*HEADER    TRANSFERASE                             26-JUN-07   2JRH              
*TITLE     SOLUTION STURCTURE OF HUMAN MEKK3 PB1 DOMAIN CIS ISOMER               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE KINASE KINASE 3;          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: OPR, PB1 DOMAIN;                                           
*COMPND   5 SYNONYM: MAPK/ERK KINASE KINASE 3, MEK KINASE 3, MEKK 3;             
*COMPND   6 EC: 2.7.11.25;                                                       
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: MAP3K3, MAPKKK3, MEKK3;                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET22B                                    
*KEYWDS    KINASE SIGNALING DOMAIN                                               
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    H.QI, Z.JIAHAI, W.JIHUI, S.YUNYU                                      
*REVDAT   1   10-JUL-07 2JRH    0                                                


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assign (resid 82 and name hg#) (resid 83 and name hn) 1.80 0.00 3.2
assign (resid 82 and name hn) (resid 83 and name hn) 1.80 0.00 2.2
assign (resid 82 and name he#) (resid 83 and name ha) 1.80 0.00 4.2
assign (resid 82 and name hb#) (resid 82 and name hn) 1.80 0.00 2.2
assign (resid 82 and name hb#) (resid 83 and name hn) 1.80 0.00 3.2
assign (resid 82 and name hg#) (resid 84 and name hn) 1.80 0.00 5.2
assign (resid 82 and name ha) (resid 82 and name hg#) 1.80 0.00 2.2
assign (resid 83 and name ha) (resid 83 and name hn) 1.80 0.00 1.7
assign (resid 83 and name hb#) (resid 83 and name hn) 1.80 0.00 1.7
assign (resid 83 and name ha) (resid 84 and name hn) 1.80 0.00 1.2
assign (resid 83 and name hb#) (resid 84 and name hn) 1.80 0.00 3.2
assign (resid 83 and name hn) (resid 84 and name hn) 1.80 0.00 2.7
assign (resid 84 and name ha) (resid 84 and name hn) 1.80 0.00 1.7
assign (resid 84 and name hb#) (resid 84 and name hn) 1.80 0.00 2.2
assign (resid 84 and name hg#) (resid 84 and name hn) 1.80 0.00 2.2
assign (resid 84 and name hb#) (resid 85 and name hn) 1.80 0.00 3.2
assign (resid 84 and name hd#) (resid 84 and name hn) 1.80 0.00 4.2
assign (resid 84 and name hn) (resid 85 and name hn) 1.80 0.00 2.2
assign (resid 84 and name ha) (resid 85 and name hn) 1.80 0.00 1.7
assign (resid 84 and name hg#) (resid 85 and name hn) 1.80 0.00 3.2
assign (resid 84 and name ha) (resid 84 and name hd#) 1.80 0.00 3.2
assign (resid 84 and name ha) (resid 84 and name hg#) 1.80 0.00 2.2
assign (resid 85 and name hd2#) (resid 85 and name ha) 1.80 0.00 4.2
assign (resid 85 and name hd2#) (resid 85 and name hb#) 1.80 0.00 2.7
assign (resid 85 and name hd2#) (resid 85 and name hn) 1.80 0.00 4.2
assign (resid 85 and name hn) (resid 85 and name hb#) 1.80 0.00 2.2
assign (resid 85 and name ha) (resid 85 and name hn) 1.80 0.00 1.7






assign (resid 6 and name hn) (resid 17 and name o) 2.00 0.60 0.70
assign (resid 6 and name n ) (resid 17 and name o) 3.00 0.60 0.70
assign (resid 7 and name hn) (resid 75 and name o) 2.00 0.60 0.70
assign (resid 7 and name n ) (resid 75 and name o) 3.00 0.60 0.70
assign (resid 8 and name hn) (resid 15 and name o) 2.00 0.60 0.70
assign (resid 8 and name n ) (resid 15 and name o) 3.00 0.60 0.70
assign (resid 13 and name hn) (resid 10 and name o) 2.00 0.60 0.70
assign (resid 13 and name n ) (resid 10 and name o) 3.00 0.60 0.70
assign (resid 17 and name hn) (resid 6 and name o) 2.00 0.60 0.70
assign (resid 17 and name n ) (resid 6 and name o) 3.00 0.60 0.70
assign (resid 19 and name hn) (resid 4 and name o) 2.00 0.60 0.70
assign (resid 19 and name n ) (resid 4 and name o) 3.00 0.60 0.70
assign (resid 31 and name hn) (resid 27 and name o) 2.00 0.60 0.70
assign (resid 31 and name n ) (resid 27 and name o) 3.00 0.60 0.70
assign (resid 32 and name hn) (resid 28 and name o) 2.00 0.60 0.70
assign (resid 32 and name n ) (resid 28 and name o) 3.00 0.60 0.70
assign (resid 35 and name hn) (resid 31 and name o) 2.00 0.60 0.70
assign (resid 35 and name n ) (resid 31 and name o) 3.00 0.60 0.70
assign (resid 59 and name hn) (resid 55 and name o) 2.00 0.60 0.70
assign (resid 59 and name n ) (resid 55 and name o) 3.00 0.60 0.70
assign (resid 60 and name hn) (resid 56 and name o) 2.00 0.60 0.70
assign (resid 60 and name n ) (resid 56 and name o) 3.00 0.60 0.70
assign (resid 61 and name hn) (resid 57 and name o) 2.00 0.60 0.70
assign (resid 61 and name n ) (resid 57 and name o) 3.00 0.60 0.70 
assign (resid 62 and name hn) (resid 58 and name o) 2.00 0.60 0.70
assign (resid 62 and name n ) (resid 58 and name o) 3.00 0.60 0.70
assign (resid 63 and name hn) (resid 59 and name o) 2.00 0.60 0.70
assign (resid 63 and name n ) (resid 59 and name o) 3.00 0.60 0.70





assign (resid 4 and name c ) (resid 5 and name n )
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assign (resid 5 and name n ) (resid 5 and name ca)
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assign (resid 5 and name c ) (resid 6 and name n )
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assign (resid 6 and name n ) (resid 6 and name ca)
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assign (resid 6 and name c ) (resid 7 and name n )
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assign (resid 7 and name n ) (resid 7 and name ca)
       (resid 7 and name c ) (resid 8 and name n ) 1.0 117.130 13.340 2
assign (resid 7 and name c ) (resid 8 and name n )
       (resid 8 and name ca) (resid 8 and name c ) 1.0  -104.410 12.820 2
assign (resid 8 and name n ) (resid 8 and name ca)
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assign (resid 8 and name c ) (resid 9 and name n )
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assign (resid 9 and name n ) (resid 9 and name ca)
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assign (resid 9 and name c ) (resid 10 and name n )
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assign (resid 10 and name n ) (resid 10 and name ca)
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assign (resid 12 and name c ) (resid 13 and name n )
       (resid 13 and name ca) (resid 13 and name c ) 1.0  -88.730 23.890 2
assign (resid 13 and name n ) (resid 13 and name ca)
       (resid 13 and name c ) (resid 14 and name n ) 1.0 144.270 8.440 2
assign (resid 13 and name c ) (resid 14 and name n )
       (resid 14 and name ca) (resid 14 and name c ) 1.0  -116.800 14.040 2
assign (resid 14 and name n ) (resid 14 and name ca)
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assign (resid 14 and name c ) (resid 15 and name n )
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assign (resid 15 and name n ) (resid 15 and name ca)
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assign (resid 15 and name c ) (resid 16 and name n )
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assign (resid 16 and name n ) (resid 16 and name ca)
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assign (resid 16 and name c ) (resid 17 and name n )
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assign (resid 17 and name n ) (resid 17 and name ca)
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assign (resid 17 and name c ) (resid 18 and name n )
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assign (resid 18 and name n ) (resid 18 and name ca)
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assign (resid 18 and name c ) (resid 19 and name n )
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assign (resid 19 and name n ) (resid 19 and name ca)
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assign (resid 24 and name c ) (resid 25 and name n )
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assign (resid 25 and name n ) (resid 25 and name ca)
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assign (resid 25 and name c ) (resid 26 and name n )
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assign (resid 26 and name n ) (resid 26 and name ca)
       (resid 26 and name c ) (resid 27 and name n ) 1.0 -39.940 4.860 2
assign (resid 26 and name c ) (resid 27 and name n )
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assign (resid 27 and name n ) (resid 27 and name ca)
       (resid 27 and name c ) (resid 28 and name n ) 1.0 -38.960 5.320 2
assign (resid 27 and name c ) (resid 28 and name n )
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assign (resid 28 and name n ) (resid 28 and name ca)
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assign (resid 28 and name c ) (resid 29 and name n )
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assign (resid 29 and name n ) (resid 29 and name ca)
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assign (resid 29 and name c ) (resid 30 and name n )
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assign (resid 30 and name n ) (resid 30 and name ca)
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assign (resid 30 and name c ) (resid 31 and name n )
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assign (resid 31 and name n ) (resid 31 and name ca)
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assign (resid 31 and name c ) (resid 32 and name n )
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assign (resid 32 and name n ) (resid 32 and name ca)
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assign (resid 32 and name c ) (resid 33 and name n )
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assign (resid 33 and name n ) (resid 33 and name ca)
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assign (resid 33 and name c ) (resid 34 and name n )
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assign (resid 34 and name n ) (resid 34 and name ca)
       (resid 34 and name c ) (resid 35 and name n ) 1.0 -34.030 10.370 2
assign (resid 37 and name c ) (resid 38 and name n )
       (resid 38 and name ca) (resid 38 and name c ) 1.0  -125.940 18.760 2
assign (resid 38 and name n ) (resid 38 and name ca)
       (resid 38 and name c ) (resid 39 and name n ) 1.0 142.490 35.980 2
assign (resid 38 and name c ) (resid 39 and name n )
       (resid 39 and name ca) (resid 39 and name c ) 1.0  -86.850 27.540 2
assign (resid 39 and name n ) (resid 39 and name ca)
       (resid 39 and name c ) (resid 40 and name n ) 1.0 139.050 14.300 2
assign (resid 39 and name c ) (resid 40 and name n )
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assign (resid 40 and name n ) (resid 40 and name ca)
       (resid 40 and name c ) (resid 41 and name n ) 1.0 146.770 16.580 2
assign (resid 40 and name c ) (resid 41 and name n )
       (resid 41 and name ca) (resid 41 and name c ) 1.0  -97.310 18.790 2
assign (resid 41 and name n ) (resid 41 and name ca)
       (resid 41 and name c ) (resid 42 and name n ) 1.0 126.320 13.660 2
assign (resid 41 and name c ) (resid 42 and name n )
       (resid 42 and name ca) (resid 42 and name c ) 1.0  -101.920 22.970 2
assign (resid 42 and name n ) (resid 42 and name ca)
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assign (resid 42 and name c ) (resid 43 and name n )
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assign (resid 43 and name n ) (resid 43 and name ca)
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assign (resid 43 and name c ) (resid 44 and name n )
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assign (resid 44 and name n ) (resid 44 and name ca)
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assign (resid 44 and name c ) (resid 45 and name n )
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assign (resid 45 and name n ) (resid 45 and name ca)
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assign (resid 48 and name c ) (resid 49 and name n )
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assign (resid 49 and name n ) (resid 49 and name ca)
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assign (resid 49 and name c ) (resid 50 and name n )
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assign (resid 50 and name n ) (resid 50 and name ca)
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assign (resid 50 and name c ) (resid 51 and name n )
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assign (resid 51 and name n ) (resid 51 and name ca)
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assign (resid 51 and name c ) (resid 52 and name n )
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assign (resid 52 and name n ) (resid 52 and name ca)
       (resid 52 and name c ) (resid 53 and name n ) 1.0 126.500 9.260 2
assign (resid 55 and name c ) (resid 56 and name n )
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assign (resid 56 and name n ) (resid 56 and name ca)
       (resid 56 and name c ) (resid 57 and name n ) 1.0 -39.920 9.940 2
assign (resid 56 and name c ) (resid 57 and name n )
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assign (resid 57 and name n ) (resid 57 and name ca)
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assign (resid 57 and name c ) (resid 58 and name n )
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assign (resid 58 and name n ) (resid 58 and name ca)
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assign (resid 58 and name c ) (resid 59 and name n )
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assign (resid 59 and name n ) (resid 59 and name ca)
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assign (resid 59 and name c ) (resid 60 and name n )
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assign (resid 60 and name n ) (resid 60 and name ca)
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assign (resid 60 and name c ) (resid 61 and name n )
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assign (resid 61 and name n ) (resid 61 and name ca)
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assign (resid 61 and name c ) (resid 62 and name n )
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assign (resid 62 and name n ) (resid 62 and name ca)
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assign (resid 62 and name c ) (resid 63 and name n )
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assign (resid 63 and name n ) (resid 63 and name ca)
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assign (resid 63 and name c ) (resid 64 and name n )
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assign (resid 64 and name n ) (resid 64 and name ca)
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assign (resid 64 and name c ) (resid 65 and name n )
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assign (resid 65 and name n ) (resid 65 and name ca)
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assign (resid 65 and name c ) (resid 66 and name n )
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assign (resid 66 and name n ) (resid 66 and name ca)
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assign (resid 66 and name c ) (resid 67 and name n )
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assign (resid 67 and name n ) (resid 67 and name ca)
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assign (resid 67 and name c ) (resid 68 and name n )
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assign (resid 68 and name n ) (resid 68 and name ca)
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assign (resid 69 and name c ) (resid 70 and name n )
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assign (resid 70 and name n ) (resid 70 and name ca)
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assign (resid 74 and name c ) (resid 75 and name n )
