD      ARG  15  -2.057  -9.117  -3.018
   67    HE   ARG  15           HE       ARG  15  -0.790  -9.296  -5.469
   68   HH11  ARG  15          1HH1      ARG  15  -4.128  -8.960  -4.350
   69   HH12  ARG  15          2HH1      ARG  15  -4.650  -8.101  -5.727
   70   HH21  ARG  15          1HH2      ARG  15  -1.507  -8.078  -7.343
   71   HH22  ARG  15          2HH2      ARG  15  -3.132  -7.588  -7.454
   72    H    CYS  16           H        CYS  16   1.502  -6.304  -1.886
   73    HA   CYS  16           HA       CYS  16   4.238  -6.434  -2.352
   74    HB2  CYS  16           2HB      CYS  16   2.726  -4.618  -0.460
   75    HB3  CYS  16           1HB      CYS  16   4.377  -4.353  -0.986
   76    H    GLY  17           H        GLY  17   5.950  -7.089  -1.156
   77    HA2  GLY  17           2HA      GLY  17   7.047  -7.430   0.949
   78    HA3  GLY  17           1HA      GLY  17   5.472  -7.781   1.657
   79    H    ILE  18           H        ILE  18   4.504  -9.414  -0.360
   80    HA   ILE  18           HA       ILE  18   5.894 -11.900   0.197
   81    HB   ILE  18           HB       ILE  18   3.545 -11.435  -1.665
   82   HG12  ILE  18          2HG1      ILE  18   3.486 -12.031   1.303
   83   HG13  ILE  18          1HG1      ILE  18   3.001 -10.536   0.536
   84   HG21  ILE  18          1HG2      ILE  18   4.664 -13.598  -1.907
   85   HG22  ILE  18          2HG2      ILE  18   3.049 -13.793  -1.228
   86   HG23  ILE  18          3HG2      ILE  18   4.460 -13.904  -0.178
   87   HD11  ILE  18          3HD1      ILE  18   1.655 -13.191   0.106
   88   HD12  ILE  18          1HD1      ILE  18   1.186 -11.655  -0.623
   89   HD13  ILE  18          2HD1      ILE  18   1.060 -11.878   1.123
   90    H    SER  19           H        SER  19   4.796 -10.027  -2.553
   91    HA   SER  19           HA       SER  19   7.210 -10.698  -4.013
   92    HB2  SER  19           2HB      SER  19   4.396 -10.810  -5.142
   93    HB3  SER  19           1HB      SER  19   5.890 -11.081  -6.048
   94    HG   SER  19           HG       SER  19   6.075 -12.687  -4.041
   95    H    GLY  20           H        GLY  20   8.117  -8.769  -4.085
   96    HA2  GLY  20           2HA      GLY  20   7.577  -6.718  -5.647
   97    HA3  GLY  20           1HA      GLY  20   6.523  -6.362  -4.279
   98    H    SER  21           H        SER  21   9.861  -7.389  -4.900
   99    HA   SER  21           HA       SER  21  10.765  -6.226  -2.477
  100    HB2  SER  21           2HB      SER  21  13.040  -6.803  -3.497
  101    HB3  SER  21           1HB      SER  21  11.944  -8.148  -3.188
  102    HG   SER  21           HG       SER  21  12.075  -6.823  -5.685
  103    H    SER  22           H        SER  22  10.494  -4.125  -2.392
  104    HA   SER  22           HA       SER  22  12.112  -2.449  -4.143
  105    HB2  SER  22           2HB      SER  22   9.188  -1.921  -3.479
  106    HB3  SER  22           1HB      SER  22  10.239  -0.871  -4.432
  107    HG   SER  22           HG       SER  22  10.293  -3.386  -5.354
  108    H    ASN  23           H        ASN  23  12.595  -3.469  -1.627
  109    HA   ASN  23           HA       ASN  23  13.368  -2.984   0.409
  110    HB2  ASN  23           2HB      ASN  23  12.791  -0.112  -0.329
  111    HB3  ASN  23           1HB      ASN  23  13.396  -0.560   1.255
  112   HD21  ASN  23          1HD2      ASN  23  14.126  -0.196  -2.078
  113   HD22  ASN  23          2HD2      ASN  23  15.831  -0.420  -1.945
  114    H    THR  24           H        THR  24  12.594  -3.242   2.389
  115    HA   THR  24           HA       THR  24   9.788  -3.388   2.670
  116    HB   THR  24           HB       THR  24  11.870  -3.570   4.875
  117    HG1  THR  24           1HG      THR  24  12.559  -5.231   3.761
  118   HG21  THR  24          3HG2      THR  24   9.164  -4.905   4.525
  119   HG22  THR  24          1HG2      THR  24   9.499  -3.567   5.626
  120   HG23  THR  24          2HG2      THR  24  10.256  -5.136   5.891
  121    H    LEU  25           H        LEU  25  11.904  -0.798   3.016
  122    HA   LEU  25           HA       LEU  25  10.353   0.705   4.943
  123    HB2  LEU  25           2HB      LEU  25  12.549   1.546   3.064
  124    HB3  LEU  25           1HB      LEU  25  11.843   2.559   4.299
  125    HG   LEU  25           HG       LEU  25  13.375   0.019   4.831
  126   HD11  LEU  25          1HD1      LEU  25  15.141   1.527   5.620
  127   HD12  LEU  25          2HD1      LEU  25  14.178   2.909   5.096
  128   HD13  LEU  25          3HD1      LEU  25  14.796   1.765   3.907
  129   HD21  LEU  25          3HD2      LEU  25  11.698   0.542   6.546
  130   HD22  LEU  25          1HD2      LEU  25  12.353   2.170   6.690
  131   HD23  LEU  25          2HD2      LEU  25  13.332   0.775   7.159
  132    H    THR  26           H        THR  26  10.264   0.068   1.580
  133    HA   THR  26           HA       THR  26   8.408   2.242   1.275
  134    HB   THR  26           HB       THR  26   9.431   2.326  -1.173
  135    HG1  THR  26           1HG      THR  26  11.023   0.810  -1.003
  136   HG21  THR  26          3HG2      THR  26  10.875   4.184  -0.429
  137   HG22  THR  26          1HG2      THR  26  10.714   3.636   1.238
  138   HG23  THR  26          2HG2      THR  26   9.304   4.241   0.368
  139    H    THR  27           H        THR  27   8.144  -0.815   1.543
  140    HA   THR  27           HA       THR  27   7.662  -2.184  -0.761
  141    HB   THR  27           HB       THR  27   5.791  -2.595   1.509
  142    HG1  THR  27           1HG      THR  27   7.384  -2.975   2.945
  143   HG21  THR  27          3HG2      THR  27   6.171  -4.243  -0.341
  144   HG22  THR  27          1HG2      THR  27   6.536  -4.889   1.259
  145   HG23  THR  27          2HG2      THR  27   7.842  -4.382   0.195
  146    H    CYS  28           H        CYS  28   5.103  -0.805   1.259
  147    HA   CYS  28           HA       CYS  28   3.365  -0.688  -1.024
  148    HB2  CYS  28           2HB      CYS  28   2.831  -0.469   1.910
  149    HB3  CYS  28           1HB      CYS  28   1.576  -0.117   0.724