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assign (resid 75 and name n ) (resid 75 and name ca)
       (resid 75 and name c ) (resid 76 and name n ) 1.0 128.300 11.490 2
assign (resid 76 and name c ) (resid 77 and name n )
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assign (resid 77 and name n ) (resid 77 and name ca)
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assign (resid 77 and name c ) (resid 78 and name n )
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assign (resid 78 and name n ) (resid 78 and name ca)
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assign (resid 78 and name c ) (resid 79 and name n )
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assign (resid 79 and name n ) (resid 79 and name ca)
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assign (resid 79 and name c ) (resid 80 and name n )
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assign (resid 80 and name n ) (resid 80 and name ca)
       (resid 80 and name c ) (resid 81 and name n ) 1.0 141.790 21.560 2
assign (resid 80 and name c ) (resid 81 and name n )
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assign (resid 81 and name n ) (resid 81 and name ca)
       (resid 81 and name c ) (resid 82 and name n ) 1.0 137.940 9.270 2
assign (resid 81 and name c ) (resid 82 and name n )
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assign (resid 82 and name n ) (resid 82 and name ca)
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  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    GLN   1           H        GLN   1   8.736 -20.845   3.886
    2    HA   GLN   1           HA       GLN   1   7.370 -18.994   4.679
    3   1HB   GLN   1          2HB       GLN   1   9.509 -18.776   3.404
    4   2HB   GLN   1          1HB       GLN   1   8.575 -18.687   1.918
    5   1HG   GLN   1          2HG       GLN   1   7.815 -16.572   2.356
    6   2HG   GLN   1          1HG       GLN   1   7.979 -16.755   4.102
    7   1HE2  GLN   1          1HE2      GLN   1   9.828 -16.112   5.077
    8   2HE2  GLN   1          2HE2      GLN   1  11.190 -15.454   4.243
    9    H    SER   2           H        SER   2   5.123 -19.239   4.684
   10    HA   SER   2           HA       SER   2   3.789 -18.395   2.197
   11   1HB   SER   2          2HB       SER   2   2.729 -20.378   4.228
   12   2HB   SER   2          1HB       SER   2   1.885 -19.831   2.778
   13    HG   SER   2           HG       SER   2   3.470 -20.822   1.526
   14    H    ASP   3           H        ASP   3   1.783 -17.229   2.487
   15    HA   ASP   3           HA       ASP   3   0.410 -15.679   3.422
   16   1HB   ASP   3          2HB       ASP   3   0.490 -17.501   5.344
   17   2HB   ASP   3          1HB       ASP   3   1.381 -16.241   6.193
   18    H    VAL   4           H        VAL   4   1.067 -13.704   2.887
   19    HA   VAL   4           HA       VAL   4   3.531 -12.613   4.024
   20    HB   VAL   4           HB       VAL   4   1.756 -11.345   1.931
   21   1HG1  VAL   4          1HG1      VAL   4   3.123  -9.641   2.564
   22   2HG1  VAL   4          2HG1      VAL   4   4.190 -10.418   1.395
   23   3HG1  VAL   4          3HG1      VAL   4   4.401 -10.722   3.119
   24   1HG2  VAL   4          1HG2      VAL   4   2.639 -13.643   1.314
   25   2HG2  VAL   4          2HG2      VAL   4   4.251 -12.933   1.379
   26   3HG2  VAL   4          3HG2      VAL   4   3.066 -12.323   0.225
   27    H    ARG   5           H        ARG   5   3.421 -11.446   5.826
   28    HA   ARG   5           HA       ARG   5   0.913 -10.235   6.657
   29   1HB   ARG   5          2HB       ARG   5   2.995 -11.407   8.038
   30   2HB   ARG   5          1HB       ARG   5   3.272  -9.693   8.311
   31   1HG   ARG   5          2HG       ARG   5   1.464  -9.471   9.629
   32   2HG   ARG   5          1HG       ARG   5   0.498 -10.603   8.680
   33   1HD   ARG   5          2HD       ARG   5   1.478 -12.477   9.732
   34   2HD   ARG   5          1HD       ARG   5   2.766 -11.501  10.436
   35    HE   ARG   5           HE       ARG   5   0.323 -10.553  11.407
   36   1HH1  ARG   5          1HH1      ARG   5   2.315 -13.423  11.641
   37   2HH1  ARG   5          2HH1      ARG   5   1.755 -13.830  13.228
   38   1HH2  ARG   5          1HH2      ARG   5  -0.409 -11.094  13.495
   39   2HH2  ARG   5          2HH2      ARG   5   0.208 -12.509  14.281
   40    H    ILE   6           H        ILE   6   0.389  -8.249   6.001
   41    HA   ILE   6           HA       ILE   6   2.559  -6.305   5.528
   42    HB   ILE   6           HB       ILE   6  -0.203  -6.189   4.312
   43   1HG1  ILE   6          2HG1      ILE   6   2.359  -7.244   3.085
   44   2HG1  ILE   6          1HG1      ILE   6   0.957  -8.213   3.529
   45   1HG2  ILE   6          1HG2      ILE   6   2.139  -4.875   3.072
   46   2HG2  ILE   6          2HG2      ILE   6   1.549  -4.178   4.580
   47   3HG2  ILE   6          3HG2      ILE   6   0.466  -4.334   3.198
   48   1HD1  ILE   6          1HD1      ILE   6  -0.334  -6.711   1.898
   49   2HD1  ILE   6          2HD1      ILE   6   0.745  -7.939   1.239
   50   3HD1  ILE   6          3HD1      ILE   6   1.258  -6.253   1.293
   51    H    LYS   7           H        LYS   7   2.633  -4.572   6.801
   52    HA   LYS   7           HA       LYS   7   0.364  -4.042   8.584
   53   1HB   LYS   7          2HB       LYS   7   3.292  -3.758   8.798
   54   2HB   LYS   7          1HB       LYS   7   2.369  -2.437   9.499
   55   1HG   LYS   7          2HG       LYS   7   1.527  -3.721  11.167
   56   2HG   LYS   7          1HG       LYS   7   1.509  -5.186  10.184
   57   1HD   LYS   7          2HD       LYS   7   3.230  -5.716  11.579
   58   2HD   LYS   7          1HD       LYS   7   4.142  -4.860  10.334
   59   1HE   LYS   7          2HE       LYS   7   3.890  -2.778  11.697
   60   2HE   LYS   7          1HE       LYS   7   3.178  -3.767  12.973
   61   1HZ   LYS   7          1HZ       LYS   7   5.748  -3.220  12.884
   62   2HZ   LYS   7          2HZ       LYS   7   5.770  -4.611  11.922
   63   3HZ   LYS   7          3HZ       LYS   7   5.165  -4.684  13.500
   64    H    PHE   8           H        PHE   8  -0.988  -2.491   7.989
   65    HA   PHE   8           HA       PHE   8  -0.020  -0.310   6.276
   66   1HB   PHE   8          2HB       PHE   8  -2.747  -1.475   6.790
   67   2HB   PHE   8          1HB       PHE   8  -2.565   0.121   6.069
   68    HD1  PHE   8           HD1      PHE   8  -1.395   0.356   3.883
   69    HD2  PHE   8           HD2      PHE   8  -2.395  -3.442   5.524
   70    HE1  PHE   8           HE1      PHE   8  -1.102  -0.674   1.668
   71    HE2  PHE   8           HE2      PHE   8  -2.104  -4.477   3.311
   72    HZ   PHE   8           HZ       PHE   8  -1.455  -3.093   1.380
   73    H    GLU   9           H        GLU   9  -0.133   1.806   6.868
   74    HA   GLU   9           HA       GLU   9  -1.155   2.388   9.569
   75   1HB   GLU   9          2HB       GLU   9   1.488   2.787   8.457
   76   2HB   GLU   9          1HB       GLU   9   0.794   4.314   8.985
   77   1HG   GLU   9          2HG       GLU   9   0.203   2.812  11.117
   78   2HG   GLU   9          1HG       GLU   9   1.646   1.967  10.558
   79    H    HIS  10           H        HIS  10  -2.631   3.942   9.705
   80    HA   HIS  10           HA       HIS  10  -2.749   6.037   7.670
   81   1HB   HIS  10          2HB       HIS  10  -4.280   4.205   6.942
   82   2HB   HIS  10          1HB       HIS  10  -5.167   4.392   8.452
   83    HD1  HIS  10           HD1      HIS  10  -7.206   5.741   8.176
   84    HD2  HIS  10           HD2      HIS  10  -4.219   6.929   5.542
   85    HE1  HIS  10           HE1      HIS  10  -8.217   7.589   6.802
   86    HE2  HIS  10           HE2      HIS  10  -6.411   8.253   5.176
   87    H    ASN  11           H        ASN  11  -2.595   7.848   8.820
   88    HA   ASN  11           HA       ASN  11  -2.910   9.440  10.410
   89   1HB   ASN  11          2HB       ASN  11  -5.372   8.742   9.664
   90   2HB   ASN  11          1HB       ASN  11  -5.459   8.195  11.335
   91   1HD2  ASN  11          1HD2      ASN  11  -7.034  10.256  10.254
   92   2HD2  ASN  11          2HD2      ASN  11  -6.610  11.730  11.049
   93    H    GLY  12           H        GLY  12  -1.452   7.056  11.145
   94   1HA   GLY  12          2HA       GLY  12  -0.326   6.639  13.177
   95   2HA   GLY  12          1HA       GLY  12  -1.700   7.300  14.051
   96    H    GLU  13           H        GLU  13  -3.645   5.656  12.548
   97    HA   GLU  13           HA       GLU  13  -3.707   3.421  14.268
   98   1HB   GLU  13          2HB       GLU  13  -5.309   4.339  11.926
   99   2HB   GLU  13          1HB       GLU  13  -5.479   2.665  12.437
  100   1HG   GLU  13          2HG       GLU  13  -5.725   4.882  14.425
  101   2HG   GLU  13          1HG       GLU  13  -7.080   4.461  13.379
  102    H    ARG  14           H        ARG  14  -3.286   1.265  13.940
  103    HA   ARG  14           HA       ARG  14  -1.777   0.595  11.496
  104   1HB   ARG  14          2HB       ARG  14  -0.570  -1.085  12.964
  105   2HB   ARG  14          1HB       ARG  14  -0.198   0.607  13.263
  106   1HG   ARG  14          2HG       ARG  14  -1.026   0.554  15.344
  107   2HG   ARG  14          1HG       ARG  14  -2.388  -0.470  14.890
  108   1HD   ARG  14          2HD       ARG  14   0.238  -1.783  14.796
  109   2HD   ARG  14          1HD       ARG  14  -0.278  -1.272  16.401
  110    HE   ARG  14           HE       ARG  14  -1.383  -3.399  14.820
  111   1HH1  ARG  14          1HH1      ARG  14  -2.068  -1.092  17.366
  112   2HH1  ARG  14          2HH1      ARG  14  -3.313  -2.062  18.080
  113   1HH2  ARG  14          1HH2      ARG  14  -3.032  -4.669  15.759
  114   2HH2  ARG  14          2HH2      ARG  14  -3.859  -4.095  17.168
  115    H    ARG  15           H        ARG  15  -2.139  -1.376  10.519
  116    HA   ARG  15           HA       ARG  15  -4.106  -3.182  11.715
  117   1HB   ARG  15          2HB       ARG  15  -4.752  -1.377   9.649
  118   2HB   ARG  15          1HB       ARG  15  -4.620  -2.956   8.887
  119   1HG   ARG  15          2HG       ARG  15  -6.633  -3.485   9.625
  120   2HG   ARG  15          1HG       ARG  15  -6.086  -3.279  11.291
  121   1HD   ARG  15          2HD       ARG  15  -6.450  -0.749  10.816
  122   2HD   ARG  15          1HD       ARG  15  -7.459  -1.323   9.489
  123    HE   ARG  15           HE       ARG  15  -8.392  -2.710  11.615
  124   1HH1  ARG  15          1HH1      ARG  15  -7.857   0.704  11.044
  125   2HH1  ARG  15          2HH1      ARG  15  -9.127   1.206  12.108
  126   1HH2  ARG  15          1HH2      ARG  15 -10.068  -2.041  13.011
  127   2HH2  ARG  15          2HH2      ARG  15 -10.382  -0.350  13.223
  128    H    ILE  16           H        ILE  16  -3.690  -5.293  11.359
  129    HA   ILE  16           HA       ILE  16  -1.405  -5.937   9.618
  130    HB   ILE  16           HB       ILE  16  -2.563  -7.665  11.809
  131   1HG1  ILE  16          2HG1      ILE  16  -0.028  -6.046  12.023
  132   2HG1  ILE  16          1HG1      ILE  16  -1.581  -5.404  12.547
  133   1HG2  ILE  16          1HG2      ILE  16   0.002  -8.431  11.541
  134   2HG2  ILE  16          2HG2      ILE  16  -0.341  -7.926   9.886
  135   3HG2  ILE  16          3HG2      ILE  16  -1.335  -9.164  10.655
  136   1HD1  ILE  16          1HD1      ILE  16  -0.507  -8.007  13.573
  137   2HD1  ILE  16          2HD1      ILE  16  -1.784  -6.998  14.252
  138   3HD1  ILE  16          3HD1      ILE  16  -0.106  -6.459  14.314
  139    H    ILE  17           H        ILE  17  -1.873  -6.850   7.724
  140    HA   ILE  17           HA       ILE  17  -4.196  -8.658   7.566
  141    HB   ILE  17           HB       ILE  17  -3.350  -6.783   5.352
  142   1HG1  ILE  17          2HG1      ILE  17  -5.890  -6.504   6.933
  143   2HG1  ILE  17          1HG1      ILE  17  -4.401  -5.770   7.517
  144   1HG2  ILE  17          1HG2      ILE  17  -6.033  -8.016   5.426
  145   2HG2  ILE  17          2HG2      ILE  17  -4.684  -9.099   5.089
  146   3HG2  ILE  17          3HG2      ILE  17  -4.966  -7.697   4.059
  147   1HD1  ILE  17          1HD1      ILE  17  -5.504  -5.253   4.775
  148   2HD1  ILE  17          2HD1      ILE  17  -4.249  -4.360   5.633
  149   3HD1  ILE  17          3HD1      ILE  17  -5.922  -4.283   6.186
  150    H    ALA  18           H        ALA  18  -3.791 -10.601   6.724
  151    HA   ALA  18           HA       ALA  18  -1.116 -11.132   5.666
  152   1HB   ALA  18          1HB       ALA  18  -2.224 -13.573   5.824
  153   2HB   ALA  18          2HB       ALA  18  -3.188 -12.729   7.035
  154   3HB   ALA  18          3HB       ALA  18  -1.431 -12.776   7.183
  155    H    PHE  19           H        PHE  19  -0.748 -12.168   3.689
  156    HA   PHE  19           HA       PHE  19  -3.048 -12.343   1.857
  157   1HB   PHE  19          2HB       PHE  19  -0.501 -10.826   1.539
  158   2HB   PHE  19          1HB       PHE  19  -1.172 -11.608   0.112
  159    HD1  PHE  19           HD1      PHE  19  -3.678 -11.124  -0.378
  160    HD2  PHE  19           HD2      PHE  19  -1.223  -8.717   2.130
  161    HE1  PHE  19           HE1      PHE  19  -5.220  -9.233  -0.691
  162    HE2  PHE  19           HE2      PHE  19  -2.760  -6.821   1.821
  163    HZ   PHE  19           HZ       PHE  19  -4.763  -7.077   0.411
  164    H    SER  20           H        SER  20  -3.074 -14.058   0.479
  165    HA   SER  20           HA       SER  20  -1.026 -16.104   0.892
  166   1HB   SER  20          2HB       SER  20  -2.736 -17.501  -0.468
  167   2HB   SER  20          1HB       SER  20  -3.161 -17.035   1.180
  168    HG   SER  20           HG       SER  20  -4.098 -15.974  -1.262
  169    H    ARG  21           H        ARG  21   0.576 -16.333  -0.526
  170    HA   ARG  21           HA       ARG  21   0.677 -14.914  -2.986
  171   1HB   ARG  21          2HB       ARG  21   2.416 -17.166  -1.957
  172   2HB   ARG  21          1HB       ARG  21   2.778 -16.189  -3.373
  173   1HG   ARG  21          2HG       ARG  21   2.873 -14.189  -1.947
  174   2HG   ARG  21          1HG       ARG  21   2.571 -15.204  -0.535
  175   1HD   ARG  21          2HD       ARG  21   4.655 -16.522  -1.582
  176   2HD   ARG  21          1HD       ARG  21   5.013 -14.901  -2.179
  177    HE   ARG  21           HE       ARG  21   4.396 -15.015   0.632
  178   1HH1  ARG  21          1HH1      ARG  21   6.948 -15.276  -1.752
  179   2HH1  ARG  21          2HH1      ARG  21   8.199 -14.842  -0.638
  180   1HH2  ARG  21          1HH2      ARG  21   6.047 -14.443   2.093
  181   2HH2  ARG  21          2HH2      ARG  21   7.689 -14.368   1.545
  182    HA   PRO  22           HA       PRO  22   1.856 -15.203  -5.027
  183   1HB   PRO  22          2HB       PRO  22   0.267 -14.972  -7.461
  184   2HB   PRO  22          1HB       PRO  22   1.970 -15.396  -7.282
  185   1HG   PRO  22          2HG       PRO  22   0.091 -17.180  -8.077
  186   2HG   PRO  22          1HG       PRO  22   1.532 -17.647  -7.154
  187   1HD   PRO  22          2HD       PRO  22  -1.278 -17.225  -6.198
  188   2HD   PRO  22          1HD       PRO  22  -0.114 -18.495  -5.758
  189    H    VAL  23           H        VAL  23   1.630 -13.011  -4.889
  190    HA   VAL  23           HA       VAL  23  -1.115 -11.990  -4.573
  191    HB   VAL  23           HB       VAL  23   0.186 -11.925  -2.488