  150    H    ARG  29           H        ARG  29   5.530   1.232   0.125
  151    HA   ARG  29           HA       ARG  29   4.077   3.769  -0.004
  152    HB2  ARG  29           2HB      ARG  29   5.398   3.274   1.960
  153    HB3  ARG  29           1HB      ARG  29   6.774   2.922   0.950
  154    HG2  ARG  29           2HG      ARG  29   6.883   5.324   0.353
  155    HG3  ARG  29           1HG      ARG  29   5.544   5.610   1.466
  156    HD2  ARG  29           2HD      ARG  29   6.768   4.947   3.341
  157    HD3  ARG  29           1HD      ARG  29   8.017   4.180   2.371
  158    HE   ARG  29           HE       ARG  29   7.818   6.979   1.907
  159   HH11  ARG  29          1HH1      ARG  29   9.208   4.521   4.085
  160   HH12  ARG  29          2HH1      ARG  29  10.482   5.541   4.598
  161   HH21  ARG  29          1HH2      ARG  29   9.624   8.285   2.568
  162   HH22  ARG  29          2HH2      ARG  29  10.742   7.678   3.702
  163    H    ASN  30           H        ASN  30   5.364   1.873  -2.278
  164    HA   ASN  30           HA       ASN  30   6.624   4.146  -3.647
  165    HB2  ASN  30           2HB      ASN  30   8.158   2.738  -4.814
  166    HB3  ASN  30           1HB      ASN  30   8.193   2.166  -3.151
  167   HD21  ASN  30          1HD2      ASN  30   7.337   0.149  -2.698
  168   HD22  ASN  30          2HD2      ASN  30   6.938  -0.991  -3.929
  169    H    SER  31           H        SER  31   6.534   3.721  -6.173
  170    HA   SER  31           HA       SER  31   3.794   4.081  -6.729
  171    HB2  SER  31           2HB      SER  31   6.097   3.858  -8.640
  172    HB3  SER  31           1HB      SER  31   4.552   4.674  -8.908
  173    HG   SER  31           HG       SER  31   5.065   6.121  -7.290
  174    H    ARG  32           H        ARG  32   5.534   1.171  -6.590
  175    HA   ARG  32           HA       ARG  32   4.080  -0.121  -8.751
  176    HB2  ARG  32           2HB      ARG  32   5.956  -1.252  -6.681
  177    HB3  ARG  32           1HB      ARG  32   5.278  -2.148  -8.039
  178    HG2  ARG  32           2HG      ARG  32   6.425  -0.781  -9.602
  179    HG3  ARG  32           1HG      ARG  32   6.948   0.311  -8.320
  180    HD2  ARG  32           2HD      ARG  32   8.278  -1.469  -7.336
  181    HD3  ARG  32           1HD      ARG  32   7.740  -2.577  -8.604
  182    HE   ARG  32           HE       ARG  32   8.730  -0.537  -9.987
  183   HH11  ARG  32          1HH1      ARG  32  10.114  -2.306  -7.261
  184   HH12  ARG  32          2HH1      ARG  32  11.709  -2.252  -7.847
  185   HH21  ARG  32          1HH2      ARG  32  10.873  -0.441 -10.798
  186   HH22  ARG  32          2HH2      ARG  32  12.160  -1.154  -9.949
  187    H    CYS  33           H        CYS  33   3.563   0.657  -5.560
  188    HA   CYS  33           HA       CYS  33   1.823  -1.567  -5.047
  189    HB2  CYS  33           2HB      CYS  33   3.145  -0.584  -3.203
  190    HB3  CYS  33           1HB      CYS  33   2.335   0.957  -3.444
  191    HA   PRO  34           HA       PRO  34  -1.266   0.547  -7.506
  192    HB2  PRO  34           2HB      PRO  34  -3.368  -1.070  -6.677
  193    HB3  PRO  34           1HB      PRO  34  -2.269  -1.455  -8.010
  194    HG2  PRO  34           2HG      PRO  34  -2.240  -2.356  -5.165
  195    HG3  PRO  34           1HG      PRO  34  -1.896  -3.284  -6.637
  196    HD2  PRO  34           2HD      PRO  34   0.055  -2.425  -5.060
  197    HD3  PRO  34           1HD      PRO  34   0.250  -2.413  -6.828
  198    H    CYS  35           H        CYS  35  -1.465  -0.084  -4.166
  199    HA   CYS  35           HA       CYS  35  -3.789   1.414  -3.509
  200    HB2  CYS  35           2HB      CYS  35  -1.429   0.644  -1.828
  201    HB3  CYS  35           1HB      CYS  35  -3.004   1.148  -1.226
  202    H    TYR  36           H        TYR  36  -0.364   1.996  -2.927
  203    HA   TYR  36           HA       TYR  36  -0.491   4.597  -1.960
  204    HB2  TYR  36           2HB      TYR  36   1.489   3.182  -1.769
  205    HB3  TYR  36           1HB      TYR  36   1.745   3.287  -3.507
  206    HD1  TYR  36           2HD      TYR  36   1.786   5.195  -0.353
  207    HD2  TYR  36           1HD      TYR  36   2.847   5.172  -4.471
  208    HE1  TYR  36           2HE      TYR  36   3.146   7.211  -0.009
  209    HE2  TYR  36           1HE      TYR  36   4.205   7.180  -4.149
  210    HH   TYR  36           HH       TYR  36   4.236   9.093  -2.516
  211    H    LYS  37           H        LYS  37  -0.014   3.492  -5.285
  212    HA   LYS  37           HA       LYS  37   0.273   6.150  -6.289
  213    HB2  LYS  37           2HB      LYS  37   0.849   3.628  -7.235
  214    HB3  LYS  37           1HB      LYS  37  -0.524   4.091  -8.224
  215    HG2  LYS  37           2HG      LYS  37   1.997   5.722  -7.919
  216    HG3  LYS  37           1HG      LYS  37   1.664   4.610  -9.245
  217    HD2  LYS  37           2HD      LYS  37  -0.290   5.965  -9.878
  218    HD3  LYS  37           1HD      LYS  37   0.050   7.065  -8.544
  219    HE2  LYS  37           2HE      LYS  37   2.150   7.702  -9.537
  220    HE3  LYS  37           1HE      LYS  37   1.959   6.500 -10.811
  221    HZ1  LYS  37           3HZ      LYS  37   0.230   8.904 -10.415
  222    HZ2  LYS  37           1HZ      LYS  37   0.012   7.714 -11.593
  223    HZ3  LYS  37           2HZ      LYS  37   1.382   8.667 -11.624
  224    H    SER  38           H        SER  38  -2.372   4.383  -5.308
  225    HA   SER  38           HA       SER  38  -4.231   6.002  -6.902
  226    HB2  SER  38           2HB      SER  38  -4.487   3.477  -6.864
  227    HB3  SER  38           1HB      SER  38  -4.829   3.600  -5.143
  228    HG   SER  38           HG       SER  38  -6.446   3.906  -7.228
  229    H    TYR  39           H        TYR  39  -2.511   6.212  -4.174
  230    HA   TYR  39           HA       TYR  39  -2.548   7.390  -2.290
  231    HB2  TYR  39           2HB      TYR  39  -4.976   8.719  -3.533
  232    HB3  TYR  39           1HB      TYR  39  -4.153   9.308  -2.090
  233    HD1  TYR  39           1HD      TYR  39  -3.805   8.752  -5.719
  234    HD2  TYR  39           2HD      TYR  39  -2.070  10.492  -2.250
  235    HE1  TYR  39           1HE      TYR  39  -2.192   9.919  -7.128
  236    HE2  TYR  39           2HE      TYR  39  -0.447  11.685  -3.660
  237    HH   TYR  39           HH       TYR  39  -0.763  11.874  -7.052
  238    H    ASN  40           H        ASN  40  -4.003   4.882  -2.519
  239    HA   ASN  40           HA       ASN  40  -5.903   5.198  -0.338
  240    HB2  ASN  40           2HB      ASN  40  -5.653   3.031  -2.410
  241    HB3  ASN  40           1HB      ASN  40  -6.513   2.749  -0.904
  242   HD21  ASN  40          1HD2      ASN  40  -6.645   4.188  -4.041
  243   HD22  ASN  40          2HD2      ASN  40  -8.238   4.803  -3.883
  244    H    SER  41           H        SER  41  -5.959   3.551   1.265
  245    HA   SER  41           HA       SER  41  -3.377   2.936   2.347
  246    HB2  SER  41           2HB      SER  41  -4.979   2.141   4.160
  247    HB3  SER  41           1HB      SER  41  -4.976   3.873   3.788
  248    HG   SER  41           HG       SER  41  -7.124   2.667   3.852
  249    H    CYS  42           H        CYS  42  -3.334   0.735   3.474
  250    HA   CYS  42           HA       CYS  42  -4.171  -1.228   1.526
  251    HB2  CYS  42           2HB      CYS  42  -1.917  -1.292   3.512
  252    HB3  CYS  42           1HB      CYS  42  -2.467  -2.732   2.647
  253    H    ALA  43           H        ALA  43  -6.220  -0.891   2.479
  254    HA   ALA  43           HA       ALA  43  -6.606  -2.591   4.845
  255    HB1  ALA  43           1HB      ALA  43  -7.584  -0.337   5.036
  256    HB2  ALA  43           2HB      ALA  43  -8.833  -1.580   5.037
  257    HB3  ALA  43           3HB      ALA  43  -8.538  -0.629   3.583
  258    H    GLY  44           H        GLY  44  -6.828  -4.630   4.190
  259    HA2  GLY  44           2HA      GLY  44  -8.330  -6.279   3.283
  260    HA3  GLY  44           1HA      GLY  44  -8.734  -5.128   2.016
  261    H    CYS  45           H        CYS  45  -5.484  -5.209   2.810
  262    HA   CYS  45           HA       CYS  45  -4.902  -6.482   0.258
  263    HB2  CYS  45           2HB      CYS  45  -3.136  -4.884   2.099
  264    HB3  CYS  45           1HB      CYS  45  -2.660  -5.535   0.536
  265    H    HIS  46           H        HIS  46  -2.833  -7.772   0.276
  266    HA   HIS  46           HA       HIS  46  -2.771  -9.434   2.681
  267    HB2  HIS  46           2HB      HIS  46  -2.472 -10.231  -0.240
  268    HB3  HIS  46           1HB      HIS  46  -2.064 -11.293   1.101
  269    HD1  HIS  46           1HD      HIS  46  -3.867 -13.032   1.247
  270    HD2  HIS  46           2HD      HIS  46  -5.433  -9.279   0.386
  271    HE1  HIS  46           1HE      HIS  46  -6.345 -13.334   1.186
  272    HE2  HIS  46           2HE      HIS  46  -7.284 -11.056   0.713
  273    H    CYS  47           H        CYS  47  -1.383  -7.036   1.947
  274    HA   CYS  47           HA       CYS  47   1.270  -7.694   1.154
  275    HB2  CYS  47           2HB      CYS  47   1.760  -5.309   1.746
  276    HB3  CYS  47           1HB      CYS  47   0.545  -5.519   0.505
  277    H    VAL  48           H        VAL  48   3.082  -7.616   2.297
  278    HA   VAL  48           HA       VAL  48   2.901  -7.957   5.202
  279    HB   VAL  48           HB       VAL  48   4.709  -9.349   3.187
  280   HG11  VAL  48          1HG1      VAL  48   5.611 -10.610   5.073
  281   HG12  VAL  48          2HG1      VAL  48   4.646  -9.635   6.183
  282   HG13  VAL  48          3HG1      VAL  48   5.929  -8.883   5.236
  283   HG21  VAL  48          3HG2      VAL  48   2.455 -10.274   3.230
  284   HG22  VAL  48          1HG2      VAL  48   2.553 -10.471   4.978
  285   HG23  VAL  48          2HG2      VAL  48   3.605 -11.418   3.925
  286    H    GLY  49           H        GLY  49   4.363  -6.701   6.331
  287    HA2  GLY  49           2HA      GLY  49   6.013  -5.113   6.720
  288    HA3  GLY  49           1HA      GLY  49   6.756  -5.621   5.200
  289    H    CYS  50           H        CYS  50   3.562  -4.389   5.809
  290    HA   CYS  50           HA       CYS  50   3.675  -2.687   3.555
  291    HB2  CYS  50           2HB      CYS  50   1.621  -3.771   3.980
  292    HB3  CYS  50           1HB      CYS  50   1.603  -3.222   5.651
  293    H    LYS  51           H        LYS  51   4.879  -0.938   3.767
  294    HA   LYS  51           HA       LYS  51   4.224   0.823   6.009
  295    HB2  LYS  51           2HB      LYS  51   6.398   1.029   3.916
  296    HB3  LYS  51           1HB      LYS  51   6.118   2.184   5.205
  297    HG2  LYS  51           2HG      LYS  51   6.928  -0.684   5.568
  298    HG3  LYS  51           1HG      LYS  51   8.007   0.708   5.649
  299    HD2  LYS  51           2HD      LYS  51   6.554   1.581   7.515
  300    HD3  LYS  51           1HD      LYS  51   5.727   0.019   7.500
  301    HE2  LYS  51           2HE      LYS  51   7.466   0.046   9.197
  302    HE3  LYS  51           1HE      LYS  51   7.870  -1.099   7.913
  303    HZ1  LYS  51           3HZ      LYS  51   9.796   0.217   8.486
  304    HZ2  LYS  51           1HZ      LYS  51   8.954   1.649   8.205
  305    HZ3  LYS  51           2HZ      LYS  51   9.300   0.623   6.933
  306    H    ASN  52           H        ASN  52   2.217   1.445   5.206
  307    HA   ASN  52           HA       ASN  52   2.364   2.956   2.712
  308    HB2  ASN  52           2HB      ASN  52   0.704   1.050   2.792
  309    HB3  ASN  52           1HB      ASN  52  -0.160   1.896   4.055
  310   HD21  ASN  52          1HD2      ASN  52  -1.164   1.121   1.515
  311   HD22  ASN  52          2HD2      ASN  52  -1.620   2.575   0.694
  312    HA   PRO  53           HA       PRO  53   2.126   6.484   5.581
  313    HB2  PRO  53           2HB      PRO  53   1.590   7.858   2.986
  314    HB3  PRO  53           1HB      PRO  53   2.738   8.288   4.257
  315    HG2  PRO  53           2HG      PRO  53   3.619   7.198   2.015
  316    HG3  PRO  53           1HG      PRO  53   4.293   6.693   3.573