  192   1HG1  VAL  23          1HG1      VAL  23   2.147 -10.604  -2.216
  193   2HG1  VAL  23          2HG1      VAL  23   2.012  -9.957  -3.850
  194   3HG1  VAL  23          3HG1      VAL  23   2.413 -11.655  -3.606
  195   1HG2  VAL  23          1HG2      VAL  23  -0.707  -9.954  -1.845
  196   2HG2  VAL  23          2HG2      VAL  23  -1.415  -9.994  -3.460
  197   3HG2  VAL  23          3HG2      VAL  23   0.049  -9.058  -3.162
  198    H    LYS  24           H        LYS  24  -1.796 -10.572  -6.022
  199    HA   LYS  24           HA       LYS  24   0.157  -9.303  -7.801
  200   1HB   LYS  24          2HB       LYS  24  -2.461 -10.456  -8.157
  201   2HB   LYS  24          1HB       LYS  24  -2.461  -8.787  -8.710
  202   1HG   LYS  24          2HG       LYS  24  -1.942 -10.277 -10.533
  203   2HG   LYS  24          1HG       LYS  24  -0.544  -9.272 -10.152
  204   1HD   LYS  24          2HD       LYS  24   0.570 -11.062  -9.075
  205   2HD   LYS  24          1HD       LYS  24  -0.895 -12.047  -9.039
  206   1HE   LYS  24          2HE       LYS  24  -0.724 -11.737 -11.664
  207   2HE   LYS  24          1HE       LYS  24   0.980 -11.491 -11.284
  208   1HZ   LYS  24          1HZ       LYS  24  -0.015 -13.873 -11.751
  209   2HZ   LYS  24          2HZ       LYS  24  -0.352 -13.809 -10.094
  210   3HZ   LYS  24          3HZ       LYS  24   1.241 -13.639 -10.641
  211    H    TYR  25           H        TYR  25   0.364  -7.126  -7.986
  212    HA   TYR  25           HA       TYR  25  -0.324  -5.440  -5.886
  213   1HB   TYR  25          2HB       TYR  25   1.475  -4.944  -7.498
  214   2HB   TYR  25          1HB       TYR  25   0.270  -4.654  -8.749
  215    HD1  TYR  25           HD1      TYR  25   1.094  -3.496  -5.290
  216    HD2  TYR  25           HD2      TYR  25  -0.325  -2.459  -9.165
  217    HE1  TYR  25           HE1      TYR  25   0.961  -1.139  -4.604
  218    HE2  TYR  25           HE2      TYR  25  -0.458  -0.099  -8.491
  219    HH   TYR  25           HH       TYR  25  -0.714   1.179  -6.300
  220    H    GLU  26           H        GLU  26  -2.003  -6.007  -8.956
  221    HA   GLU  26           HA       GLU  26  -3.937  -3.976  -8.697
  222   1HB   GLU  26          2HB       GLU  26  -3.306  -5.824 -10.623
  223   2HB   GLU  26          1HB       GLU  26  -4.845  -6.435 -10.032
  224   1HG   GLU  26          2HG       GLU  26  -5.904  -4.309 -10.500
  225   2HG   GLU  26          1HG       GLU  26  -4.361  -3.632 -11.015
  226    H    ASP  27           H        ASP  27  -3.989  -7.401  -7.736
  227    HA   ASP  27           HA       ASP  27  -6.636  -7.416  -6.764
  228   1HB   ASP  27          2HB       ASP  27  -4.938  -9.383  -7.249
  229   2HB   ASP  27          1HB       ASP  27  -4.568  -9.194  -5.537
  230    H    VAL  28           H        VAL  28  -3.527  -6.858  -5.128
  231    HA   VAL  28           HA       VAL  28  -4.562  -6.635  -2.518
  232    HB   VAL  28           HB       VAL  28  -2.131  -5.185  -3.583
  233   1HG1  VAL  28          1HG1      VAL  28  -2.500  -4.328  -1.466
  234   2HG1  VAL  28          2HG1      VAL  28  -1.408  -5.672  -1.138
  235   3HG1  VAL  28          3HG1      VAL  28  -3.137  -5.851  -0.846
  236   1HG2  VAL  28          1HG2      VAL  28  -2.605  -7.993  -3.376
  237   2HG2  VAL  28          2HG2      VAL  28  -1.385  -7.523  -2.193
  238   3HG2  VAL  28          3HG2      VAL  28  -1.148  -7.146  -3.899
  239    H    GLU  29           H        GLU  29  -3.889  -4.171  -4.995
  240    HA   GLU  29           HA       GLU  29  -4.604  -1.924  -3.504
  241   1HB   GLU  29          2HB       GLU  29  -3.573  -2.215  -5.934
  242   2HB   GLU  29          1HB       GLU  29  -5.249  -1.996  -6.418
  243   1HG   GLU  29          2HG       GLU  29  -4.826   0.029  -4.587
  244   2HG   GLU  29          1HG       GLU  29  -3.312  -0.057  -5.485
  245    H    HIS  30           H        HIS  30  -6.621  -3.994  -5.597
  246    HA   HIS  30           HA       HIS  30  -9.000  -2.549  -5.387
  247   1HB   HIS  30          2HB       HIS  30  -8.200  -5.161  -6.318
  248   2HB   HIS  30          1HB       HIS  30  -9.736  -5.264  -5.464
  249    HD1  HIS  30           HD1      HIS  30 -10.798  -5.832  -7.823
  250    HD2  HIS  30           HD2      HIS  30  -9.240  -1.996  -7.449
  251    HE1  HIS  30           HE1      HIS  30 -11.751  -4.526  -9.750
  252    HE2  HIS  30           HE2      HIS  30 -10.842  -2.193  -9.469
  253    H    LYS  31           H        LYS  31  -7.682  -5.058  -3.257
  254    HA   LYS  31           HA       LYS  31  -9.952  -5.157  -1.538
  255   1HB   LYS  31          2HB       LYS  31  -8.017  -6.882  -1.863
  256   2HB   LYS  31          1HB       LYS  31  -7.191  -5.925  -0.642
  257   1HG   LYS  31          2HG       LYS  31  -8.784  -6.438   0.999
  258   2HG   LYS  31          1HG       LYS  31  -9.951  -7.011  -0.194
  259   1HD   LYS  31          2HD       LYS  31  -8.579  -8.939  -0.676
  260   2HD   LYS  31          1HD       LYS  31  -7.306  -8.341   0.388
  261   1HE   LYS  31          2HE       LYS  31  -8.570 -10.074   1.508
  262   2HE   LYS  31          1HE       LYS  31  -8.841  -8.523   2.300
  263   1HZ   LYS  31          1HZ       LYS  31 -10.790  -8.905   0.298
  264   2HZ   LYS  31          2HZ       LYS  31 -11.006  -8.748   1.968
  265   3HZ   LYS  31          3HZ       LYS  31 -10.749 -10.274   1.290
  266    H    VAL  32           H        VAL  32  -6.747  -3.613  -1.227
  267    HA   VAL  32           HA       VAL  32  -7.245  -2.437   1.292
  268    HB   VAL  32           HB       VAL  32  -5.329  -1.431  -0.815
  269   1HG1  VAL  32          1HG1      VAL  32  -5.713   0.160   0.990
  270   2HG1  VAL  32          2HG1      VAL  32  -4.088  -0.516   1.090
  271   3HG1  VAL  32          3HG1      VAL  32  -5.349  -1.087   2.183
  272   1HG2  VAL  32          1HG2      VAL  32  -3.885  -3.081  -0.340
  273   2HG2  VAL  32          2HG2      VAL  32  -5.305  -3.941   0.254
  274   3HG2  VAL  32          3HG2      VAL  32  -4.271  -3.061   1.380
  275    H    THR  33           H        THR  33  -7.664  -1.202  -2.008
  276    HA   THR  33           HA       THR  33  -8.285   1.446  -1.366
  277    HB   THR  33           HB       THR  33  -9.181  -0.269  -3.691
  278    HG1  THR  33           HG1      THR  33  -7.171   1.723  -3.456
  279   1HG2  THR  33          1HG2      THR  33  -9.833   1.655  -4.883
  280   2HG2  THR  33          2HG2      THR  33  -9.248   2.730  -3.616
  281   3HG2  THR  33          3HG2      THR  33 -10.671   1.726  -3.336
  282    H    THR  34           H        THR  34 -10.361  -1.432  -1.498
  283    HA   THR  34           HA       THR  34 -12.786   0.016  -1.066
  284    HB   THR  34           HB       THR  34 -12.291  -2.912  -0.504
  285    HG1  THR  34           HG1      THR  34 -11.806  -2.824  -2.587
  286   1HG2  THR  34          1HG2      THR  34 -14.827  -1.549  -1.363
  287   2HG2  THR  34          2HG2      THR  34 -14.448  -1.984   0.303
  288   3HG2  THR  34          3HG2      THR  34 -14.615  -3.243  -0.921
  289    H    VAL  35           H        VAL  35 -10.457  -1.578   1.058
  290    HA   VAL  35           HA       VAL  35 -11.977  -1.544   3.416
  291    HB   VAL  35           HB       VAL  35  -8.973  -1.257   3.233
  292   1HG1  VAL  35          1HG1      VAL  35 -10.510  -0.997   5.447
  293   2HG1  VAL  35          2HG1      VAL  35  -8.854  -1.600   5.453
  294   3HG1  VAL  35          3HG1      VAL  35 -10.204  -2.733   5.459
  295   1HG2  VAL  35          1HG2      VAL  35  -9.831  -3.907   3.871
  296   2HG2  VAL  35          2HG2      VAL  35  -8.836  -3.354   2.524
  297   3HG2  VAL  35          3HG2      VAL  35 -10.592  -3.396   2.364
  298    H    PHE  36           H        PHE  36  -9.487   0.795   2.339
  299    HA   PHE  36           HA       PHE  36 -10.332   2.655   4.409
  300   1HB   PHE  36          2HB       PHE  36  -8.138   2.921   2.351
  301   2HB   PHE  36          1HB       PHE  36  -8.414   4.004   3.709
  302    HD1  PHE  36           HD2      PHE  36  -8.358   2.912   6.068
  303    HD2  PHE  36           HD1      PHE  36  -6.670   1.150   2.579
  304    HE1  PHE  36           HE2      PHE  36  -6.905   1.516   7.480
  305    HE2  PHE  36           HE1      PHE  36  -5.216  -0.248   3.985
  306    HZ   PHE  36           HZ       PHE  36  -5.331  -0.068   6.438
  307    H    GLY  37           H        GLY  37 -10.934   2.181   1.031
  308   1HA   GLY  37          2HA       GLY  37 -12.770   3.366   0.015
  309   2HA   GLY  37          1HA       GLY  37 -12.346   4.771   0.984
  310    H    GLN  38           H        GLN  38 -12.690   5.450  -1.490
  311    HA   GLN  38           HA       GLN  38  -9.978   5.839  -2.532
  312   1HB   GLN  38          2HB       GLN  38 -10.910   5.535  -4.875
  313   2HB   GLN  38          1HB       GLN  38 -10.711   4.070  -3.925
  314   1HG   GLN  38          2HG       GLN  38 -13.350   5.442  -3.896
  315   2HG   GLN  38          1HG       GLN  38 -12.886   4.522  -5.325
  316   1HE2  GLN  38          1HE2      GLN  38 -12.539   2.271  -5.124
  317   2HE2  GLN  38          2HE2      GLN  38 -13.209   1.378  -3.806
  318    HA   PRO  39           HA       PRO  39  -9.288   6.698  -4.479
  319   1HB   PRO  39          2HB       PRO  39  -7.941   8.853  -5.295
  320   2HB   PRO  39          1HB       PRO  39  -9.400   8.315  -6.135
  321   1HG   PRO  39          2HG       PRO  39  -9.042  10.563  -4.203
  322   2HG   PRO  39          1HG       PRO  39 -10.047  10.484  -5.661
  323   1HD   PRO  39          2HD       PRO  39 -10.943  10.115  -3.045
  324   2HD   PRO  39          1HD       PRO  39 -11.808   9.620  -4.512
  325    H    LEU  40           H        LEU  40  -7.210   6.266  -3.769
  326    HA   LEU  40           HA       LEU  40  -6.098   7.892  -1.597
  327   1HB   LEU  40          2HB       LEU  40  -6.793   4.984  -1.496
  328   2HB   LEU  40          1HB       LEU  40  -5.408   5.566  -0.593
  329    HG   LEU  40           HG       LEU  40  -8.198   6.668  -0.268
  330   1HD1  LEU  40          1HD1      LEU  40  -8.437   5.316   1.672
  331   2HD1  LEU  40          2HD1      LEU  40  -6.778   4.731   1.545
  332   3HD1  LEU  40          3HD1      LEU  40  -7.977   4.250   0.346
  333   1HD2  LEU  40          1HD2      LEU  40  -5.567   7.366   0.784
  334   2HD2  LEU  40          2HD2      LEU  40  -6.779   7.109   2.039
  335   3HD2  LEU  40          3HD2      LEU  40  -7.067   8.295   0.767
  336    H    ASP  41           H        ASP  41  -3.793   7.503  -1.217
  337    HA   ASP  41           HA       ASP  41  -2.435   6.506  -3.638
  338   1HB   ASP  41          2HB       ASP  41  -2.303   9.039  -2.570
  339   2HB   ASP  41          1HB       ASP  41  -0.871   8.273  -1.892
  340    H    LEU  42           H        LEU  42  -0.729   5.097  -3.449
  341    HA   LEU  42           HA       LEU  42  -0.316   3.933  -0.782
  342   1HB   LEU  42          2HB       LEU  42  -0.204   2.868  -3.558
  343   2HB   LEU  42          1HB       LEU  42   0.861   2.143  -2.370
  344    HG   LEU  42           HG       LEU  42  -2.131   2.352  -2.027
  345   1HD1  LEU  42          1HD1      LEU  42  -0.669  -0.171  -2.700
  346   2HD1  LEU  42          2HD1      LEU  42  -1.228   0.912  -3.975
  347   3HD1  LEU  42          3HD1      LEU  42  -2.386   0.200  -2.852
  348   1HD2  LEU  42          1HD2      LEU  42  -1.896   1.253  -0.064
  349   2HD2  LEU  42          2HD2      LEU  42  -0.303   2.007  -0.094
  350   3HD2  LEU  42          3HD2      LEU  42  -0.495   0.334  -0.617
  351    H    HIS  43           H        HIS  43   1.376   4.837   0.232
  352    HA   HIS  43           HA       HIS  43   3.802   5.454  -1.314
  353   1HB   HIS  43          2HB       HIS  43   2.792   7.296   0.024
  354   2HB   HIS  43          1HB       HIS  43   3.059   6.349   1.481
  355    HD1  HIS  43           HD1      HIS  43   5.747   5.689   1.821
  356    HD2  HIS  43           HD2      HIS  43   4.817   9.006  -0.507
  357    HE1  HIS  43           HE1      HIS  43   7.854   7.053   1.722
  358    HE2  HIS  43           HE2      HIS  43   7.282   9.035   0.275
  359    H    TYR  44           H        TYR  44   5.551   4.198  -1.116
  360    HA   TYR  44           HA       TYR  44   5.706   2.384   1.201
  361   1HB   TYR  44          2HB       TYR  44   5.445   1.050  -0.760
  362   2HB   TYR  44          1HB       TYR  44   6.614   2.012  -1.657
  363    HD1  TYR  44           HD1      TYR  44   9.036   1.859  -1.056
  364    HD2  TYR  44           HD2      TYR  44   6.137  -0.793   0.569
  365    HE1  TYR  44           HE1      TYR  44  10.831   0.309  -0.403
  366    HE2  TYR  44           HE2      TYR  44   7.921  -2.354   1.226
  367    HH   TYR  44           HH       TYR  44  10.967  -2.274   0.037
  368    H    MET  45           H        MET  45   7.433   2.547   2.502
  369    HA   MET  45           HA       MET  45   9.782   4.042   1.538
  370   1HB   MET  45          2HB       MET  45   9.989   4.931   3.908
  371   2HB   MET  45          1HB       MET  45   8.687   5.602   2.937
  372   1HG   MET  45          2HG       MET  45   7.045   4.453   4.125
  373   2HG   MET  45          1HG       MET  45   8.203   3.311   4.802
  374   1HE   MET  45          1HE       MET  45   6.510   7.046   5.929
  375   2HE   MET  45          2HE       MET  45   7.278   6.836   4.355
  376   3HE   MET  45          3HE       MET  45   8.109   7.725   5.631
  377    H    ASN  46           H        ASN  46  11.587   2.893   1.668
  378    HA   ASN  46           HA       ASN  46  11.638   0.390   3.101
  379   1HB   ASN  46          2HB       ASN  46  12.692   0.720   0.851
  380   2HB   ASN  46          1HB       ASN  46  13.887   1.763   1.611
  381   1HD2  ASN  46          1HD2      ASN  46  15.563   0.389   0.965
  382   2HD2  ASN  46          2HD2      ASN  46  15.850  -1.123   1.749
  383    H    ASN  47           H        ASN  47  13.728   3.278   3.148
  384    HA   ASN  47           HA       ASN  47  13.740   3.570   5.938
  385   1HB   ASN  47          2HB       ASN  47  15.306   1.421   5.235
  386   2HB   ASN  47          1HB       ASN  47  16.480   2.733   5.285
  387   1HD2  ASN  47          1HD2      ASN  47  15.913   4.262   7.289
  388   2HD2  ASN  47          2HD2      ASN  47  15.814   3.405   8.785
  389    H    GLU  48           H        GLU  48  16.017   3.817   3.208
  390    HA   GLU  48           HA       GLU  48  16.481   6.629   3.933
  391   1HB   GLU  48          2HB       GLU  48  18.142   4.770   2.224
  392   2HB   GLU  48          1HB       GLU  48  18.530   6.450   2.565
  393   1HG   GLU  48          2HG       GLU  48  18.169   5.340   5.069
  394   2HG   GLU  48          1HG       GLU  48  18.988   4.072   4.156
  395    H    LEU  49           H        LEU  49  15.259   4.543   1.405
  396    HA   LEU  49           HA       LEU  49  14.764   6.931  -0.251
  397   1HB   LEU  49          2HB       LEU  49  15.803   4.252  -0.972
  398   2HB   LEU  49          1HB       LEU  49  14.639   4.955  -2.077
  399    HG   LEU  49           HG       LEU  49  16.937   6.652  -1.241
  400   1HD1  LEU  49          1HD1      LEU  49  17.917   4.424  -1.726
  401   2HD1  LEU  49          2HD1      LEU  49  18.417   5.677  -2.861
  402   3HD1  LEU  49          3HD1      LEU  49  17.193   4.499  -3.332
  403   1HD2  LEU  49          1HD2      LEU  49  15.473   7.751  -2.676
  404   2HD2  LEU  49          2HD2      LEU  49  15.195   6.311  -3.655