  317    HD2  PRO  53           2HD      PRO  53   2.324   5.279   1.825
  318    HD3  PRO  53           1HD      PRO  53   3.676   4.623   2.766
  319    H    HIS  54           H        HIS  54  -0.111   5.475   3.139
  320    HA   HIS  54           HA       HIS  54  -2.230   7.169   4.117
  321    HB2  HIS  54           2HB      HIS  54  -2.255   5.052   1.954
  322    HB3  HIS  54           1HB      HIS  54  -3.633   6.061   2.380
  323    HD1  HIS  54           1HD      HIS  54  -3.393   8.641   1.809
  324    HD2  HIS  54           2HD      HIS  54  -0.423   6.188   0.257
  325    HE1  HIS  54           1HE      HIS  54  -2.263   9.987   0.026
  326    HE2  HIS  54           2HE      HIS  54  -0.372   8.578  -0.765
  327    H    LYS  55           H        LYS  55  -4.192   6.297   4.926
  328    HA   LYS  55           HA       LYS  55  -4.090   3.683   6.107
  329    HB2  LYS  55           2HB      LYS  55  -4.234   4.746   8.413
  330    HB3  LYS  55           1HB      LYS  55  -2.655   4.715   7.636
  331    HG2  LYS  55           2HG      LYS  55  -3.133   7.046   6.826
  332    HG3  LYS  55           1HG      LYS  55  -4.518   7.050   7.915
  333    HD2  LYS  55           2HD      LYS  55  -3.116   6.704   9.796
  334    HD3  LYS  55           1HD      LYS  55  -1.717   6.448   8.742
  335    HE2  LYS  55           2HE      LYS  55  -3.274   9.027   9.016
  336    HE3  LYS  55           1HE      LYS  55  -1.696   8.702   9.732
  337    HZ1  LYS  55           3HZ      LYS  55  -1.368   9.939   7.741
  338    HZ2  LYS  55           1HZ      LYS  55  -2.319   8.886   6.825
  339    HZ3  LYS  55           2HZ      LYS  55  -0.843   8.374   7.430
  340    H    GLU  56           H        GLU  56  -6.065   3.611   7.741
  341    HA   GLU  56           HA       GLU  56  -8.293   4.789   6.343
  342    HB2  GLU  56           2HB      GLU  56  -8.229   3.031   8.813
  343    HB3  GLU  56           1HB      GLU  56  -9.688   3.574   7.996
  344    HG2  GLU  56           2HG      GLU  56  -7.543   1.938   6.748
  345    HG3  GLU  56           1HG      GLU  56  -9.032   1.252   7.432
  346    H    ASP  57           H        ASP  57  -7.875   6.816   6.657
  347    HA   ASP  57           HA       ASP  57  -8.616   7.986   9.251
  348    HB2  ASP  57           2HB      ASP  57  -6.053   7.875   8.944
  349    HB3  ASP  57           1HB      ASP  57  -6.307   9.005   7.615
  350    H    TYR  58           H        TYR  58 -10.142   9.391   8.843
  351    HA   TYR  58           HA       TYR  58 -11.075   9.887   6.249
  352    HB2  TYR  58           2HB      TYR  58 -12.515   9.838   8.253
  353    HB3  TYR  58           1HB      TYR  58 -11.780  11.337   8.805
  354    HD1  TYR  58           1HD      TYR  58 -13.442   9.972   5.764
  355    HD2  TYR  58           2HD      TYR  58 -12.952  13.284   8.375
  356    HE1  TYR  58           1HE      TYR  58 -15.122  11.211   4.496
  357    HE2  TYR  58           2HE      TYR  58 -14.639  14.537   7.105
  358    HH   TYR  58           HH       TYR  58 -15.593  14.549   4.915
  359    H    VAL  59           H        VAL  59 -10.340  11.203   4.813
  360    HA   VAL  59           HA       VAL  59  -8.305  13.054   5.320
  361    HB   VAL  59           HB       VAL  59  -8.396  11.928   3.175
  362   HG11  VAL  59          1HG1      VAL  59 -10.039  12.444   1.448
  363   HG12  VAL  59          2HG1      VAL  59 -10.922  13.445   2.595
  364   HG13  VAL  59          3HG1      VAL  59 -10.788  11.709   2.868
  365   HG21  VAL  59          3HG2      VAL  59  -8.753  14.905   2.862
  366   HG22  VAL  59          1HG2      VAL  59  -8.056  13.834   1.645
  367   HG23  VAL  59          2HG2      VAL  59  -7.248  14.042   3.196
  Start of MODEL   20
    1    H1   SER   8           1HT      SER   8 -19.333  -1.032   1.642
    2    H2   SER   8           2HT      SER   8 -20.329   0.000   0.752
    3    H3   SER   8           3HT      SER   8 -19.997   0.327   2.384
    4    HA   SER   8           HA       SER   8 -18.759   1.759   0.984
    5    HB2  SER   8           2HB      SER   8 -17.135  -0.344   2.418
    6    HB3  SER   8           1HB      SER   8 -16.617   1.312   2.072
    7    HG   SER   8           HG       SER   8 -17.620   0.708   4.235
    8    HA   PRO   9           HA       PRO   9 -17.346  -0.008  -2.847
    9    HB2  PRO   9           2HB      PRO   9 -15.660   1.984  -3.628
   10    HB3  PRO   9           1HB      PRO   9 -17.419   2.141  -3.712
   11    HG2  PRO   9           2HG      PRO   9 -15.526   3.176  -1.643
   12    HG3  PRO   9           1HG      PRO   9 -16.913   3.986  -2.397
   13    HD2  PRO   9           2HD      PRO   9 -17.044   2.869   0.061
   14    HD3  PRO   9           1HD      PRO   9 -18.434   2.914  -1.044
   15    HA   PRO  10           HA       PRO  10 -13.551  -1.941  -1.546
   16    HB2  PRO  10           2HB      PRO  10 -12.912  -3.211  -3.855
   17    HB3  PRO  10           1HB      PRO  10 -14.198  -3.775  -2.782
   18    HG2  PRO  10           2HG      PRO  10 -14.404  -2.194  -5.312
   19    HG3  PRO  10           1HG      PRO  10 -15.421  -3.525  -4.736
   20    HD2  PRO  10           2HD      PRO  10 -16.138  -0.912  -4.545
   21    HD3  PRO  10           1HD      PRO  10 -16.676  -2.148  -3.392
   22    H    LYS  11           H        LYS  11 -11.272  -1.817  -1.916
   23    HA   LYS  11           HA       LYS  11 -10.476   0.295  -3.764
   24    HB2  LYS  11           2HB      LYS  11  -8.923   1.121  -2.025
   25    HB3  LYS  11           1HB      LYS  11 -10.603   1.216  -1.538
   26    HG2  LYS  11           2HG      LYS  11 -10.296  -0.803  -0.171
   27    HG3  LYS  11           1HG      LYS  11  -8.589  -0.839  -0.626
   28    HD2  LYS  11           2HD      LYS  11  -8.829   0.206   1.551
   29    HD3  LYS  11           1HD      LYS  11  -8.336   1.424   0.377
   30    HE2  LYS  11           2HE      LYS  11 -10.679   2.160   0.167
   31    HE3  LYS  11           1HE      LYS  11 -11.156   0.953   1.356
   32    HZ1  LYS  11           3HZ      LYS  11 -10.963   3.127   2.277
   33    HZ2  LYS  11           1HZ      LYS  11  -9.349   3.257   1.821
   34    HZ3  LYS  11           2HZ      LYS  11  -9.817   2.131   3.004
   35    HA   PRO  12           HA       PRO  12  -7.213  -2.228  -5.311
   36    HB2  PRO  12           2HB      PRO  12  -5.164  -0.392  -4.185
   37    HB3  PRO  12           1HB      PRO  12  -5.362  -0.981  -5.838
   38    HG2  PRO  12           2HG      PRO  12  -6.059   1.503  -5.228
   39    HG3  PRO  12           1HG      PRO  12  -7.051   0.527  -6.325
   40    HD2  PRO  12           2HD      PRO  12  -7.518   1.207  -3.454
   41    HD3  PRO  12           1HD      PRO  12  -8.679   1.091  -4.782
   42    H    LYS  13           H        LYS  13  -5.754  -3.787  -4.762
   43    HA   LYS  13           HA       LYS  13  -4.946  -4.005  -1.985
   44    HB2  LYS  13           2HB      LYS  13  -5.442  -6.447  -1.988
   45    HB3  LYS  13           1HB      LYS  13  -6.882  -5.464  -2.043
   46    HG2  LYS  13           2HG      LYS  13  -5.657  -6.751  -4.489
   47    HG3  LYS  13           1HG      LYS  13  -6.864  -7.548  -3.486
   48    HD2  LYS  13           2HD      LYS  13  -7.281  -4.888  -4.861
   49    HD3  LYS  13           1HD      LYS  13  -7.799  -6.433  -5.531
   50    HE2  LYS  13           2HE      LYS  13  -9.287  -6.790  -3.657
   51    HE3  LYS  13           1HE      LYS  13  -8.672  -5.348  -2.856
   52    HZ1  LYS  13           3HZ      LYS  13  -9.996  -5.240  -5.487
   53    HZ2  LYS  13           1HZ      LYS  13  -9.668  -3.968  -4.427
   54    HZ3  LYS  13           2HZ      LYS  13 -10.849  -5.122  -4.040
   55    H    CYS  14           H        CYS  14  -3.110  -5.309  -1.682
   56    HA   CYS  14           HA       CYS  14  -1.611  -5.975  -4.061
   57    HB2  CYS  14           2HB      CYS  14   0.329  -4.608  -3.269
   58    HB3  CYS  14           1HB      CYS  14  -1.070  -3.651  -3.704
   59    H    ARG  15           H        ARG  15   0.495  -6.988  -3.371
   60    HA   ARG  15           HA       ARG  15   0.136  -8.593  -0.911
   61    HB2  ARG  15           2HB      ARG  15   1.130  -9.500  -3.627
   62    HB3  ARG  15           1HB      ARG  15   1.036 -10.512  -2.190
   63    HG2  ARG  15           2HG      ARG  15  -1.354 -10.371  -2.173
   64    HG3  ARG  15           1HG      ARG  15  -1.332  -9.179  -3.471
   65    HD2  ARG  15           2HD      ARG  15  -0.342 -10.897  -4.951
   66    HD3  ARG  15           1HD      ARG  15  -0.499 -12.066  -3.648
   67    HE   ARG  15           HE       ARG  15  -2.885 -11.756  -3.729
   68   HH11  ARG  15          1HH1      ARG  15  -1.072 -10.634  -6.567
   69   HH12  ARG  15          2HH1      ARG  15  -2.435 -10.623  -7.580
   70   HH21  ARG  15          1HH2      ARG  15  -4.713 -11.741  -5.119
   71   HH22  ARG  15          2HH2      ARG  15  -4.560 -11.279  -6.759
   72    H    CYS  16           H        CYS  16   1.650  -6.179  -1.601
   73    HA   CYS  16           HA       CYS  16   4.377  -6.544  -2.004
   74    HB2  CYS  16           2HB      CYS  16   3.064  -4.445  -0.269
   75    HB3  CYS  16           1HB      CYS  16   4.644  -4.341  -1.036
   76    H    GLY  17           H        GLY  17   5.547  -7.939  -0.810
   77    HA2  GLY  17           2HA      GLY  17   6.739  -7.809   1.425
   78    HA3  GLY  17           1HA      GLY  17   5.122  -7.907   2.101
   79    H    ILE  18           H        ILE  18   4.184  -9.856   0.065
   80    HA   ILE  18           HA       ILE  18   4.956 -12.273   1.307
   81    HB   ILE  18           HB       ILE  18   3.845 -11.871  -1.500
   82   HG12  ILE  18          2HG1      ILE  18   2.498 -10.717   0.187
   83   HG13  ILE  18          1HG1      ILE  18   1.624 -12.055  -0.523
   84   HG21  ILE  18          1HG2      ILE  18   3.673 -14.261   0.340
   85   HG22  ILE  18          2HG2      ILE  18   4.670 -14.141  -1.108
   86   HG23  ILE  18          3HG2      ILE  18   2.911 -14.122  -1.246
   87   HD11  ILE  18          3HD1      ILE  18   1.924 -13.368   1.468
   88   HD12  ILE  18          1HD1      ILE  18   1.322 -11.775   1.917
   89   HD13  ILE  18          2HD1      ILE  18   3.025 -12.163   2.153
   90    H    SER  19           H        SER  19   5.870 -10.691  -1.654
   91    HA   SER  19           HA       SER  19   8.470 -11.962  -1.451
   92    HB2  SER  19           2HB      SER  19   7.189 -12.738  -3.485
   93    HB3  SER  19           1HB      SER  19   7.057 -11.058  -3.997
   94    HG   SER  19           HG       SER  19   9.494 -12.427  -3.547
   95    H    GLY  20           H        GLY  20   9.140 -10.284  -0.135
   96    HA2  GLY  20           2HA      GLY  20   9.345  -7.695  -1.457
   97    HA3  GLY  20           1HA      GLY  20   8.555  -7.772   0.109
   98    H    SER  21           H        SER  21  11.335  -9.682  -0.902
   99    HA   SER  21           HA       SER  21  12.834  -8.544   1.273
  100    HB2  SER  21           2HB      SER  21  13.738 -10.443  -0.915
  101    HB3  SER  21           1HB      SER  21  14.566 -10.124   0.614
  102    HG   SER  21           HG       SER  21  12.456 -10.802   1.563
  103    H    SER  22           H        SER  22  12.614  -8.366  -2.205
  104    HA   SER  22           HA       SER  22  14.431  -6.126  -2.306
  105    HB2  SER  22           2HB      SER  22  12.473  -7.193  -4.383
  106    HB3  SER  22           1HB      SER  22  13.829  -6.099  -4.675
  107    HG   SER  22           HG       SER  22  14.734  -8.269  -3.443
  108    H    ASN  23           H        ASN  23  13.669  -4.292  -1.427
  109    HA   ASN  23           HA       ASN  23  12.373  -2.573  -0.795
  110    HB2  ASN  23           2HB      ASN  23  10.263  -3.711  -2.664
  111    HB3  ASN  23           1HB      ASN  23  10.029  -2.246  -1.721
  112   HD21  ASN  23          1HD2      ASN  23  10.063  -2.725  -4.594
  113   HD22  ASN  23          2HD2      ASN  23  11.250  -1.642  -5.227
  114    H    THR  24           H        THR  24  12.489  -3.419   1.262
  115    HA   THR  24           HA       THR  24  10.125  -4.910   2.165
  116    HB   THR  24           HB       THR  24  12.654  -4.401   3.759