  405   3HD2  LEU  49          3HD2      LEU  49  16.734   7.166  -3.761
  406    H    SER  50           H        SER  50  12.768   7.116  -1.253
  407    HA   SER  50           HA       SER  50  10.729   5.163  -0.411
  408   1HB   SER  50          2HB       SER  50   9.143   6.924  -0.097
  409   2HB   SER  50          1HB       SER  50  10.611   7.418   0.744
  410    HG   SER  50           HG       SER  50  10.153   9.176  -0.401
  411    H    ILE  51           H        ILE  51   9.451   4.327  -1.961
  412    HA   ILE  51           HA       ILE  51   9.520   5.571  -4.632
  413    HB   ILE  51           HB       ILE  51   9.446   2.593  -4.150
  414   1HG1  ILE  51          2HG1      ILE  51  11.846   3.014  -5.340
  415   2HG1  ILE  51          1HG1      ILE  51  11.727   4.475  -4.363
  416   1HG2  ILE  51          1HG2      ILE  51   8.481   3.006  -6.228
  417   2HG2  ILE  51          2HG2      ILE  51  10.166   2.651  -6.615
  418   3HG2  ILE  51          3HG2      ILE  51   9.597   4.320  -6.594
  419   1HD1  ILE  51          1HD1      ILE  51  10.991   2.380  -2.670
  420   2HD1  ILE  51          2HD1      ILE  51  12.496   3.301  -2.656
  421   3HD1  ILE  51          3HD1      ILE  51  12.389   1.800  -3.575
  422    H    LEU  52           H        LEU  52   7.596   5.858  -5.594
  423    HA   LEU  52           HA       LEU  52   5.199   5.130  -4.132
  424   1HB   LEU  52          2HB       LEU  52   5.938   7.236  -5.860
  425   2HB   LEU  52          1HB       LEU  52   4.676   6.347  -6.689
  426    HG   LEU  52           HG       LEU  52   3.812   8.244  -5.368
  427   1HD1  LEU  52          1HD1      LEU  52   2.987   5.437  -4.855
  428   2HD1  LEU  52          2HD1      LEU  52   2.128   6.741  -5.673
  429   3HD1  LEU  52          3HD1      LEU  52   2.227   6.719  -3.913
  430   1HD2  LEU  52          1HD2      LEU  52   3.812   8.147  -2.939
  431   2HD2  LEU  52          2HD2      LEU  52   5.462   8.183  -3.559
  432   3HD2  LEU  52          3HD2      LEU  52   4.770   6.668  -2.983
  433    H    LEU  53           H        LEU  53   4.156   3.289  -4.479
  434    HA   LEU  53           HA       LEU  53   4.822   1.501  -6.566
  435   1HB   LEU  53          2HB       LEU  53   2.325   1.463  -4.868
  436   2HB   LEU  53          1HB       LEU  53   3.018   0.114  -5.745
  437    HG   LEU  53           HG       LEU  53   4.435   1.502  -3.472
  438   1HD1  LEU  53          1HD1      LEU  53   3.748  -0.396  -2.084
  439   2HD1  LEU  53          2HD1      LEU  53   2.746  -0.995  -3.406
  440   3HD1  LEU  53          3HD1      LEU  53   2.363   0.546  -2.637
  441   1HD2  LEU  53          1HD2      LEU  53   5.451  -0.959  -3.541
  442   2HD2  LEU  53          2HD2      LEU  53   6.105   0.365  -4.504
  443   3HD2  LEU  53          3HD2      LEU  53   5.009  -0.803  -5.242
  444    H    LYS  54           H        LYS  54   4.433   2.017  -8.632
  445    HA   LYS  54           HA       LYS  54   1.781   3.094  -9.329
  446   1HB   LYS  54          2HB       LYS  54   4.491   3.680 -10.284
  447   2HB   LYS  54          1HB       LYS  54   3.320   3.448 -11.575
  448   1HG   LYS  54          2HG       LYS  54   2.021   5.254 -10.894
  449   2HG   LYS  54          1HG       LYS  54   2.731   5.277  -9.280
  450   1HD   LYS  54          2HD       LYS  54   4.943   5.762 -10.641
  451   2HD   LYS  54          1HD       LYS  54   3.797   6.347 -11.847
  452   1HE   LYS  54          2HE       LYS  54   3.974   8.285 -10.716
  453   2HE   LYS  54          1HE       LYS  54   2.812   7.531  -9.628
  454   1HZ   LYS  54          1HZ       LYS  54   5.117   6.625  -8.625
  455   2HZ   LYS  54          2HZ       LYS  54   4.352   8.037  -8.093
  456   3HZ   LYS  54          3HZ       LYS  54   5.619   8.130  -9.210
  457    H    ASN  55           H        ASN  55   4.170   0.625 -10.111
  458    HA   ASN  55           HA       ASN  55   2.081  -0.858 -11.539
  459   1HB   ASN  55          2HB       ASN  55   4.196   0.375 -12.851
  460   2HB   ASN  55          1HB       ASN  55   4.730  -1.294 -12.684
  461   1HD2  ASN  55          1HD2      ASN  55   3.890  -2.808 -13.995
  462   2HD2  ASN  55          2HD2      ASN  55   2.636  -2.522 -15.148
  463    H    GLN  56           H        GLN  56   2.866  -3.197 -11.952
  464    HA   GLN  56           HA       GLN  56   3.325  -4.443  -9.494
  465   1HB   GLN  56          2HB       GLN  56   2.248  -5.555 -11.409
  466   2HB   GLN  56          1HB       GLN  56   3.781  -5.561 -12.266
  467   1HG   GLN  56          2HG       GLN  56   4.129  -7.575 -11.419
  468   2HG   GLN  56          1HG       GLN  56   4.368  -6.793  -9.860
  469   1HE2  GLN  56          1HE2      GLN  56   3.625  -8.784  -8.932
  470   2HE2  GLN  56          2HE2      GLN  56   1.932  -9.109  -8.829
  471    H    ASP  57           H        ASP  57   5.574  -3.302 -11.924
  472    HA   ASP  57           HA       ASP  57   7.850  -4.749 -11.255
  473   1HB   ASP  57          2HB       ASP  57   7.321  -2.140 -12.561
  474   2HB   ASP  57          1HB       ASP  57   8.950  -2.385 -11.939
  475    H    ASP  58           H        ASP  58   6.599  -1.744  -9.831
  476    HA   ASP  58           HA       ASP  58   8.763  -1.354  -8.039
  477   1HB   ASP  58          2HB       ASP  58   5.901  -0.382  -7.918
  478   2HB   ASP  58          1HB       ASP  58   7.167   0.144  -6.816
  479    H    LEU  59           H        LEU  59   5.806  -3.226  -7.885
  480    HA   LEU  59           HA       LEU  59   5.756  -3.704  -5.109
  481   1HB   LEU  59          2HB       LEU  59   3.848  -4.085  -6.629
  482   2HB   LEU  59          1HB       LEU  59   4.702  -5.444  -7.338
  483    HG   LEU  59           HG       LEU  59   4.703  -6.503  -5.040
  484   1HD1  LEU  59          1HD1      LEU  59   3.444  -5.651  -3.307
  485   2HD1  LEU  59          2HD1      LEU  59   2.471  -4.634  -4.372
  486   3HD1  LEU  59          3HD1      LEU  59   4.137  -4.188  -4.005
  487   1HD2  LEU  59          1HD2      LEU  59   1.867  -6.121  -5.800
  488   2HD2  LEU  59          2HD2      LEU  59   2.784  -7.605  -5.535
  489   3HD2  LEU  59          3HD2      LEU  59   2.957  -6.719  -7.050
  490    H    ASP  60           H        ASP  60   7.191  -5.587  -7.788
  491    HA   ASP  60           HA       ASP  60   8.141  -7.672  -6.082
  492   1HB   ASP  60          2HB       ASP  60   9.315  -8.525  -8.000
  493   2HB   ASP  60          1HB       ASP  60   7.732  -7.965  -8.522
  494    H    LYS  61           H        LYS  61   9.453  -4.624  -7.178
  495    HA   LYS  61           HA       LYS  61  12.156  -5.059  -6.513
  496   1HB   LYS  61          2HB       LYS  61  10.516  -2.821  -7.318
  497   2HB   LYS  61          1HB       LYS  61  11.602  -2.337  -6.023
  498   1HG   LYS  61          2HG       LYS  61  13.274  -3.746  -7.652
  499   2HG   LYS  61          1HG       LYS  61  12.175  -2.998  -8.810
  500   1HD   LYS  61          2HD       LYS  61  13.931  -1.458  -8.544
  501   2HD   LYS  61          1HD       LYS  61  12.606  -0.814  -7.575
  502   1HE   LYS  61          2HE       LYS  61  13.697  -2.055  -5.612
  503   2HE   LYS  61          1HE       LYS  61  15.110  -2.200  -6.656
  504   1HZ   LYS  61          1HZ       LYS  61  13.950   0.464  -6.379
  505   2HZ   LYS  61          2HZ       LYS  61  15.571  -0.005  -6.489
  506   3HZ   LYS  61          3HZ       LYS  61  14.743  -0.160  -5.021
  507    H    ALA  62           H        ALA  62   9.392  -3.967  -4.605
  508    HA   ALA  62           HA       ALA  62  10.834  -3.235  -2.281
  509   1HB   ALA  62          1HB       ALA  62   8.273  -2.921  -3.056
  510   2HB   ALA  62          2HB       ALA  62   8.821  -2.741  -1.391
  511   3HB   ALA  62          3HB       ALA  62   8.092  -4.256  -1.917
  512    H    ILE  63           H        ILE  63   9.263  -6.260  -3.275
  513    HA   ILE  63           HA       ILE  63   9.733  -7.656  -0.855
  514    HB   ILE  63           HB       ILE  63   9.435  -8.894  -3.596
  515   1HG1  ILE  63          2HG1      ILE  63   7.574  -7.377  -3.233
  516   2HG1  ILE  63          1HG1      ILE  63   7.011  -9.034  -3.051
  517   1HG2  ILE  63          1HG2      ILE  63   8.771  -9.989  -0.863
  518   2HG2  ILE  63          2HG2      ILE  63  10.218 -10.387  -1.789
  519   3HG2  ILE  63          3HG2      ILE  63   8.626 -10.836  -2.403
  520   1HD1  ILE  63          1HD1      ILE  63   7.757  -8.231  -0.488
  521   2HD1  ILE  63          2HD1      ILE  63   6.121  -8.419  -1.120
  522   3HD1  ILE  63          3HD1      ILE  63   6.918  -6.848  -1.191
  523    H    ASP  64           H        ASP  64  11.576  -7.411  -3.882
  524    HA   ASP  64           HA       ASP  64  13.516  -9.337  -3.383
  525   1HB   ASP  64          2HB       ASP  64  13.080  -7.657  -5.426
  526   2HB   ASP  64          1HB       ASP  64  14.417  -6.806  -4.660
  527    H    ILE  65           H        ILE  65  13.484  -5.909  -2.429
  528    HA   ILE  65           HA       ILE  65  16.033  -5.936  -1.189
  529    HB   ILE  65           HB       ILE  65  13.722  -4.095  -0.546
  530   1HG1  ILE  65          2HG1      ILE  65  15.938  -3.344  -2.411
  531   2HG1  ILE  65          1HG1      ILE  65  14.625  -4.344  -3.027
  532   1HG2  ILE  65          1HG2      ILE  65  15.183  -3.522   1.077
  533   2HG2  ILE  65          2HG2      ILE  65  15.934  -2.604  -0.229
  534   3HG2  ILE  65          3HG2      ILE  65  16.571  -4.187   0.216
  535   1HD1  ILE  65          1HD1      ILE  65  14.255  -1.974  -3.460
  536   2HD1  ILE  65          2HD1      ILE  65  14.302  -1.650  -1.726
  537   3HD1  ILE  65          3HD1      ILE  65  13.012  -2.644  -2.405
  538    H    LEU  66           H        LEU  66  12.759  -6.527   0.004
  539    HA   LEU  66           HA       LEU  66  13.392  -6.670   2.753
  540   1HB   LEU  66          2HB       LEU  66  11.094  -6.438   1.763
  541   2HB   LEU  66          1HB       LEU  66  11.174  -8.132   1.318
  542    HG   LEU  66           HG       LEU  66  11.515  -8.623   3.799
  543   1HD1  LEU  66          1HD1      LEU  66  10.327  -5.890   4.181
  544   2HD1  LEU  66          2HD1      LEU  66  12.061  -6.195   4.303
  545   3HD1  LEU  66          3HD1      LEU  66  10.945  -7.005   5.402
  546   1HD2  LEU  66          1HD2      LEU  66   9.115  -8.498   4.264
  547   2HD2  LEU  66          2HD2      LEU  66   9.427  -9.075   2.627
  548   3HD2  LEU  66          3HD2      LEU  66   8.905  -7.412   2.891
  549    H    ASP  67           H        ASP  67  13.224  -9.160   0.218
  550    HA   ASP  67           HA       ASP  67  13.633 -11.413   1.812
  551   1HB   ASP  67          2HB       ASP  67  13.135 -11.166  -0.763
  552   2HB   ASP  67          1HB       ASP  67  14.886 -11.270  -0.904
  553    H    ARG  68           H        ARG  68  16.001  -9.237   0.311
  554    HA   ARG  68           HA       ARG  68  18.310 -10.684   1.024
  555   1HB   ARG  68          2HB       ARG  68  17.697  -7.986   0.033
  556   2HB   ARG  68          1HB       ARG  68  19.160  -8.079   1.003
  557   1HG   ARG  68          2HG       ARG  68  20.172  -8.641  -0.896
  558   2HG   ARG  68          1HG       ARG  68  19.441 -10.231  -0.662
  559   1HD   ARG  68          2HD       ARG  68  17.407  -8.884  -1.856
  560   2HD   ARG  68          1HD       ARG  68  18.804  -8.116  -2.604
  561    HE   ARG  68           HE       ARG  68  17.856 -10.789  -3.035
  562   1HH1  ARG  68          1HH1      ARG  68  20.687  -8.726  -3.145
  563   2HH1  ARG  68          2HH1      ARG  68  21.506  -9.705  -4.316
  564   1HH2  ARG  68          1HH2      ARG  68  18.942 -12.075  -4.574
  565   2HH2  ARG  68          2HH2      ARG  68  20.515 -11.608  -5.127
  566    H    SER  69           H        SER  69  16.320  -8.412   2.811
  567    HA   SER  69           HA       SER  69  18.201  -8.087   4.963
  568   1HB   SER  69          2HB       SER  69  16.705  -6.257   4.556
  569   2HB   SER  69          1HB       SER  69  15.294  -7.310   4.645
  570    HG   SER  69           HG       SER  69  17.024  -6.526   6.750
  571    H    SER  70           H        SER  70  18.082  -8.958   7.038
  572    HA   SER  70           HA       SER  70  17.066 -11.619   7.219
  573   1HB   SER  70          2HB       SER  70  19.092 -10.335   8.453
  574   2HB   SER  70          1HB       SER  70  17.860 -10.218   9.712
  575    HG   SER  70           HG       SER  70  18.900 -12.130  10.044
  576    H    SER  71           H        SER  71  15.710  -8.529   7.918
  577    HA   SER  71           HA       SER  71  13.731  -9.621   9.766
  578   1HB   SER  71          2HB       SER  71  13.071  -7.356  10.182
  579   2HB   SER  71          1HB       SER  71  14.834  -7.386  10.165
  580    HG   SER  71           HG       SER  71  14.491  -6.794   7.808
  581    H    MET  72           H        MET  72  13.624 -10.645   7.123
  582    HA   MET  72           HA       MET  72  11.545  -9.291   5.671
  583   1HB   MET  72          2HB       MET  72  13.364 -10.702   4.631
  584   2HB   MET  72          1HB       MET  72  12.536 -12.116   5.268
  585   1HG   MET  72          2HG       MET  72  10.630 -10.544   3.881
  586   2HG   MET  72          1HG       MET  72  12.053 -10.707   2.855
  587   1HE   MET  72          1HE       MET  72   8.747 -13.593   3.163
  588   2HE   MET  72          2HE       MET  72   8.826 -11.835   3.061
  589   3HE   MET  72          3HE       MET  72   9.058 -12.637   4.614
  590    H    LYS  73           H        LYS  73   9.884  -9.162   7.248
  591    HA   LYS  73           HA       LYS  73   8.310 -11.628   7.466
  592   1HB   LYS  73          2HB       LYS  73   8.888  -9.765   9.781
  593   2HB   LYS  73          1HB       LYS  73   7.741 -11.095   9.818
  594   1HG   LYS  73          2HG       LYS  73   9.335 -12.597  10.206
  595   2HG   LYS  73          1HG       LYS  73  10.389 -11.931   8.961
  596   1HD   LYS  73          2HD       LYS  73  11.689 -11.313  10.682
  597   2HD   LYS  73          1HD       LYS  73  10.527 -10.002  10.883
  598   1HE   LYS  73          2HE       LYS  73  10.734 -10.940  13.019
  599   2HE   LYS  73          1HE       LYS  73   9.231 -11.609  12.385
  600   1HZ   LYS  73          1HZ       LYS  73  10.854 -13.187  13.525
  601   2HZ   LYS  73          2HZ       LYS  73  11.789 -13.068  12.122
  602   3HZ   LYS  73          3HZ       LYS  73  10.212 -13.676  12.039
  603    H    SER  74           H        SER  74   8.205  -8.170   8.379
  604    HA   SER  74           HA       SER  74   5.483  -8.053   7.263
  605   1HB   SER  74          2HB       SER  74   5.382  -5.919   8.767
  606   2HB   SER  74          1HB       SER  74   5.218  -7.508   9.517
  607    HG   SER  74           HG       SER  74   7.600  -5.964   9.365
  608    H    LEU  75           H        LEU  75   4.873  -5.794   6.478
  609    HA   LEU  75           HA       LEU  75   7.157  -4.573   5.065
  610   1HB   LEU  75          2HB       LEU  75   4.357  -5.079   4.063
  611   2HB   LEU  75          1HB       LEU  75   5.504  -4.036   3.245
  612    HG   LEU  75           HG       LEU  75   7.012  -6.239   3.381
  613   1HD1  LEU  75          1HD1      LEU  75   4.227  -7.141   3.821
  614   2HD1  LEU  75          2HD1      LEU  75   5.752  -7.865   4.332
  615   3HD1  LEU  75          3HD1      LEU  75   5.199  -8.059   2.669
  616   1HD2  LEU  75          1HD2      LEU  75   6.738  -6.338   1.135
  617   2HD2  LEU  75          2HD2      LEU  75   5.877  -4.826   1.412
  618   3HD2  LEU  75          3HD2      LEU  75   4.978  -6.333   1.235
  619    H    ARG  76           H        ARG  76   7.292  -2.374   5.036
  620    HA   ARG  76           HA       ARG  76   5.409  -0.938   6.758
  621   1HB   ARG  76          2HB       ARG  76   8.155  -0.912   6.659
  622   2HB   ARG  76          1HB       ARG  76   7.742   0.539   5.757
  623   1HG   ARG  76          2HG       ARG  76   6.570   1.460   7.603
  624   2HG   ARG  76          1HG       ARG  76   6.643  -0.065   8.490
  625   1HD   ARG  76          2HD       ARG  76   8.274   1.494   9.375
  626   2HD   ARG  76          1HD       ARG  76   9.087   0.132   8.605
  627    HE   ARG  76           HE       ARG  76   8.727   2.407   6.878
  628   1HH1  ARG  76          1HH1      ARG  76  10.808   0.937   9.278
  629   2HH1  ARG  76          2HH1      ARG  76  12.230   1.761   8.732
  630   1HH2  ARG  76          1HH2      ARG  76  10.605   3.494   6.163
  631   2HH2  ARG  76          2HH2      ARG  76  12.112   3.212   6.967
  632    H    ILE  77           H        ILE  77   3.689  -0.698   5.293
  633    HA   ILE  77           HA       ILE  77   4.210   1.150   3.053
  634    HB   ILE  77           HB       ILE  77   1.887  -0.768   3.238
  635   1HG1  ILE  77          2HG1      ILE  77   4.460  -1.083   1.671
  636   2HG1  ILE  77          1HG1      ILE  77   4.018  -2.014   3.098
  637   1HG2  ILE  77          1HG2      ILE  77   2.845   0.305   0.658
  638   2HG2  ILE  77          2HG2      ILE  77   2.061   1.452   1.743
  639   3HG2  ILE  77          3HG2      ILE  77   1.204   0.001   1.225
  640   1HD1  ILE  77          1HD1      ILE  77   2.116  -2.954   1.892
  641   2HD1  ILE  77          2HD1      ILE  77   3.639  -3.280   1.066
  642   3HD1  ILE  77          3HD1      ILE  77   2.561  -2.020   0.464
  643    H    LEU  78           H        LEU  78   3.463   3.134   3.412
  644    HA   LEU  78           HA       LEU  78   1.189   3.484   5.250
  645   1HB   LEU  78          2HB       LEU  78   3.540   4.559   5.623
  646   2HB   LEU  78          1HB       LEU  78   3.010   5.708   4.410
  647    HG   LEU  78           HG       LEU  78   1.189   5.211   6.709
  648   1HD1  LEU  78          1HD1      LEU  78   3.924   5.985   7.064
  649   2HD1  LEU  78          2HD1      LEU  78   2.656   5.769   8.272
  650   3HD1  LEU  78          3HD1      LEU  78   2.860   7.330   7.480
  651   1HD2  LEU  78          1HD2      LEU  78   0.288   6.755   5.269
  652   2HD2  LEU  78          2HD2      LEU  78   1.859   7.425   4.827
  653   3HD2  LEU  78          3HD2      LEU  78   1.144   7.811   6.393
  654    H    LEU  79           H        LEU  79  -0.681   4.260   4.503
  655    HA   LEU  79           HA       LEU  79  -0.720   5.400   1.786
  656   1HB   LEU  79          2HB       LEU  79  -3.075   4.619   1.665
  657   2HB   LEU  79          1HB       LEU  79  -1.900   3.326   1.786
  658    HG   LEU  79           HG       LEU  79  -2.501   3.574   4.386
  659   1HD1  LEU  79          1HD1      LEU  79  -4.265   5.363   3.392
  660   2HD1  LEU  79          2HD1      LEU  79  -4.508   4.449   4.881
  661   3HD1  LEU  79          3HD1      LEU  79  -5.242   3.895   3.376
  662   1HD2  LEU  79          1HD2      LEU  79  -4.439   2.062   2.701
  663   2HD2  LEU  79          2HD2      LEU  79  -3.603   1.571   4.173
  664   3HD2  LEU  79          3HD2      LEU  79  -2.730   1.636   2.643
  665    H    LEU  80           H        LEU  80  -1.678   7.338   1.445
  666    HA   LEU  80           HA       LEU  80  -3.134   8.591   3.669
  667   1HB   LEU  80          2HB       LEU  80  -1.183  10.185   2.044
  668   2HB   LEU  80          1HB       LEU  80  -1.885  10.565   3.604
  669    HG   LEU  80           HG       LEU  80  -0.484   8.368   4.280
  670   1HD1  LEU  80          1HD1      LEU  80   0.368   8.768   1.688
  671   2HD1  LEU  80          2HD1      LEU  80   1.205   7.834   2.929
  672   3HD1  LEU  80          3HD1      LEU  80   1.632   9.523   2.659
  673   1HD2  LEU  80          1HD2      LEU  80   1.213   9.878   5.147
  674   2HD2  LEU  80          2HD2      LEU  80  -0.397  10.566   5.361
  675   3HD2  LEU  80          3HD2      LEU  80   0.651  11.155   4.070
  676    H    SER  81           H        SER  81  -4.663  10.146   3.082
  677    HA   SER  81           HA       SER  81  -5.824   9.789   0.494
  678   1HB   SER  81          2HB       SER  81  -7.327  11.749   1.379
  679   2HB   SER  81          1HB       SER  81  -7.442  10.157   2.126
  680    HG   SER  81           HG       SER  81  -7.201  12.095   3.544
  681    H    GLN  82           H        GLN  82  -6.053  11.311  -1.179
  682    HA   GLN  82           HA       GLN  82  -3.808  13.073  -1.449
  683   1HB   GLN  82          2HB       GLN  82  -4.834  11.638  -3.294
  684   2HB   GLN  82          1HB       GLN  82  -6.107  12.845  -3.378
  685   1HG   GLN  82          2HG       GLN  82  -4.480  13.261  -5.092
  686   2HG   GLN  82          1HG       GLN  82  -4.420  14.557  -3.901
  687   1HE2  GLN  82          1HE2      GLN  82  -2.641  14.672  -2.483
  688   2HE2  GLN  82          2HE2      GLN  82  -1.151  13.877  -2.846
  689    H    ASP  83           H        ASP  83  -6.496  13.537   0.194
  690    HA   ASP  83           HA       ASP  83  -7.601  15.307   1.057
  691   1HB   ASP  83          2HB       ASP  83  -5.138  16.117   1.110
  692   2HB   ASP  83          1HB       ASP  83  -5.628  17.176  -0.210
  693    H    ARG  84           H        ARG  84  -9.445  16.199   0.449
  694    HA   ARG  84           HA       ARG  84 -11.058  17.244  -0.765
  695   1HB   ARG  84          2HB       ARG  84  -8.952  17.971  -2.805
  696   2HB   ARG  84          1HB       ARG  84 -10.512  18.741  -2.553
  697   1HG   ARG  84          2HG       ARG  84  -9.737  19.493  -0.327
  698   2HG   ARG  84          1HG       ARG  84  -8.150  18.808  -0.685
  699   1HD   ARG  84          2HD       ARG  84  -7.610  20.463  -2.129
  700   2HD   ARG  84          1HD       ARG  84  -9.263  20.637  -2.715
  701    HE   ARG  84           HE       ARG  84  -9.624  22.260  -1.142
  702   1HH1  ARG  84          1HH1      ARG  84  -6.670  20.556  -0.338
  703   2HH1  ARG  84          2HH1      ARG  84  -6.219  21.673   0.906
  704   1HH2  ARG  84          1HH2      ARG  84  -9.025  23.728   0.503
  705   2HH2  ARG  84          2HH2      ARG  84  -7.555  23.473   1.385
  706    H    ASN  85           H        ASN  85 -12.563  16.207  -1.900
  707    HA   ASN  85           HA       ASN  85 -11.686  14.179  -3.840
  708   1HB   ASN  85          2HB       ASN  85 -13.941  13.170  -3.487
  709   2HB   ASN  85          1HB       ASN  85 -12.948  13.214  -2.035
  710   1HD2  ASN  85          1HD2      ASN  85 -15.934  13.191  -2.612
  711   2HD2  ASN  85          2HD2      ASN  85 -16.554  14.465  -1.623
  712    H    LEU  86           H        LEU  86 -12.919  13.858  -5.782
  713    HA   LEU  86           HA       LEU  86 -14.069  16.369  -6.799
  714   1HB   LEU  86          2HB       LEU  86 -12.178  14.486  -7.865
  715   2HB   LEU  86          1HB       LEU  86 -13.573  14.571  -8.924
  716    HG   LEU  86           HG       LEU  86 -13.278  17.060  -8.995
  717   1HD1  LEU  86          1HD1      LEU  86 -12.057  17.649  -7.120
  718   2HD1  LEU  86          2HD1      LEU  86 -10.848  17.734  -8.401
  719   3HD1  LEU  86          3HD1      LEU  86 -10.901  16.333  -7.331
  720   1HD2  LEU  86          1HD2      LEU  86 -10.970  16.767 -10.286
  721   2HD2  LEU  86          2HD2      LEU  86 -12.495  16.153 -10.925
  722   3HD2  LEU  86          3HD2      LEU  86 -11.384  15.063 -10.096
  723    H    GLU  87           H        GLU  87 -16.235  16.233  -6.418
  724    HA   GLU  87           HA       GLU  87 -17.749  14.386  -8.011
  725   1HB   GLU  87          2HB       GLU  87 -19.101  13.534  -6.052
  726   2HB   GLU  87          1HB       GLU  87 -17.474  12.886  -6.194
  727   1HG   GLU  87          2HG       GLU  87 -16.706  14.041  -4.352
  728   2HG   GLU  87          1HG       GLU  87 -17.982  15.253  -4.451
  729    H    HIS  88           H        HIS  88 -17.934  16.822  -8.611
  730    HA   HIS  88           HA       HIS  88 -19.606  18.496  -7.042
  731   1HB   HIS  88          2HB       HIS  88 -19.850  19.826  -9.170
  732   2HB   HIS  88          1HB       HIS  88 -18.195  19.557  -8.641
  733    HD1  HIS  88           HD1      HIS  88 -19.681  16.636 -10.324
  734    HD2  HIS  88           HD2      HIS  88 -17.558  20.042 -11.415
  735    HE1  HIS  88           HE1      HIS  88 -18.858  16.196 -12.655
  736    HE2  HIS  88           HE2      HIS  88 -17.634  18.294 -13.322
  737    H    HIS  89           H        HIS  89 -21.745  19.353  -7.827
  738    HA   HIS  89           HA       HIS  89 -23.395  17.160  -8.906
  739   1HB   HIS  89          2HB       HIS  89 -23.564  18.420  -6.379
  740   2HB   HIS  89          1HB       HIS  89 -24.952  18.975  -7.308
  741    HD1  HIS  89           HD1      HIS  89 -23.284  15.644  -6.505
  742    HD2  HIS  89           HD2      HIS  89 -27.051  17.286  -7.128
  743    HE1  HIS  89           HE1      HIS  89 -24.910  13.769  -6.101
  744    HE2  HIS  89           HE2      HIS  89 -27.187  14.803  -6.413
  745    H    HIS  90           H        HIS  90 -23.895  20.639  -8.219
  746    HA   HIS  90           HA       HIS  90 -24.236  21.261 -11.010
  747   1HB   HIS  90          2HB       HIS  90 -26.601  22.100 -10.676
  748   2HB   HIS  90          1HB       HIS  90 -26.417  20.349 -10.700
  749    HD1  HIS  90           HD1      HIS  90 -27.236  23.197  -8.408
  750    HD2  HIS  90           HD2      HIS  90 -27.016  19.051  -8.308
  751    HE1  HIS  90           HE1      HIS  90 -28.311  22.520  -6.239
  752    HE2  HIS  90           HE2      HIS  90 -28.047  20.016  -6.143
  753    H    HIS  91           H        HIS  91 -24.559  23.561 -11.392
  754    HA   HIS  91           HA       HIS  91 -24.511  25.402  -9.184
  755   1HB   HIS  91          2HB       HIS  91 -22.004  24.615 -10.561
  756   2HB   HIS  91          1HB       HIS  91 -22.232  26.337 -10.286
  757    HD1  HIS  91           HD1      HIS  91 -23.607  26.091  -7.472
  758    HD2  HIS  91           HD2      HIS  91 -20.117  24.156  -8.631
  759    HE1  HIS  91           HE1      HIS  91 -22.383  25.580  -5.339
  760    HE2  HIS  91           HE2      HIS  91 -20.246  24.461  -6.067
  761    H    HIS  92           H        HIS  92 -24.618  27.627  -9.846
  762    HA   HIS  92           HA       HIS  92 -26.066  27.990 -12.276
  763   1HB   HIS  92          2HB       HIS  92 -26.149  30.368 -11.654
  764   2HB   HIS  92          1HB       HIS  92 -26.603  29.330 -10.312
  765    HD1  HIS  92           HD1      HIS  92 -25.807  32.111  -9.604
  766    HD2  HIS  92           HD2      HIS  92 -23.026  29.040  -9.922
  767    HE1  HIS  92           HE1      HIS  92 -23.835  32.842  -8.223
  768    HE2  HIS  92           HE2      HIS  92 -22.146  30.988  -8.470
  769    H    HIS  93           H        HIS  93 -25.505  29.143 -14.124
  770    HA   HIS  93           HA       HIS  93 -22.643  29.142 -14.705
  771   1HB   HIS  93          2HB       HIS  93 -25.124  28.898 -16.284
  772   2HB   HIS  93          1HB       HIS  93 -23.838  29.816 -17.059
  773    HD1  HIS  93           HD1      HIS  93 -22.650  27.080 -14.892
  774    HD2  HIS  93           HD2      HIS  93 -23.701  27.591 -18.881
  775    HE1  HIS  93           HE1      HIS  93 -21.730  25.072 -16.093
  776    HE2  HIS  93           HE2      HIS  93 -22.459  25.359 -18.487
  Start of MODEL    2
    1    H    GLN   1           H        GLN   1   4.291 -20.014   4.720
    2    HA   GLN   1           HA       GLN   1   5.019 -21.012   2.772
    3   1HB   GLN   1          2HB       GLN   1   3.928 -23.249   3.588
    4   2HB   GLN   1          1HB       GLN   1   2.546 -22.709   2.646
    5   1HG   GLN   1          2HG       GLN   1   4.728 -22.382   0.952
    6   2HG   GLN   1          1HG       GLN   1   5.014 -23.913   1.776
    7   1HE2  GLN   1          1HE2      GLN   1   3.290 -22.320  -0.668
    8   2HE2  GLN   1          2HE2      GLN   1   2.248 -23.623  -1.115
    9    H    SER   2           H        SER   2   4.715 -19.271   1.551
   10    HA   SER   2           HA       SER   2   3.772 -17.651   0.279
   11   1HB   SER   2          2HB       SER   2   1.341 -19.378  -0.116
   12   2HB   SER   2          1HB       SER   2   2.125 -18.287  -1.257
   13    HG   SER   2           HG       SER   2   2.871 -20.174  -1.934
   14    H    ASP   3           H        ASP   3   3.547 -16.295   2.139
   15    HA   ASP   3           HA       ASP   3   0.953 -15.217   2.448
   16   1HB   ASP   3          2HB       ASP   3   1.212 -17.418   4.014
   17   2HB   ASP   3          1HB       ASP   3   1.819 -16.183   5.112
   18    H    VAL   4           H        VAL   4   1.937 -13.265   2.021
   19    HA   VAL   4           HA       VAL   4   4.076 -12.355   3.801
   20    HB   VAL   4           HB       VAL   4   2.942 -10.904   1.404
   21   1HG1  VAL   4          1HG1      VAL   4   5.121 -10.394   3.334
   22   2HG1  VAL   4          2HG1      VAL   4   4.107  -9.264   2.440
   23   3HG1  VAL   4          3HG1      VAL   4   5.472 -10.044   1.642
   24   1HG2  VAL   4          1HG2      VAL   4   4.825 -11.745   0.128
   25   2HG2  VAL   4          2HG2      VAL   4   3.876 -13.093   0.752
   26   3HG2  VAL   4          3HG2      VAL   4   5.398 -12.654   1.526
   27    H    ARG   5           H        ARG   5   3.661 -11.111   5.505
   28    HA   ARG   5           HA       ARG   5   0.997 -10.010   5.869
   29   1HB   ARG   5          2HB       ARG   5   3.399 -10.190   7.689
   30   2HB   ARG   5          1HB       ARG   5   1.914  -9.366   8.141
   31   1HG   ARG   5          2HG       ARG   5   0.712 -11.319   8.298
   32   2HG   ARG   5          1HG       ARG   5   1.791 -12.196   7.211
   33   1HD   ARG   5          2HD       ARG   5   3.487 -11.569   9.232
   34   2HD   ARG   5          1HD       ARG   5   1.972 -11.756  10.113
   35    HE   ARG   5           HE       ARG   5   2.056 -13.964   8.552
   36   1HH1  ARG   5          1HH1      ARG   5   4.334 -12.549  10.807
   37   2HH1  ARG   5          2HH1      ARG   5   5.041 -14.069  11.237
   38   1HH2  ARG   5          1HH2      ARG   5   2.990 -15.962   9.125
   39   2HH2  ARG   5          2HH2      ARG   5   4.276 -16.007  10.282
   40    H    ILE   6           H        ILE   6   0.518  -8.067   5.130
   41    HA   ILE   6           HA       ILE   6   2.644  -6.041   4.937
   42    HB   ILE   6           HB       ILE   6  -0.061  -5.977   3.589
   43   1HG1  ILE   6          2HG1      ILE   6   2.550  -6.696   2.256
   44   2HG1  ILE   6          1HG1      ILE   6   1.474  -7.921   2.919
   45   1HG2  ILE   6          1HG2      ILE   6   0.666  -4.126   2.422
   46   2HG2  ILE   6          2HG2      ILE   6   2.371  -4.500   2.671
   47   3HG2  ILE   6          3HG2      ILE   6   1.404  -3.860   4.001
   48   1HD1  ILE   6          1HD1      ILE   6   0.139  -7.826   1.151
   49   2HD1  ILE   6          2HD1      ILE   6   1.406  -6.879   0.372
   50   3HD1  ILE   6          3HD1      ILE   6   0.074  -6.064   1.192
   51    H    LYS   7           H        LYS   7   2.670  -4.531   6.463
   52    HA   LYS   7           HA       LYS   7   0.189  -3.931   7.919
   53   1HB   LYS   7          2HB       LYS   7   2.260  -4.696   9.173