  117    HG1  THR  24           1HG      THR  24  12.005  -6.354   1.813
  118   HG21  THR  24          3HG2      THR  24  10.558  -6.581   3.839
  119   HG22  THR  24          1HG2      THR  24  10.705  -5.254   4.988
  120   HG23  THR  24          2HG2      THR  24  11.974  -6.479   4.877
  121    H    LEU  25           H        LEU  25  11.640  -1.842   2.292
  122    HA   LEU  25           HA       LEU  25   9.884  -0.979   4.474
  123    HB2  LEU  25           2HB      LEU  25  12.347   0.379   3.342
  124    HB3  LEU  25           1HB      LEU  25  11.288   1.102   4.524
  125    HG   LEU  25           HG       LEU  25  11.905  -0.826   6.069
  126   HD11  LEU  25          1HD1      LEU  25  14.015  -1.971   5.662
  127   HD12  LEU  25          2HD1      LEU  25  14.109  -1.236   4.063
  128   HD13  LEU  25          3HD1      LEU  25  12.808  -2.369   4.438
  129   HD21  LEU  25          3HD2      LEU  25  14.015   0.222   6.742
  130   HD22  LEU  25          1HD2      LEU  25  12.767   1.413   6.369
  131   HD23  LEU  25          2HD2      LEU  25  14.058   1.094   5.208
  132    H    THR  26           H        THR  26  10.879  -0.341   1.200
  133    HA   THR  26           HA       THR  26   8.785   1.661   0.908
  134    HB   THR  26           HB       THR  26  10.731   0.766  -1.239
  135    HG1  THR  26           1HG      THR  26  12.288   1.749  -0.202
  136   HG21  THR  26          3HG2      THR  26   8.904   2.346  -1.859
  137   HG22  THR  26          1HG2      THR  26  10.498   3.092  -1.993
  138   HG23  THR  26          2HG2      THR  26   9.471   3.455  -0.609
  139    H    THR  27           H        THR  27   8.171  -1.209   1.350
  140    HA   THR  27           HA       THR  27   7.587  -2.790  -0.816
  141    HB   THR  27           HB       THR  27   5.585  -2.877   1.225
  142    HG1  THR  27           1HG      THR  27   7.110  -3.019   3.031
  143   HG21  THR  27          3HG2      THR  27   6.465  -4.851   0.043
  144   HG22  THR  27          1HG2      THR  27   6.671  -5.016   1.781
  145   HG23  THR  27          2HG2      THR  27   8.053  -4.588   0.769
  146    H    CYS  28           H        CYS  28   5.274  -0.958   1.090
  147    HA   CYS  28           HA       CYS  28   3.544  -0.739  -1.183
  148    HB2  CYS  28           2HB      CYS  28   3.045  -0.328   1.739
  149    HB3  CYS  28           1HB      CYS  28   1.862   0.127   0.502
  150    H    ARG  29           H        ARG  29   5.945   1.080  -0.053
  151    HA   ARG  29           HA       ARG  29   4.527   3.600  -0.435
  152    HB2  ARG  29           2HB      ARG  29   5.956   3.281   1.598
  153    HB3  ARG  29           1HB      ARG  29   7.361   3.231   0.546
  154    HG2  ARG  29           2HG      ARG  29   6.938   5.499  -0.181
  155    HG3  ARG  29           1HG      ARG  29   5.474   5.562   0.791
  156    HD2  ARG  29           2HD      ARG  29   6.842   5.221   2.810
  157    HD3  ARG  29           1HD      ARG  29   8.292   5.261   1.806
  158    HE   ARG  29           HE       ARG  29   6.891   7.538   1.195
  159   HH11  ARG  29          1HH1      ARG  29   8.420   6.246   4.114
  160   HH12  ARG  29          2HH1      ARG  29   8.709   7.789   4.778
  161   HH21  ARG  29          1HH2      ARG  29   7.279   9.596   2.104
  162   HH22  ARG  29          2HH2      ARG  29   8.067   9.753   3.601
  163    H    ASN  30           H        ASN  30   6.081   1.556  -2.420
  164    HA   ASN  30           HA       ASN  30   7.413   3.672  -3.917
  165    HB2  ASN  30           2HB      ASN  30   8.273   1.983  -5.456
  166    HB3  ASN  30           1HB      ASN  30   8.542   1.426  -3.821
  167   HD21  ASN  30          1HD2      ASN  30   7.493  -0.377  -3.108
  168   HD22  ASN  30          2HD2      ASN  30   6.574  -1.409  -4.137
  169    H    SER  31           H        SER  31   6.909   3.902  -6.315
  170    HA   SER  31           HA       SER  31   4.162   4.553  -6.449
  171    HB2  SER  31           2HB      SER  31   4.971   5.260  -8.814
  172    HB3  SER  31           1HB      SER  31   5.578   6.116  -7.394
  173    HG   SER  31           HG       SER  31   6.920   4.600  -9.197
  174    H    ARG  32           H        ARG  32   5.563   1.580  -6.974
  175    HA   ARG  32           HA       ARG  32   3.687   0.961  -9.099
  176    HB2  ARG  32           2HB      ARG  32   5.976  -0.651  -7.980
  177    HB3  ARG  32           1HB      ARG  32   4.871  -1.222  -9.222
  178    HG2  ARG  32           2HG      ARG  32   5.597   0.580 -10.697
  179    HG3  ARG  32           1HG      ARG  32   6.707   1.149  -9.455
  180    HD2  ARG  32           2HD      ARG  32   6.767  -1.589 -10.692
  181    HD3  ARG  32           1HD      ARG  32   7.823  -0.255 -11.162
  182    HE   ARG  32           HE       ARG  32   8.440  -0.319  -8.684
  183   HH11  ARG  32          1HH1      ARG  32   7.661  -3.226 -10.574
  184   HH12  ARG  32          2HH1      ARG  32   8.734  -4.215  -9.697
  185   HH21  ARG  32          1HH2      ARG  32   9.964  -1.700  -7.563
  186   HH22  ARG  32          2HH2      ARG  32  10.078  -3.344  -8.003
  187    H    CYS  33           H        CYS  33   3.578   1.189  -5.868
  188    HA   CYS  33           HA       CYS  33   2.070  -1.230  -5.455
  189    HB2  CYS  33           2HB      CYS  33   3.407  -0.294  -3.577
  190    HB3  CYS  33           1HB      CYS  33   2.470   1.189  -3.654
  191    HA   PRO  34           HA       PRO  34  -1.368   0.672  -7.510
  192    HB2  PRO  34           2HB      PRO  34  -3.300  -1.068  -6.501
  193    HB3  PRO  34           1HB      PRO  34  -2.330  -1.349  -7.950
  194    HG2  PRO  34           2HG      PRO  34  -1.957  -2.363  -5.178
  195    HG3  PRO  34           1HG      PRO  34  -1.674  -3.190  -6.718
  196    HD2  PRO  34           2HD      PRO  34   0.342  -2.238  -5.245
  197    HD3  PRO  34           1HD      PRO  34   0.393  -2.177  -7.023
  198    H    CYS  35           H        CYS  35  -1.463  -0.075  -4.117
  199    HA   CYS  35           HA       CYS  35  -3.759   1.464  -3.447
  200    HB2  CYS  35           2HB      CYS  35  -1.440   0.545  -1.792