   54   2HB   LYS   7          1HB       LYS   7   2.995  -3.161   8.732
   55   1HG   LYS   7          2HG       LYS   7   1.659  -1.951  10.140
   56   2HG   LYS   7          1HG       LYS   7   0.339  -3.122  10.071
   57   1HD   LYS   7          2HD       LYS   7   1.248  -3.291  12.246
   58   2HD   LYS   7          1HD       LYS   7   1.843  -4.697  11.361
   59   1HE   LYS   7          2HE       LYS   7   3.754  -2.748  10.890
   60   2HE   LYS   7          1HE       LYS   7   3.307  -2.499  12.575
   61   1HZ   LYS   7          1HZ       LYS   7   4.147  -4.502  13.189
   62   2HZ   LYS   7          2HZ       LYS   7   5.151  -4.222  11.857
   63   3HZ   LYS   7          3HZ       LYS   7   3.815  -5.246  11.704
   64    H    PHE   8           H        PHE   8  -0.866  -2.195   7.251
   65    HA   PHE   8           HA       PHE   8   0.677   0.102   6.241
   66   1HB   PHE   8          2HB       PHE   8  -1.642   0.622   5.089
   67   2HB   PHE   8          1HB       PHE   8  -0.486  -0.472   4.344
   68    HD1  PHE   8           HD1      PHE   8  -0.815  -2.981   4.715
   69    HD2  PHE   8           HD2      PHE   8  -3.804  -0.076   5.578
   70    HE1  PHE   8           HE1      PHE   8  -2.534  -4.736   4.649
   71    HE2  PHE   8           HE2      PHE   8  -5.528  -1.829   5.516
   72    HZ   PHE   8           HZ       PHE   8  -4.895  -4.162   5.052
   73    H    GLU   9           H        GLU   9   0.086   2.172   6.870
   74    HA   GLU   9           HA       GLU   9  -1.808   2.300   9.125
   75   1HB   GLU   9          2HB       GLU   9   0.676   2.593   9.640
   76   2HB   GLU   9          1HB       GLU   9   0.569   4.120   8.776
   77   1HG   GLU   9          2HG       GLU   9  -1.278   4.756  10.365
   78   2HG   GLU   9          1HG       GLU   9  -0.850   3.326  11.300
   79    H    HIS  10           H        HIS  10  -3.269   3.922   9.208
   80    HA   HIS  10           HA       HIS  10  -3.177   6.057   7.207
   81   1HB   HIS  10          2HB       HIS  10  -4.558   4.212   6.268
   82   2HB   HIS  10          1HB       HIS  10  -5.613   4.319   7.671
   83    HD1  HIS  10           HD1      HIS  10  -7.672   5.573   7.176
   84    HD2  HIS  10           HD2      HIS  10  -4.447   7.001   4.978
   85    HE1  HIS  10           HE1      HIS  10  -8.600   7.420   5.744
   86    HE2  HIS  10           HE2      HIS  10  -6.611   8.330   4.492
   87    H    ASN  11           H        ASN  11  -3.280   7.878   8.337
   88    HA   ASN  11           HA       ASN  11  -3.806   9.443   9.895
   89   1HB   ASN  11          2HB       ASN  11  -6.378   7.881   9.777
   90   2HB   ASN  11          1HB       ASN  11  -6.198   9.284  10.822
   91   1HD2  ASN  11          1HD2      ASN  11  -8.099   9.733   9.257
   92   2HD2  ASN  11          2HD2      ASN  11  -7.688  10.662   7.859
   93    H    GLY  12           H        GLY  12  -2.371   7.091  10.822
   94   1HA   GLY  12          2HA       GLY  12  -1.489   6.897  13.042
   95   2HA   GLY  12          1HA       GLY  12  -3.083   7.286  13.671
   96    H    GLU  13           H        GLU  13  -4.700   5.503  12.321
   97    HA   GLU  13           HA       GLU  13  -4.216   3.110  13.784
   98   1HB   GLU  13          2HB       GLU  13  -6.468   4.196  12.965
   99   2HB   GLU  13          1HB       GLU  13  -6.193   3.205  11.536
  100   1HG   GLU  13          2HG       GLU  13  -5.775   1.507  13.715
  101   2HG   GLU  13          1HG       GLU  13  -7.196   2.460  14.130
  102    H    ARG  14           H        ARG  14  -3.681   1.044  13.070
  103    HA   ARG  14           HA       ARG  14  -2.577   0.889  10.344
  104   1HB   ARG  14          2HB       ARG  14  -0.800  -0.582  11.228
  105   2HB   ARG  14          1HB       ARG  14  -0.741   1.035  11.915
  106   1HG   ARG  14          2HG       ARG  14  -1.444   0.320  14.001
  107   2HG   ARG  14          1HG       ARG  14  -2.171  -1.156  13.362
  108   1HD   ARG  14          2HD       ARG  14  -0.305  -2.128  14.155
  109   2HD   ARG  14          1HD       ARG  14   0.414  -1.528  12.662
  110    HE   ARG  14           HE       ARG  14   0.748   0.531  14.395
  111   1HH1  ARG  14          1HH1      ARG  14   1.567  -2.874  14.517
  112   2HH1  ARG  14          2HH1      ARG  14   2.940  -2.634  15.544
  113   1HH2  ARG  14          1HH2      ARG  14   2.563   0.840  15.746
  114   2HH2  ARG  14          2HH2      ARG  14   3.506  -0.526  16.242
  115    H    ARG  15           H        ARG  15  -2.730  -1.071   9.252
  116    HA   ARG  15           HA       ARG  15  -4.396  -3.150  10.500
  117   1HB   ARG  15          2HB       ARG  15  -5.316  -1.434   8.539
  118   2HB   ARG  15          1HB       ARG  15  -4.818  -2.846   7.619
  119   1HG   ARG  15          2HG       ARG  15  -6.379  -3.485  10.008
  120   2HG   ARG  15          1HG       ARG  15  -7.242  -2.509   8.820
  121   1HD   ARG  15          2HD       ARG  15  -7.199  -4.149   7.229
  122   2HD   ARG  15          1HD       ARG  15  -5.702  -4.854   7.839
  123    HE   ARG  15           HE       ARG  15  -6.933  -6.224   9.191
  124   1HH1  ARG  15          1HH1      ARG  15  -9.010  -3.632   8.061
  125   2HH1  ARG  15          2HH1      ARG  15 -10.452  -4.339   8.706
  126   1HH2  ARG  15          1HH2      ARG  15  -8.844  -7.151  10.040
  127   2HH2  ARG  15          2HH2      ARG  15 -10.359  -6.339   9.830
  128    H    ILE  16           H        ILE  16  -3.795  -5.223  10.095
  129    HA   ILE  16           HA       ILE  16  -1.505  -5.622   8.274
  130    HB   ILE  16           HB       ILE  16  -2.132  -7.281  10.720
  131   1HG1  ILE  16          2HG1      ILE  16   0.145  -5.325  10.520
  132   2HG1  ILE  16          1HG1      ILE  16  -1.435  -4.810  11.098
  133   1HG2  ILE  16          1HG2      ILE  16  -0.886  -8.546   9.147
  134   2HG2  ILE  16          2HG2      ILE  16   0.251  -8.012  10.384
  135   3HG2  ILE  16          3HG2      ILE  16   0.203  -7.197   8.820
  136   1HD1  ILE  16          1HD1      ILE  16  -1.294  -6.590  12.835
  137   2HD1  ILE  16          2HD1      ILE  16  -0.088  -5.313  12.987
  138   3HD1  ILE  16          3HD1      ILE  16   0.366  -6.881  12.317
  139    H    ILE  17           H        ILE  17  -1.815  -6.976   6.619
  140    HA   ILE  17           HA       ILE  17  -3.817  -9.104   6.853
  141    HB   ILE  17           HB       ILE  17  -3.670  -7.296   4.435
  142   1HG1  ILE  17          2HG1      ILE  17  -5.721  -7.403   6.661
  143   2HG1  ILE  17          1HG1      ILE  17  -4.625  -6.069   6.316
  144   1HG2  ILE  17          1HG2      ILE  17  -5.528  -8.502   3.590
  145   2HG2  ILE  17          2HG2      ILE  17  -5.761  -9.355   5.116
  146   3HG2  ILE  17          3HG2      ILE  17  -4.351  -9.705   4.115
  147   1HD1  ILE  17          1HD1      ILE  17  -6.561  -5.316   5.365
  148   2HD1  ILE  17          2HD1      ILE  17  -7.082  -6.930   4.881
  149   3HD1  ILE  17          3HD1      ILE  17  -5.806  -6.108   3.982
  150    H    ALA  18           H        ALA  18  -3.154 -10.998   6.040
  151    HA   ALA  18           HA       ALA  18  -0.532 -11.111   4.777
  152   1HB   ALA  18          1HB       ALA  18  -0.844 -13.599   5.075
  153   2HB   ALA  18          2HB       ALA  18  -2.335 -13.222   5.939
  154   3HB   ALA  18          3HB       ALA  18  -0.787 -12.645   6.558
  155    H    PHE  19           H        PHE  19  -0.109 -12.045   2.781
  156    HA   PHE  19           HA       PHE  19  -2.434 -12.660   1.084
  157   1HB   PHE  19          2HB       PHE  19  -0.103 -10.852   0.438
  158   2HB   PHE  19          1HB       PHE  19  -1.155 -11.529  -0.802
  159    HD1  PHE  19           HD1      PHE  19  -1.148  -9.400   2.236
  160    HD2  PHE  19           HD2      PHE  19  -3.184 -10.501  -1.336
  161    HE1  PHE  19           HE1      PHE  19  -2.722  -7.540   2.563
  162    HE2  PHE  19           HE2      PHE  19  -4.760  -8.641  -1.015
  163    HZ   PHE  19           HZ       PHE  19  -4.531  -7.157   0.936
  164    H    SER  20           H        SER  20  -2.275 -14.570   0.101
  165    HA   SER  20           HA       SER  20   0.058 -16.184   0.361
  166   1HB   SER  20          2HB       SER  20  -2.138 -17.222   0.382
  167   2HB   SER  20          1HB       SER  20  -2.478 -16.613  -1.236
  168    HG   SER  20           HG       SER  20  -1.585 -18.909  -0.817
  169    H    ARG  21           H        ARG  21   1.751 -16.368  -0.945
  170    HA   ARG  21           HA       ARG  21   2.017 -14.746  -3.269
  171   1HB   ARG  21          2HB       ARG  21   3.818 -16.998  -2.368
  172   2HB   ARG  21          1HB       ARG  21   4.237 -15.694  -3.469
  173   1HG   ARG  21          2HG       ARG  21   3.704 -14.136  -1.492
  174   2HG   ARG  21          1HG       ARG  21   3.827 -15.598  -0.508
  175   1HD   ARG  21          2HD       ARG  21   6.081 -15.915  -1.805
  176   2HD   ARG  21          1HD       ARG  21   5.935 -14.180  -2.080
  177    HE   ARG  21           HE       ARG  21   6.412 -13.814   0.128
  178   1HH1  ARG  21          1HH1      ARG  21   5.706 -17.214  -0.323
  179   2HH1  ARG  21          2HH1      ARG  21   6.208 -17.655   1.273
  180   1HH2  ARG  21          1HH2      ARG  21   7.062 -14.397   2.234
  181   2HH2  ARG  21          2HH2      ARG  21   6.975 -16.054   2.729
  182    HA   PRO  22           HA       PRO  22   3.170 -14.650  -5.138
  183   1HB   PRO  22          2HB       PRO  22   2.377 -14.103  -7.652
  184   2HB   PRO  22          1HB       PRO  22   3.611 -15.320  -7.301
  185   1HG   PRO  22          2HG       PRO  22   0.712 -15.684  -7.936
  186   2HG   PRO  22          1HG       PRO  22   2.108 -16.624  -8.492
  187   1HD   PRO  22          2HD       PRO  22   0.443 -17.403  -6.452
  188   2HD   PRO  22          1HD       PRO  22   2.132 -17.922  -6.609
  189    H    VAL  23           H        VAL  23   2.420 -12.845  -4.220
  190    HA   VAL  23           HA       VAL  23  -0.364 -12.241  -4.052
  191    HB   VAL  23           HB       VAL  23   1.191 -11.647  -2.245
  192   1HG1  VAL  23          1HG1      VAL  23   3.176 -11.053  -3.401
  193   2HG1  VAL  23          2HG1      VAL  23   2.633  -9.608  -2.550
  194   3HG1  VAL  23          3HG1      VAL  23   2.358  -9.765  -4.284
  195   1HG2  VAL  23          1HG2      VAL  23   0.153  -9.663  -1.639
  196   2HG2  VAL  23          2HG2      VAL  23  -0.972 -10.347  -2.813
  197   3HG2  VAL  23          3HG2      VAL  23   0.126  -9.053  -3.294
  198    H    LYS  24           H        LYS  24  -1.535 -10.564  -5.011
  199    HA   LYS  24           HA       LYS  24  -0.302  -9.427  -7.435
  200   1HB   LYS  24          2HB       LYS  24  -3.246  -9.853  -6.902
  201   2HB   LYS  24          1HB       LYS  24  -2.514  -9.333  -8.412
  202   1HG   LYS  24          2HG       LYS  24  -2.211 -12.031  -7.112
  203   2HG   LYS  24          1HG       LYS  24  -3.156 -11.654  -8.553
  204   1HD   LYS  24          2HD       LYS  24  -0.181 -11.209  -8.361
  205   2HD   LYS  24          1HD       LYS  24  -0.896 -12.704  -8.965
  206   1HE   LYS  24          2HE       LYS  24  -1.839 -11.632 -10.827
  207   2HE   LYS  24          1HE       LYS  24  -1.637 -10.030 -10.118
  208   1HZ   LYS  24          1HZ       LYS  24   0.126 -10.001 -11.506
  209   2HZ   LYS  24          2HZ       LYS  24   0.286 -11.683 -11.550
  210   3HZ   LYS  24          3HZ       LYS  24   0.894 -10.810 -10.237
  211    H    TYR  25           H        TYR  25  -0.200  -7.281  -7.695
  212    HA   TYR  25           HA       TYR  25  -0.586  -5.497  -5.580
  213   1HB   TYR  25          2HB       TYR  25   0.930  -5.023  -7.443
  214   2HB   TYR  25          1HB       TYR  25  -0.432  -4.927  -8.551
  215    HD1  TYR  25           HD1      TYR  25   1.412  -3.212  -5.893
  216    HD2  TYR  25           HD2      TYR  25  -1.883  -2.966  -8.575
  217    HE1  TYR  25           HE1      TYR  25   1.250  -0.796  -5.467
  218    HE2  TYR  25           HE2      TYR  25  -2.054  -0.551  -8.153
  219    HH   TYR  25           HH       TYR  25   0.297   1.258  -6.832
  220    H    GLU  26           H        GLU  26  -2.661  -6.220  -8.370
  221    HA   GLU  26           HA       GLU  26  -4.615  -4.264  -7.934
  222   1HB   GLU  26          2HB       GLU  26  -5.073  -7.025  -9.081
  223   2HB   GLU  26          1HB       GLU  26  -6.077  -5.604  -9.330
  224   1HG   GLU  26          2HG       GLU  26  -4.838  -4.941 -11.041
  225   2HG   GLU  26          1HG       GLU  26  -3.353  -5.075 -10.101
  226    H    ASP  27           H        ASP  27  -4.375  -7.586  -6.683
  227    HA   ASP  27           HA       ASP  27  -6.867  -7.579  -5.348
  228   1HB   ASP  27          2HB       ASP  27  -4.650  -9.378  -5.637
  229   2HB   ASP  27          1HB       ASP  27  -5.101  -9.286  -3.936
  230    H    VAL  28           H        VAL  28  -3.577  -6.817  -4.230
  231    HA   VAL  28           HA       VAL  28  -4.289  -6.371  -1.528
  232    HB   VAL  28           HB       VAL  28  -1.979  -5.086  -2.993
  233   1HG1  VAL  28          1HG1      VAL  28  -2.024  -5.889  -0.107
  234   2HG1  VAL  28          2HG1      VAL  28  -2.690  -4.340  -0.624
  235   3HG1  VAL  28          3HG1      VAL  28  -0.992  -4.714  -0.922
  236   1HG2  VAL  28          1HG2      VAL  28  -1.152  -7.346  -1.485
  237   2HG2  VAL  28          2HG2      VAL  28  -1.035  -7.080  -3.225
  238   3HG2  VAL  28          3HG2      VAL  28  -2.469  -7.849  -2.546
  239    H    GLU  29           H        GLU  29  -3.854  -4.134  -4.265
  240    HA   GLU  29           HA       GLU  29  -4.456  -1.779  -2.843
  241   1HB   GLU  29          2HB       GLU  29  -4.026  -2.543  -5.618
  242   2HB   GLU  29          1HB       GLU  29  -5.260  -1.300  -5.463
  243   1HG   GLU  29          2HG       GLU  29  -3.185  -0.491  -3.780
  244   2HG   GLU  29          1HG       GLU  29  -2.402  -1.090  -5.238
  245    H    HIS  30           H        HIS  30  -6.537  -3.911  -4.815
  246    HA   HIS  30           HA       HIS  30  -8.883  -2.415  -4.665
  247   1HB   HIS  30          2HB       HIS  30  -8.492  -4.464  -6.084
  248   2HB   HIS  30          1HB       HIS  30  -8.773  -5.434  -4.643
  249    HD1  HIS  30           HD1      HIS  30 -10.596  -2.840  -6.738
  250    HD2  HIS  30           HD2      HIS  30 -11.386  -6.065  -4.238
  251    HE1  HIS  30           HE1      HIS  30 -13.084  -3.185  -6.851
  252    HE2  HIS  30           HE2      HIS  30 -13.521  -5.216  -5.426
  253    H    LYS  31           H        LYS  31  -7.589  -4.794  -2.378
  254    HA   LYS  31           HA       LYS  31  -9.853  -4.763  -0.653
  255   1HB   LYS  31          2HB       LYS  31  -7.789  -6.443  -0.893
  256   2HB   LYS  31          1HB       LYS  31  -7.171  -5.461   0.428
  257   1HG   LYS  31          2HG       LYS  31  -9.049  -6.003   1.801
  258   2HG   LYS  31          1HG       LYS  31  -9.861  -6.809   0.457
  259   1HD   LYS  31          2HD       LYS  31  -8.623  -8.690   0.661
  260   2HD   LYS  31          1HD       LYS  31  -7.161  -7.805   1.106
  261   1HE   LYS  31          2HE       LYS  31  -7.672  -8.925   3.064
  262   2HE   LYS  31          1HE       LYS  31  -8.412  -7.347   3.328
  263   1HZ   LYS  31          1HZ       LYS  31  -9.674  -9.945   2.909
  264   2HZ   LYS  31          2HZ       LYS  31 -10.457  -8.604   2.239
  265   3HZ   LYS  31          3HZ       LYS  31 -10.147  -8.660   3.901
  266    H    VAL  32           H        VAL  32  -6.641  -3.215  -0.446