  201    HB3  CYS  35           1HB      CYS  35  -2.903   1.265  -1.136
  202    H    TYR  36           H        TYR  36  -0.333   2.033  -2.999
  203    HA   TYR  36           HA       TYR  36  -0.348   4.537  -1.831
  204    HB2  TYR  36           2HB      TYR  36   1.617   3.036  -2.043
  205    HB3  TYR  36           1HB      TYR  36   1.705   3.433  -3.753
  206    HD1  TYR  36           1HD      TYR  36   1.950   4.866  -0.358
  207    HD2  TYR  36           2HD      TYR  36   2.865   5.365  -4.477
  208    HE1  TYR  36           1HE      TYR  36   3.380   6.789   0.196
  209    HE2  TYR  36           2HE      TYR  36   4.300   7.290  -3.923
  210    HH   TYR  36           HH       TYR  36   4.466   8.921  -2.151
  211    H    LYS  37           H        LYS  37  -0.065   3.795  -5.310
  212    HA   LYS  37           HA       LYS  37   0.009   6.531  -6.024
  213    HB2  LYS  37           2HB      LYS  37   0.417   4.062  -7.305
  214    HB3  LYS  37           1HB      LYS  37  -0.836   4.877  -8.229
  215    HG2  LYS  37           2HG      LYS  37   1.869   6.076  -7.566
  216    HG3  LYS  37           1HG      LYS  37   1.545   5.175  -9.034
  217    HD2  LYS  37           2HD      LYS  37   1.419   7.474  -9.640
  218    HD3  LYS  37           1HD      LYS  37  -0.245   6.925  -9.551
  219    HE2  LYS  37           2HE      LYS  37  -0.466   7.969  -7.337
  220    HE3  LYS  37           1HE      LYS  37   1.225   8.475  -7.418
  221    HZ1  LYS  37           3HZ      LYS  37  -0.874   9.318  -9.333
  222    HZ2  LYS  37           1HZ      LYS  37   0.681   9.927  -9.251
  223    HZ3  LYS  37           2HZ      LYS  37  -0.421  10.237  -8.011
  224    H    SER  38           H        SER  38  -2.571   4.265  -5.510
  225    HA   SER  38           HA       SER  38  -4.550   5.927  -6.793
  226    HB2  SER  38           2HB      SER  38  -4.742   3.448  -6.816
  227    HB3  SER  38           1HB      SER  38  -4.859   3.454  -5.062
  228    HG   SER  38           HG       SER  38  -6.651   4.768  -6.806
  229    H    TYR  39           H        TYR  39  -2.854   6.065  -3.989
  230    HA   TYR  39           HA       TYR  39  -2.903   7.319  -2.146
  231    HB2  TYR  39           2HB      TYR  39  -5.451   8.544  -3.250
  232    HB3  TYR  39           1HB      TYR  39  -4.443   9.224  -1.971
  233    HD1  TYR  39           2HD      TYR  39  -1.883   9.479  -2.704
  234    HD2  TYR  39           1HD      TYR  39  -5.170   9.407  -5.384
  235    HE1  TYR  39           2HE      TYR  39  -0.513  10.602  -4.384
  236    HE2  TYR  39           1HE      TYR  39  -3.802  10.525  -7.092
  237    HH   TYR  39           HH       TYR  39  -1.824  11.945  -7.197
  238    H    ASN  40           H        ASN  40  -4.307   4.775  -2.411
  239    HA   ASN  40           HA       ASN  40  -6.379   4.989  -0.368
  240    HB2  ASN  40           2HB      ASN  40  -5.806   2.932  -2.451
  241    HB3  ASN  40           1HB      ASN  40  -6.612   2.435  -0.971
  242   HD21  ASN  40          1HD2      ASN  40  -6.952   4.149  -4.001
  243   HD22  ASN  40          2HD2      ASN  40  -8.615   4.461  -3.803
  244    H    SER  41           H        SER  41  -6.510   3.213   1.191
  245    HA   SER  41           HA       SER  41  -4.000   2.886   2.520
  246    HB2  SER  41           2HB      SER  41  -5.637   1.976   4.262
  247    HB3  SER  41           1HB      SER  41  -5.788   3.687   3.849
  248    HG   SER  41           HG       SER  41  -7.779   2.182   3.848
  249    H    CYS  42           H        CYS  42  -3.621   0.669   3.497
  250    HA   CYS  42           HA       CYS  42  -4.283  -1.326   1.517
  251    HB2  CYS  42           2HB      CYS  42  -2.105  -1.292   3.600
  252    HB3  CYS  42           1HB      CYS  42  -2.523  -2.739   2.686
  253    H    ALA  43           H        ALA  43  -6.347  -1.175   2.303
  254    HA   ALA  43           HA       ALA  43  -6.853  -2.935   4.599
  255    HB1  ALA  43           1HB      ALA  43  -7.884  -0.715   4.805
  256    HB2  ALA  43           2HB      ALA  43  -9.108  -1.972   4.632
  257    HB3  ALA  43           3HB      ALA  43  -8.699  -0.950   3.260
  258    H    GLY  44           H        GLY  44  -7.190  -4.916   3.967
  259    HA2  GLY  44           2HA      GLY  44  -8.484  -6.565   2.870
  260    HA3  GLY  44           1HA      GLY  44  -8.835  -5.398   1.594
  261    H    CYS  45           H        CYS  45  -5.662  -5.399   2.665
  262    HA   CYS  45           HA       CYS  45  -4.759  -6.548   0.137
  263    HB2  CYS  45           2HB      CYS  45  -3.280  -4.965   2.227
  264    HB3  CYS  45           1HB      CYS  45  -2.584  -5.565   0.729
  265    H    HIS  46           H        HIS  46  -2.665  -7.754   0.274
  266    HA   HIS  46           HA       HIS  46  -2.711  -9.595   2.567
  267    HB2  HIS  46           2HB      HIS  46  -3.417 -10.334   0.080
  268    HB3  HIS  46           1HB      HIS  46  -1.677 -10.374  -0.132
  269    HD1  HIS  46           1HD      HIS  46  -4.501 -12.271   1.258
  270    HD2  HIS  46           2HD      HIS  46  -0.368 -12.367   1.448
  271    HE1  HIS  46           1HE      HIS  46  -3.923 -14.501   2.213
  272    HE2  HIS  46           2HE      HIS  46  -1.423 -14.616   1.978
  273    H    CYS  47           H        CYS  47  -1.331  -7.057   2.059
  274    HA   CYS  47           HA       CYS  47   1.393  -7.720   1.427
  275    HB2  CYS  47           2HB      CYS  47   1.859  -5.309   1.919
  276    HB3  CYS  47           1HB      CYS  47   0.727  -5.570   0.614
  277    H    VAL  48           H        VAL  48   3.154  -7.577   2.762
  278    HA   VAL  48           HA       VAL  48   2.644  -7.744   5.649
  279    HB   VAL  48           HB       VAL  48   4.411  -9.658   4.065
  280   HG11  VAL  48          1HG1      VAL  48   4.698 -10.873   6.157
  281   HG12  VAL  48          2HG1      VAL  48   3.703  -9.689   6.995
  282   HG13  VAL  48          3HG1      VAL  48   5.259  -9.208   6.315
  283   HG21  VAL  48          3HG2      VAL  48   1.760 -10.199   5.414