  267    HA   VAL  32           HA       VAL  32  -7.167  -1.868   1.988
  268    HB   VAL  32           HB       VAL  32  -5.181  -1.074  -0.148
  269   1HG1  VAL  32          1HG1      VAL  32  -4.081  -0.382   2.237
  270   2HG1  VAL  32          2HG1      VAL  32  -5.790  -0.077   2.544
  271   3HG1  VAL  32          3HG1      VAL  32  -4.983   0.717   1.193
  272   1HG2  VAL  32          1HG2      VAL  32  -5.228  -3.468   1.149
  273   2HG2  VAL  32          2HG2      VAL  32  -4.224  -2.504   2.231
  274   3HG2  VAL  32          3HG2      VAL  32  -3.773  -2.685   0.536
  275    H    THR  33           H        THR  33  -7.445  -0.841  -1.402
  276    HA   THR  33           HA       THR  33  -8.055   1.846  -0.946
  277    HB   THR  33           HB       THR  33  -8.871   0.019  -3.210
  278    HG1  THR  33           HG1      THR  33  -6.755   0.280  -3.380
  279   1HG2  THR  33          1HG2      THR  33 -10.390   1.888  -3.257
  280   2HG2  THR  33          2HG2      THR  33  -9.196   2.063  -4.542
  281   3HG2  THR  33          3HG2      THR  33  -9.053   3.022  -3.070
  282    H    THR  34           H        THR  34 -10.199  -0.995  -1.000
  283    HA   THR  34           HA       THR  34 -12.592   0.554  -0.781
  284    HB   THR  34           HB       THR  34 -12.153  -2.363  -0.112
  285    HG1  THR  34           HG1      THR  34 -12.299  -2.724  -2.169
  286   1HG2  THR  34          1HG2      THR  34 -14.578  -2.570  -0.635
  287   2HG2  THR  34          2HG2      THR  34 -14.675  -0.809  -0.602
  288   3HG2  THR  34          3HG2      THR  34 -14.220  -1.694   0.853
  289    H    VAL  35           H        VAL  35 -10.429  -0.969   1.562
  290    HA   VAL  35           HA       VAL  35 -12.083  -0.719   3.820
  291    HB   VAL  35           HB       VAL  35  -9.060  -0.628   3.766
  292   1HG1  VAL  35          1HG1      VAL  35  -9.747   0.107   5.891
  293   2HG1  VAL  35          2HG1      VAL  35  -9.375  -1.605   6.092
  294   3HG1  VAL  35          3HG1      VAL  35 -11.054  -1.076   5.968
  295   1HG2  VAL  35          1HG2      VAL  35 -10.225  -3.131   4.609
  296   2HG2  VAL  35          2HG2      VAL  35  -9.023  -2.815   3.358
  297   3HG2  VAL  35          3HG2      VAL  35 -10.742  -2.709   2.976
  298    H    PHE  36           H        PHE  36  -9.488   1.462   2.657
  299    HA   PHE  36           HA       PHE  36 -10.358   3.477   4.587
  300   1HB   PHE  36          2HB       PHE  36  -7.993   3.561   2.711
  301   2HB   PHE  36          1HB       PHE  36  -8.312   4.658   4.049
  302    HD1  PHE  36           HD1      PHE  36  -8.304   3.716   6.401
  303    HD2  PHE  36           HD2      PHE  36  -6.823   1.568   3.040
  304    HE1  PHE  36           HE1      PHE  36  -7.024   2.250   7.908
  305    HE2  PHE  36           HE2      PHE  36  -5.545   0.099   4.539
  306    HZ   PHE  36           HZ       PHE  36  -5.642   0.438   6.976
  307    H    GLY  37           H        GLY  37 -10.739   2.812   1.217
  308   1HA   GLY  37          2HA       GLY  37 -12.408   4.058   0.000
  309   2HA   GLY  37          1HA       GLY  37 -11.921   5.494   0.885
  310    H    GLN  38           H        GLN  38 -12.028   6.090  -1.586
  311    HA   GLN  38           HA       GLN  38  -9.260   5.997  -2.562
  312   1HB   GLN  38          2HB       GLN  38 -10.029   5.739  -4.869
  313   2HB   GLN  38          1HB       GLN  38 -10.544   4.381  -3.882
  314   1HG   GLN  38          2HG       GLN  38 -12.549   6.460  -3.932
  315   2HG   GLN  38          1HG       GLN  38 -12.117   5.940  -5.558
  316   1HE2  GLN  38          1HE2      GLN  38 -14.241   5.086  -5.755
  317   2HE2  GLN  38          2HE2      GLN  38 -14.651   3.567  -5.042
  318    HA   PRO  39           HA       PRO  39  -8.426   6.669  -4.463
  319   1HB   PRO  39          2HB       PRO  39  -6.750   8.495  -5.462
  320   2HB   PRO  39          1HB       PRO  39  -8.315   8.171  -6.215
  321   1HG   PRO  39          2HG       PRO  39  -7.460  10.473  -4.545
  322   2HG   PRO  39          1HG       PRO  39  -8.633  10.417  -5.869
  323   1HD   PRO  39          2HD       PRO  39  -9.188  10.365  -3.091
  324   2HD   PRO  39          1HD       PRO  39 -10.338  10.101  -4.416
  325    H    LEU  40           H        LEU  40  -6.508   5.844  -3.714
  326    HA   LEU  40           HA       LEU  40  -4.965   7.389  -1.761
  327   1HB   LEU  40          2HB       LEU  40  -6.210   4.691  -1.330
  328   2HB   LEU  40          1HB       LEU  40  -4.759   5.156  -0.462
  329    HG   LEU  40           HG       LEU  40  -7.228   6.867  -0.381
  330   1HD1  LEU  40          1HD1      LEU  40  -8.216   5.634   1.241
  331   2HD1  LEU  40          2HD1      LEU  40  -6.689   4.978   1.831
  332   3HD1  LEU  40          3HD1      LEU  40  -7.423   4.324   0.368
  333   1HD2  LEU  40          1HD2      LEU  40  -4.776   7.448   0.455
  334   2HD2  LEU  40          2HD2      LEU  40  -5.325   6.553   1.871
  335   3HD2  LEU  40          3HD2      LEU  40  -6.215   7.972   1.325
  336    H    ASP  41           H        ASP  41  -2.781   7.029  -1.812
  337    HA   ASP  41           HA       ASP  41  -1.816   5.118  -3.840
  338   1HB   ASP  41          2HB       ASP  41  -0.888   7.855  -3.041
  339   2HB   ASP  41          1HB       ASP  41   0.275   6.713  -3.703
  340    H    LEU  42           H        LEU  42  -0.178   3.703  -3.348
  341    HA   LEU  42           HA       LEU  42   0.365   3.302  -0.518
  342   1HB   LEU  42          2HB       LEU  42   1.451   1.612  -2.755
  343   2HB   LEU  42          1HB       LEU  42   1.169   1.158  -1.086
  344    HG   LEU  42           HG       LEU  42  -1.157   1.893  -2.821
  345   1HD1  LEU  42          1HD1      LEU  42  -0.152   0.333  -4.236
  346   2HD1  LEU  42          2HD1      LEU  42  -1.308  -0.608  -3.297
  347   3HD1  LEU  42          3HD1      LEU  42   0.406  -0.663  -2.894
  348   1HD2  LEU  42          1HD2      LEU  42  -0.807  -0.055  -0.545
  349   2HD2  LEU  42          2HD2      LEU  42  -2.322   0.333  -1.362
  350   3HD2  LEU  42          3HD2      LEU  42  -1.489   1.565  -0.416
  351    H    HIS  43           H        HIS  43   2.022   4.311   0.410
  352    HA   HIS  43           HA       HIS  43   4.407   4.937  -1.194
  353   1HB   HIS  43          2HB       HIS  43   2.935   6.654   0.241
  354   2HB   HIS  43          1HB       HIS  43   4.026   6.115   1.512
  355    HD1  HIS  43           HD1      HIS  43   4.269   8.976   0.837
  356    HD2  HIS  43           HD2      HIS  43   6.341   6.060  -1.275
  357    HE1  HIS  43           HE1      HIS  43   6.211  10.168  -0.224
  358    HE2  HIS  43           HE2      HIS  43   7.333   8.418  -1.647
  359    H    TYR  44           H        TYR  44   6.109   3.631  -0.918
  360    HA   TYR  44           HA       TYR  44   6.390   2.204   1.639
  361   1HB   TYR  44          2HB       TYR  44   6.208   0.651  -0.157
  362   2HB   TYR  44          1HB       TYR  44   7.334   1.561  -1.156
  363    HD1  TYR  44           HD2      TYR  44   9.764   1.573  -0.550
  364    HD2  TYR  44           HD1      TYR  44   6.973  -1.013   1.350
  365    HE1  TYR  44           HE2      TYR  44  11.619   0.156   0.232
  366    HE2  TYR  44           HE1      TYR  44   8.818  -2.437   2.138
  367    HH   TYR  44           HH       TYR  44  11.964  -1.503   2.215
  368    H    MET  45           H        MET  45   7.961   2.828   2.972
  369    HA   MET  45           HA       MET  45  10.189   4.409   1.864
  370   1HB   MET  45          2HB       MET  45   9.249   4.383   4.736
  371   2HB   MET  45          1HB       MET  45  10.396   5.493   3.999
  372   1HG   MET  45          2HG       MET  45   8.748   6.667   2.884
  373   2HG   MET  45          1HG       MET  45   7.595   5.338   2.974
  374   1HE   MET  45          1HE       MET  45   9.508   8.000   4.510
  375   2HE   MET  45          2HE       MET  45   9.329   7.715   6.241
  376   3HE   MET  45          3HE       MET  45   8.268   8.862   5.422
  377    H    ASN  46           H        ASN  46  12.190   3.602   1.984
  378    HA   ASN  46           HA       ASN  46  12.625   0.971   2.998
  379   1HB   ASN  46          2HB       ASN  46  13.902   2.601   1.161
  380   2HB   ASN  46          1HB       ASN  46  15.050   2.536   2.497
  381   1HD2  ASN  46          1HD2      ASN  46  16.324   0.810   2.662
  382   2HD2  ASN  46          2HD2      ASN  46  16.140  -0.654   1.764
  383    H    ASN  47           H        ASN  47  13.993   4.126   3.921
  384    HA   ASN  47           HA       ASN  47  13.717   3.803   6.680
  385   1HB   ASN  47          2HB       ASN  47  15.875   2.275   5.663
  386   2HB   ASN  47          1HB       ASN  47  16.586   3.665   6.476
  387   1HD2  ASN  47          1HD2      ASN  47  16.731   0.906   7.273
  388   2HD2  ASN  47          2HD2      ASN  47  16.000   0.796   8.834
  389    H    GLU  48           H        GLU  48  16.094   5.017   4.319
  390    HA   GLU  48           HA       GLU  48  16.024   7.629   5.660
  391   1HB   GLU  48          2HB       GLU  48  18.034   6.432   3.750
  392   2HB   GLU  48          1HB       GLU  48  18.100   8.089   4.333
  393   1HG   GLU  48          2HG       GLU  48  18.763   7.480   6.423
  394   2HG   GLU  48          1HG       GLU  48  17.942   5.924   6.352
  395    H    LEU  49           H        LEU  49  15.347   6.019   2.605
  396    HA   LEU  49           HA       LEU  49  14.450   8.603   1.503
  397   1HB   LEU  49          2HB       LEU  49  16.388   7.016   0.442
  398   2HB   LEU  49          1HB       LEU  49  14.973   6.409  -0.393
  399    HG   LEU  49           HG       LEU  49  14.572   9.016  -0.811
  400   1HD1  LEU  49          1HD1      LEU  49  17.569   8.764  -0.591
  401   2HD1  LEU  49          2HD1      LEU  49  16.526   9.731   0.453
  402   3HD1  LEU  49          3HD1      LEU  49  16.693  10.145  -1.253
  403   1HD2  LEU  49          1HD2      LEU  49  16.060   6.924  -2.286
  404   2HD2  LEU  49          2HD2      LEU  49  16.189   8.577  -2.889
  405   3HD2  LEU  49          3HD2      LEU  49  14.607   7.815  -2.734
  406    H    SER  50           H        SER  50  12.632   8.491  -0.007
  407    HA   SER  50           HA       SER  50  10.689   6.450   0.826
  408   1HB   SER  50          2HB       SER  50  10.470   9.320   0.071
  409   2HB   SER  50          1HB       SER  50   9.136   8.267  -0.401
  410    HG   SER  50           HG       SER  50   8.494   8.400   1.582
  411    H    ILE  51           H        ILE  51   9.832   5.057  -0.608
  412    HA   ILE  51           HA       ILE  51  10.510   5.423  -3.458
  413    HB   ILE  51           HB       ILE  51  10.000   2.775  -2.103
  414   1HG1  ILE  51          2HG1      ILE  51  12.002   3.759  -1.109
  415   2HG1  ILE  51          1HG1      ILE  51  12.446   2.424  -2.165
  416   1HG2  ILE  51          1HG2      ILE  51  11.332   3.386  -4.734
  417   2HG2  ILE  51          2HG2      ILE  51   9.645   2.910  -4.555
  418   3HG2  ILE  51          3HG2      ILE  51  10.929   1.796  -4.088
  419   1HD1  ILE  51          1HD1      ILE  51  12.554   5.306  -3.009
  420   2HD1  ILE  51          2HD1      ILE  51  13.232   3.908  -3.842
  421   3HD1  ILE  51          3HD1      ILE  51  13.916   4.436  -2.307
  422    H    LEU  52           H        LEU  52   8.882   5.391  -4.922
  423    HA   LEU  52           HA       LEU  52   6.165   4.940  -3.894
  424   1HB   LEU  52          2HB       LEU  52   7.340   6.886  -5.690
  425   2HB   LEU  52          1HB       LEU  52   5.982   6.073  -6.444
  426    HG   LEU  52           HG       LEU  52   5.895   7.533  -3.799
  427   1HD1  LEU  52          1HD1      LEU  52   6.079   9.189  -5.444
  428   2HD1  LEU  52          2HD1      LEU  52   4.346   9.041  -5.158
  429   3HD1  LEU  52          3HD1      LEU  52   5.070   8.296  -6.583
  430   1HD2  LEU  52          1HD2      LEU  52   3.423   7.252  -4.092
  431   2HD2  LEU  52          2HD2      LEU  52   4.302   5.759  -3.756
  432   3HD2  LEU  52          3HD2      LEU  52   3.769   6.118  -5.399
  433    H    LEU  53           H        LEU  53   5.062   3.198  -4.528
  434    HA   LEU  53           HA       LEU  53   5.936   1.802  -6.973
  435   1HB   LEU  53          2HB       LEU  53   5.123  -0.300  -5.887
  436   2HB   LEU  53          1HB       LEU  53   6.545   0.412  -5.154
  437    HG   LEU  53           HG       LEU  53   4.355   1.459  -3.728
  438   1HD1  LEU  53          1HD1      LEU  53   3.349  -0.698  -2.904
  439   2HD1  LEU  53          2HD1      LEU  53   4.056  -1.476  -4.319
  440   3HD1  LEU  53          3HD1      LEU  53   2.859  -0.197  -4.521
  441   1HD2  LEU  53          1HD2      LEU  53   5.343   0.288  -1.875
  442   2HD2  LEU  53          2HD2      LEU  53   6.632   0.903  -2.911
  443   3HD2  LEU  53          3HD2      LEU  53   6.195  -0.805  -2.966
  444    H    LYS  54           H        LYS  54   4.487   2.276  -8.500
  445    HA   LYS  54           HA       LYS  54   1.632   2.200  -7.800
  446   1HB   LYS  54          2HB       LYS  54   3.074   4.128  -9.188
  447   2HB   LYS  54          1HB       LYS  54   2.223   3.243 -10.448
  448   1HG   LYS  54          2HG       LYS  54   0.103   3.694  -9.419
  449   2HG   LYS  54          1HG       LYS  54   0.889   4.419  -8.016
  450   1HD   LYS  54          2HD       LYS  54   0.566   6.366  -9.078
  451   2HD   LYS  54          1HD       LYS  54   1.937   5.883 -10.076
  452   1HE   LYS  54          2HE       LYS  54   0.450   4.945 -11.734
  453   2HE   LYS  54          1HE       LYS  54  -0.948   5.268 -10.710
  454   1HZ   LYS  54          1HZ       LYS  54  -0.994   7.044 -12.135
  455   2HZ   LYS  54          2HZ       LYS  54   0.689   7.149 -12.266
  456   3HZ   LYS  54          3HZ       LYS  54  -0.085   7.704 -10.868
  457    H    ASN  55           H        ASN  55   4.060   0.901  -9.997
  458    HA   ASN  55           HA       ASN  55   2.056  -0.786 -11.311
  459   1HB   ASN  55          2HB       ASN  55   4.895  -0.035 -11.960
  460   2HB   ASN  55          1HB       ASN  55   4.163  -1.455 -12.698
  461   1HD2  ASN  55          1HD2      ASN  55   4.975   1.454 -13.502
  462   2HD2  ASN  55          2HD2      ASN  55   3.649   1.942 -14.494
  463    H    GLN  56           H        GLN  56   2.718  -3.102 -11.723
  464    HA   GLN  56           HA       GLN  56   3.146  -4.432  -9.273
  465   1HB   GLN  56          2HB       GLN  56   2.638  -5.191 -12.042
  466   2HB   GLN  56          1HB       GLN  56   3.732  -6.308 -11.236
  467   1HG   GLN  56          2HG       GLN  56   1.697  -5.863  -9.395
  468   2HG   GLN  56          1HG       GLN  56   0.881  -5.991 -10.952
  469   1HE2  GLN  56          1HE2      GLN  56   1.975  -7.701  -8.359
  470   2HE2  GLN  56          2HE2      GLN  56   2.087  -9.268  -9.078
  471    H    ASP  57           H        ASP  57   5.323  -3.579 -11.916
  472    HA   ASP  57           HA       ASP  57   7.526  -5.147 -11.328
  473   1HB   ASP  57          2HB       ASP  57   7.028  -3.198 -13.140
  474   2HB   ASP  57          1HB       ASP  57   8.117  -2.337 -12.056
  475    H    ASP  58           H        ASP  58   6.682  -1.960  -9.967
  476    HA   ASP  58           HA       ASP  58   8.956  -1.768  -8.290
  477   1HB   ASP  58          2HB       ASP  58   7.003  -0.035  -9.029
  478   2HB   ASP  58          1HB       ASP  58   6.502  -0.405  -7.381
  479    H    LEU  59           H        LEU  59   5.819  -3.280  -7.884