  284   HG22  VAL  48          1HG2      VAL  48   2.799 -11.419   4.678
  285   HG23  VAL  48          2HG2      VAL  48   2.059 -10.169   3.680
  286    H    GLY  49           H        GLY  49   3.922  -6.267   6.577
  287    HA2  GLY  49           2HA      GLY  49   5.914  -5.063   6.989
  288    HA3  GLY  49           1HA      GLY  49   6.592  -5.737   5.503
  289    H    CYS  50           H        CYS  50   3.531  -4.219   5.990
  290    HA   CYS  50           HA       CYS  50   3.810  -2.641   3.632
  291    HB2  CYS  50           2HB      CYS  50   1.726  -3.658   3.928
  292    HB3  CYS  50           1HB      CYS  50   1.626  -3.150   5.607
  293    H    LYS  51           H        LYS  51   5.050  -0.845   3.861
  294    HA   LYS  51           HA       LYS  51   4.170   0.972   5.981
  295    HB2  LYS  51           2HB      LYS  51   6.614   1.105   4.196
  296    HB3  LYS  51           1HB      LYS  51   6.207   2.292   5.416
  297    HG2  LYS  51           2HG      LYS  51   6.419   0.522   7.136
  298    HG3  LYS  51           1HG      LYS  51   6.952  -0.586   5.871
  299    HD2  LYS  51           2HD      LYS  51   8.831   0.909   5.363
  300    HD3  LYS  51           1HD      LYS  51   8.281   2.006   6.627
  301    HE2  LYS  51           2HE      LYS  51   9.203  -0.835   7.015
  302    HE3  LYS  51           1HE      LYS  51  10.121   0.612   7.413
  303    HZ1  LYS  51           3HZ      LYS  51   7.606  -0.321   8.671
  304    HZ2  LYS  51           1HZ      LYS  51   8.291   1.188   8.983
  305    HZ3  LYS  51           2HZ      LYS  51   9.108  -0.240   9.389
  306    H    ASN  52           H        ASN  52   2.295   1.577   5.017
  307    HA   ASN  52           HA       ASN  52   2.583   3.094   2.547
  308    HB2  ASN  52           2HB      ASN  52   1.005   1.230   2.285
  309    HB3  ASN  52           1HB      ASN  52   0.089   1.790   3.675
  310   HD21  ASN  52          1HD2      ASN  52  -1.729   1.838   2.292
  311   HD22  ASN  52          2HD2      ASN  52  -2.032   3.145   1.213
  312    HA   PRO  53           HA       PRO  53   1.943   6.481   5.438
  313    HB2  PRO  53           2HB      PRO  53   2.254   8.188   3.094
  314    HB3  PRO  53           1HB      PRO  53   3.256   8.105   4.540
  315    HG2  PRO  53           2HG      PRO  53   4.099   7.225   2.122
  316    HG3  PRO  53           1HG      PRO  53   4.651   6.522   3.647
  317    HD2  PRO  53           2HD      PRO  53   2.633   5.485   1.699
  318    HD3  PRO  53           1HD      PRO  53   3.839   4.612   2.677
  319    H    HIS  54           H        HIS  54   0.233   5.594   2.625
  320    HA   HIS  54           HA       HIS  54  -1.738   7.671   2.972
  321    HB2  HIS  54           2HB      HIS  54  -1.532   5.465   0.935
  322    HB3  HIS  54           1HB      HIS  54  -2.992   6.434   1.113
  323    HD1  HIS  54           1HD      HIS  54  -2.841   8.930   0.463
  324    HD2  HIS  54           2HD      HIS  54   0.611   6.757  -0.239
  325    HE1  HIS  54           1HE      HIS  54  -1.404  10.403  -0.943
  326    HE2  HIS  54           2HE      HIS  54   0.787   9.256  -0.852
  327    H    LYS  55           H        LYS  55  -2.925   7.538   4.558
  328    HA   LYS  55           HA       LYS  55  -3.963   4.958   5.473
  329    HB2  LYS  55           2HB      LYS  55  -4.322   7.686   6.735
  330    HB3  LYS  55           1HB      LYS  55  -4.546   6.121   7.493
  331    HG2  LYS  55           2HG      LYS  55  -1.926   7.372   6.675
  332    HG3  LYS  55           1HG      LYS  55  -2.525   7.149   8.315
  333    HD2  LYS  55           2HD      LYS  55  -2.428   4.723   8.018
  334    HD3  LYS  55           1HD      LYS  55  -1.858   4.946   6.362
  335    HE2  LYS  55           2HE      LYS  55   0.034   4.470   7.797
  336    HE3  LYS  55           1HE      LYS  55   0.118   6.136   7.244
  337    HZ1  LYS  55           3HZ      LYS  55  -0.708   6.889   9.323
  338    HZ2  LYS  55           1HZ      LYS  55   0.617   5.907   9.603
  339    HZ3  LYS  55           2HZ      LYS  55  -0.939   5.317   9.892
  340    H    GLU  56           H        GLU  56  -6.378   4.961   5.908
  341    HA   GLU  56           HA       GLU  56  -7.576   6.551   3.858
  342    HB2  GLU  56           2HB      GLU  56  -9.740   5.370   4.462
  343    HB3  GLU  56           1HB      GLU  56  -8.468   4.390   3.769
  344    HG2  GLU  56           2HG      GLU  56  -7.922   3.604   6.048
  345    HG3  GLU  56           1HG      GLU  56  -9.333   4.498   6.638
  346    H    ASP  57           H        ASP  57  -7.248   8.384   4.470
  347    HA   ASP  57           HA       ASP  57  -8.404   9.461   6.945
  348    HB2  ASP  57           2HB      ASP  57  -5.990   9.799   6.294
  349    HB3  ASP  57           1HB      ASP  57  -6.551  10.726   4.916
  350    H    TYR  58           H        TYR  58  -8.806   9.125   3.705
  351    HA   TYR  58           HA       TYR  58 -10.153  11.610   3.137
  352    HB2  TYR  58           2HB      TYR  58  -8.598  10.441   1.536
  353    HB3  TYR  58           1HB      TYR  58  -9.819   9.192   1.362
  354    HD1  TYR  58           1HD      TYR  58  -9.182  12.784   0.910
  355    HD2  TYR  58           2HD      TYR  58 -11.586   9.474  -0.190
  356    HE1  TYR  58           1HE      TYR  58 -10.191  14.122  -0.876
  357    HE2  TYR  58           2HE      TYR  58 -12.611  10.813  -1.983
  358    HH   TYR  58           HH       TYR  58 -12.953  13.106  -2.579
  359    H    VAL  59           H        VAL  59 -12.070  11.714   4.056
  360    HA   VAL  59           HA       VAL  59 -14.018   9.688   3.376
  361    HB   VAL  59           HB       VAL  59 -15.091  10.145   5.737
  362   HG11  VAL  59          1HG1      VAL  59 -12.564   8.507   5.481
  363   HG12  VAL  59          2HG1      VAL  59 -14.187   7.975   5.048
  364   HG13  VAL  59          3HG1      VAL  59 -13.790   8.310   6.733
  365   HG21  VAL  59          3HG2      VAL  59 -13.552  11.959   6.376
  366   HG22  VAL  59          1HG2      VAL  59 -12.200  10.830   6.305
  367   HG23  VAL  59          2HG2      VAL  59 -13.466  10.614   7.517