  480    HA   LEU  59           HA       LEU  59   6.037  -3.651  -5.054
  481   1HB   LEU  59          2HB       LEU  59   3.888  -3.677  -6.378
  482   2HB   LEU  59          1HB       LEU  59   4.363  -5.250  -6.990
  483    HG   LEU  59           HG       LEU  59   4.567  -5.788  -4.390
  484   1HD1  LEU  59          1HD1      LEU  59   2.928  -3.331  -4.559
  485   2HD1  LEU  59          2HD1      LEU  59   3.953  -3.929  -3.255
  486   3HD1  LEU  59          3HD1      LEU  59   2.346  -4.614  -3.499
  487   1HD2  LEU  59          1HD2      LEU  59   1.772  -5.772  -5.360
  488   2HD2  LEU  59          2HD2      LEU  59   2.733  -7.085  -4.684
  489   3HD2  LEU  59          3HD2      LEU  59   2.962  -6.602  -6.364
  490    H    ASP  60           H        ASP  60   6.815  -5.590  -7.910
  491    HA   ASP  60           HA       ASP  60   7.407  -8.010  -6.609
  492   1HB   ASP  60          2HB       ASP  60   8.109  -6.801  -9.247
  493   2HB   ASP  60          1HB       ASP  60   9.006  -8.222  -8.720
  494    H    LYS  61           H        LYS  61   9.488  -5.240  -7.419
  495    HA   LYS  61           HA       LYS  61  11.887  -6.418  -6.476
  496   1HB   LYS  61          2HB       LYS  61  12.783  -4.095  -6.465
  497   2HB   LYS  61          1HB       LYS  61  12.036  -4.553  -7.987
  498   1HG   LYS  61          2HG       LYS  61  10.163  -3.186  -7.602
  499   2HG   LYS  61          1HG       LYS  61  10.554  -2.990  -5.893
  500   1HD   LYS  61          2HD       LYS  61  11.170  -0.960  -6.948
  501   2HD   LYS  61          1HD       LYS  61  12.674  -1.832  -6.636
  502   1HE   LYS  61          2HE       LYS  61  12.971  -1.108  -8.813
  503   2HE   LYS  61          1HE       LYS  61  12.354  -2.743  -9.044
  504   1HZ   LYS  61          1HZ       LYS  61  10.332  -1.975  -9.773
  505   2HZ   LYS  61          2HZ       LYS  61  11.356  -0.774 -10.382
  506   3HZ   LYS  61          3HZ       LYS  61  10.465  -0.488  -8.974
  507    H    ALA  62           H        ALA  62   9.410  -4.422  -4.928
  508    HA   ALA  62           HA       ALA  62  10.776  -3.955  -2.511
  509   1HB   ALA  62          1HB       ALA  62   8.845  -2.640  -3.104
  510   2HB   ALA  62          2HB       ALA  62   8.550  -3.456  -1.571
  511   3HB   ALA  62          3HB       ALA  62   7.812  -4.069  -3.049
  512    H    ILE  63           H        ILE  63   8.512  -6.543  -3.450
  513    HA   ILE  63           HA       ILE  63   8.489  -7.823  -0.921
  514    HB   ILE  63           HB       ILE  63   7.979  -9.107  -3.611
  515   1HG1  ILE  63          2HG1      ILE  63   5.790  -8.173  -1.798
  516   2HG1  ILE  63          1HG1      ILE  63   6.606  -6.985  -2.807
  517   1HG2  ILE  63          1HG2      ILE  63   6.376 -10.409  -1.899
  518   2HG2  ILE  63          2HG2      ILE  63   7.697  -9.995  -0.806
  519   3HG2  ILE  63          3HG2      ILE  63   8.022 -10.928  -2.266
  520   1HD1  ILE  63          1HD1      ILE  63   4.461  -8.109  -3.672
  521   2HD1  ILE  63          2HD1      ILE  63   5.505  -9.490  -4.007
  522   3HD1  ILE  63          3HD1      ILE  63   5.829  -7.933  -4.769
  523    H    ASP  64           H        ASP  64  10.467  -8.270  -3.831
  524    HA   ASP  64           HA       ASP  64  11.822 -10.586  -3.114
  525   1HB   ASP  64          2HB       ASP  64  11.917  -9.087  -5.289
  526   2HB   ASP  64          1HB       ASP  64  13.324  -8.396  -4.489
  527    H    ILE  65           H        ILE  65  12.606  -7.203  -2.330
  528    HA   ILE  65           HA       ILE  65  15.012  -7.765  -0.949
  529    HB   ILE  65           HB       ILE  65  13.169  -5.418  -0.455
  530   1HG1  ILE  65          2HG1      ILE  65  15.562  -5.256  -2.243
  531   2HG1  ILE  65          1HG1      ILE  65  14.079  -5.944  -2.890
  532   1HG2  ILE  65          1HG2      ILE  65  14.799  -4.469   0.777
  533   2HG2  ILE  65          2HG2      ILE  65  16.092  -5.129  -0.225
  534   3HG2  ILE  65          3HG2      ILE  65  15.324  -6.137   1.002
  535   1HD1  ILE  65          1HD1      ILE  65  12.959  -3.953  -2.815
  536   2HD1  ILE  65          2HD1      ILE  65  14.602  -3.395  -3.128
  537   3HD1  ILE  65          3HD1      ILE  65  13.944  -3.324  -1.494
  538    H    LEU  66           H        LEU  66  11.653  -7.422   0.152
  539    HA   LEU  66           HA       LEU  66  12.146  -7.639   2.910
  540   1HB   LEU  66          2HB       LEU  66   9.984  -7.003   1.588
  541   2HB   LEU  66          1HB       LEU  66   9.654  -8.724   1.649
  542    HG   LEU  66           HG       LEU  66   9.920  -8.533   4.184
  543   1HD1  LEU  66          1HD1      LEU  66  10.055  -6.523   5.221
  544   2HD1  LEU  66          2HD1      LEU  66   9.185  -5.677   3.942
  545   3HD1  LEU  66          3HD1      LEU  66  10.887  -6.087   3.730
  546   1HD2  LEU  66          1HD2      LEU  66   7.695  -7.579   2.489
  547   2HD2  LEU  66          2HD2      LEU  66   7.583  -7.238   4.214
  548   3HD2  LEU  66          3HD2      LEU  66   7.751  -8.902   3.652
  549    H    ASP  67           H        ASP  67  11.317 -10.140   0.502
  550    HA   ASP  67           HA       ASP  67  11.299 -12.303   2.323
  551   1HB   ASP  67          2HB       ASP  67  11.339 -12.009  -0.630
  552   2HB   ASP  67          1HB       ASP  67  11.891 -13.551   0.012
  553    H    ARG  68           H        ARG  68  13.872 -10.849   0.388
  554    HA   ARG  68           HA       ARG  68  15.818 -12.857   0.975
  555   1HB   ARG  68          2HB       ARG  68  15.677 -10.843  -0.848
  556   2HB   ARG  68          1HB       ARG  68  16.780 -10.142   0.327
  557   1HG   ARG  68          2HG       ARG  68  18.244 -11.183  -1.081
  558   2HG   ARG  68          1HG       ARG  68  17.992 -12.448   0.124
  559   1HD   ARG  68          2HD       ARG  68  16.057 -13.173  -1.483
  560   2HD   ARG  68          1HD       ARG  68  16.972 -12.254  -2.677
  561    HE   ARG  68           HE       ARG  68  18.613 -14.104  -1.247
  562   1HH1  ARG  68          1HH1      ARG  68  16.333 -13.842  -3.899
  563   2HH1  ARG  68          2HH1      ARG  68  16.954 -15.227  -4.730
  564   1HH2  ARG  68          1HH2      ARG  68  19.420 -15.932  -2.347
  565   2HH2  ARG  68          2HH2      ARG  68  18.705 -16.415  -3.850
  566    H    SER  69           H        SER  69  14.880  -9.799   2.447
  567    HA   SER  69           HA       SER  69  17.100  -9.697   4.255
  568   1HB   SER  69          2HB       SER  69  15.688  -7.722   3.419
  569   2HB   SER  69          1HB       SER  69  14.489  -8.229   4.610
  570    HG   SER  69           HG       SER  69  16.457  -8.132   6.096
  571    H    SER  70           H        SER  70  17.324 -10.650   6.184
  572    HA   SER  70           HA       SER  70  15.319 -12.455   7.155
  573   1HB   SER  70          2HB       SER  70  16.955 -12.802   9.047
  574   2HB   SER  70          1HB       SER  70  17.611 -13.110   7.439
  575    HG   SER  70           HG       SER  70  18.890 -11.760   8.973
  576    H    SER  71           H        SER  71  16.552  -9.286   8.122
  577    HA   SER  71           HA       SER  71  15.033  -9.156  10.545
  578   1HB   SER  71          2HB       SER  71  15.671  -6.527   9.786
  579   2HB   SER  71          1HB       SER  71  16.555  -7.551  10.916
  580    HG   SER  71           HG       SER  71  17.162  -6.843   8.314
  581    H    MET  72           H        MET  72  14.666  -7.701   7.313
  582    HA   MET  72           HA       MET  72  12.159  -6.462   7.991
  583   1HB   MET  72          2HB       MET  72  13.936  -6.577   5.626
  584   2HB   MET  72          1HB       MET  72  12.228  -6.345   5.286
  585   1HG   MET  72          2HG       MET  72  12.713  -4.180   5.534
  586   2HG   MET  72          1HG       MET  72  12.587  -4.536   7.256
  587   1HE   MET  72          1HE       MET  72  16.425  -3.871   4.831
  588   2HE   MET  72          2HE       MET  72  14.772  -3.926   4.221
  589   3HE   MET  72          3HE       MET  72  15.602  -5.420   4.651
  590    H    LYS  73           H        LYS  73  10.749  -8.102   8.622
  591    HA   LYS  73           HA       LYS  73  10.162 -10.224   6.689
  592   1HB   LYS  73          2HB       LYS  73   9.332  -9.828   9.562
  593   2HB   LYS  73          1HB       LYS  73   8.715 -11.126   8.548
  594   1HG   LYS  73          2HG       LYS  73  10.495 -12.369   8.968
  595   2HG   LYS  73          1HG       LYS  73  11.573 -11.087   8.415
  596   1HD   LYS  73          2HD       LYS  73  12.289 -11.163  10.559
  597   2HD   LYS  73          1HD       LYS  73  10.903 -10.102  10.822
  598   1HE   LYS  73          2HE       LYS  73   9.744 -11.680  11.944
  599   2HE   LYS  73          1HE       LYS  73  10.312 -12.982  10.902
  600   1HZ   LYS  73          1HZ       LYS  73  11.072 -12.762  13.403
  601   2HZ   LYS  73          2HZ       LYS  73  12.257 -11.769  12.716
  602   3HZ   LYS  73          3HZ       LYS  73  12.104 -13.376  12.212
  603    H    SER  74           H        SER  74   8.499  -7.640   8.489
  604    HA   SER  74           HA       SER  74   6.085  -8.032   6.902
  605   1HB   SER  74          2HB       SER  74   5.334  -6.006   8.384
  606   2HB   SER  74          1HB       SER  74   5.482  -7.606   9.112
  607    HG   SER  74           HG       SER  74   7.447  -5.550   9.189
  608    H    LEU  75           H        LEU  75   5.132  -6.362   5.629
  609    HA   LEU  75           HA       LEU  75   7.122  -4.627   4.384
  610   1HB   LEU  75          2HB       LEU  75   4.781  -6.021   3.486
  611   2HB   LEU  75          1HB       LEU  75   4.598  -4.313   3.137
  612    HG   LEU  75           HG       LEU  75   7.175  -5.600   2.382
  613   1HD1  LEU  75          1HD1      LEU  75   5.844  -6.020   0.116
  614   2HD1  LEU  75          2HD1      LEU  75   4.530  -6.316   1.257
  615   3HD1  LEU  75          3HD1      LEU  75   6.019  -7.259   1.359
  616   1HD2  LEU  75          1HD2      LEU  75   6.518  -3.135   2.111
  617   2HD2  LEU  75          2HD2      LEU  75   5.483  -3.696   0.797
  618   3HD2  LEU  75          3HD2      LEU  75   7.224  -3.960   0.720
  619    H    ARG  76           H        ARG  76   7.291  -2.535   4.822
  620    HA   ARG  76           HA       ARG  76   5.231  -1.250   6.446
  621   1HB   ARG  76          2HB       ARG  76   7.974  -1.181   6.582
  622   2HB   ARG  76          1HB       ARG  76   7.613   0.328   5.755
  623   1HG   ARG  76          2HG       ARG  76   6.077   0.932   7.584
  624   2HG   ARG  76          1HG       ARG  76   6.532  -0.553   8.422
  625   1HD   ARG  76          2HD       ARG  76   8.469   0.313   9.138
  626   2HD   ARG  76          1HD       ARG  76   8.822   1.050   7.575
  627    HE   ARG  76           HE       ARG  76   7.972   3.023   8.352
  628   1HH1  ARG  76          1HH1      ARG  76   6.914   0.452  10.489
  629   2HH1  ARG  76          2HH1      ARG  76   6.231   1.533  11.656
  630   1HH2  ARG  76          1HH2      ARG  76   7.068   4.444   9.895
  631   2HH2  ARG  76          2HH2      ARG  76   6.318   3.803  11.318
  632    H    ILE  77           H        ILE  77   3.622  -0.881   4.908
  633    HA   ILE  77           HA       ILE  77   4.304   1.042   2.782
  634    HB   ILE  77           HB       ILE  77   1.850  -0.715   2.877
  635   1HG1  ILE  77          2HG1      ILE  77   4.419  -1.146   1.330
  636   2HG1  ILE  77          1HG1      ILE  77   3.888  -2.100   2.710
  637   1HG2  ILE  77          1HG2      ILE  77   3.076   0.852   0.611
  638   2HG2  ILE  77          2HG2      ILE  77   1.662   1.343   1.544
  639   3HG2  ILE  77          3HG2      ILE  77   1.600  -0.109   0.543
  640   1HD1  ILE  77          1HD1      ILE  77   3.147  -3.466   1.080
  641   2HD1  ILE  77          2HD1      ILE  77   2.997  -2.162  -0.096
  642   3HD1  ILE  77          3HD1      ILE  77   1.751  -2.392   1.128
  643    H    LEU  78           H        LEU  78   3.711   3.062   3.193
  644    HA   LEU  78           HA       LEU  78   1.521   3.562   5.086
  645   1HB   LEU  78          2HB       LEU  78   3.723   4.571   5.569
  646   2HB   LEU  78          1HB       LEU  78   3.651   5.432   4.044
  647    HG   LEU  78           HG       LEU  78   1.352   6.299   5.135
  648   1HD1  LEU  78          1HD1      LEU  78   1.288   5.429   7.233
  649   2HD1  LEU  78          2HD1      LEU  78   2.216   6.890   7.566
  650   3HD1  LEU  78          3HD1      LEU  78   3.044   5.345   7.377
  651   1HD2  LEU  78          1HD2      LEU  78   3.125   7.695   4.220
  652   2HD2  LEU  78          2HD2      LEU  78   4.096   7.434   5.668
  653   3HD2  LEU  78          3HD2      LEU  78   2.575   8.320   5.773
  654    H    LEU  79           H        LEU  79  -0.392   4.225   4.355
  655    HA   LEU  79           HA       LEU  79  -0.527   5.378   1.646
  656   1HB   LEU  79          2HB       LEU  79  -2.875   4.585   1.590
  657   2HB   LEU  79          1HB       LEU  79  -1.695   3.296   1.693
  658    HG   LEU  79           HG       LEU  79  -2.296   3.668   4.333
  659   1HD1  LEU  79          1HD1      LEU  79  -4.915   3.569   4.142
  660   2HD1  LEU  79          2HD1      LEU  79  -4.627   4.534   2.694
  661   3HD1  LEU  79          3HD1      LEU  79  -4.069   5.110   4.264
  662   1HD2  LEU  79          1HD2      LEU  79  -3.714   1.650   4.067
  663   2HD2  LEU  79          2HD2      LEU  79  -2.155   1.526   3.252
  664   3HD2  LEU  79          3HD2      LEU  79  -3.614   1.854   2.318
  665    H    LEU  80           H        LEU  80  -1.323   7.367   1.383
  666    HA   LEU  80           HA       LEU  80  -2.774   8.620   3.618
  667   1HB   LEU  80          2HB       LEU  80  -0.843  10.195   1.955
  668   2HB   LEU  80          1HB       LEU  80  -1.500  10.573   3.535
  669    HG   LEU  80           HG       LEU  80  -0.117   8.487   4.306
  670   1HD1  LEU  80          1HD1      LEU  80   0.876   7.502   2.537
  671   2HD1  LEU  80          2HD1      LEU  80   2.093   8.751   2.795
  672   3HD1  LEU  80          3HD1      LEU  80   0.851   8.972   1.564
  673   1HD2  LEU  80          1HD2      LEU  80   0.490  10.474   5.286
  674   2HD2  LEU  80          2HD2      LEU  80   0.795  11.268   3.742
  675   3HD2  LEU  80          3HD2      LEU  80   1.948  10.093   4.372
  676    H    SER  81           H        SER  81  -4.395  10.040   3.067
  677    HA   SER  81           HA       SER  81  -5.312   9.885   0.317
  678   1HB   SER  81          2HB       SER  81  -6.570  10.180   2.866
  679   2HB   SER  81          1HB       SER  81  -7.014  11.563   1.865
  680    HG   SER  81           HG       SER  81  -7.646  10.055   0.238
  681    H    GLN  82           H        GLN  82  -5.611  11.606  -1.059
  682    HA   GLN  82           HA       GLN  82  -3.977  13.934  -0.496
  683   1HB   GLN  82          2HB       GLN  82  -4.144  14.438  -2.857
  684   2HB   GLN  82          1HB       GLN  82  -3.724  12.744  -2.646
  685   1HG   GLN  82          2HG       GLN  82  -6.501  12.766  -2.745
  686   2HG   GLN  82          1HG       GLN  82  -6.003  13.933  -3.966
  687   1HE2  GLN  82          1HE2      GLN  82  -5.367  10.638  -2.828
  688   2HE2  GLN  82          2HE2      GLN  82  -5.021   9.979  -4.387
  689    H    ASP  83           H        ASP  83  -6.978  13.244   0.268
  690    HA   ASP  83           HA       ASP  83  -8.837  14.387   0.827
  691   1HB   ASP  83          2HB       ASP  83  -6.777  16.551   0.720
  692   2HB   ASP  83          1HB       ASP  83  -8.468  16.993   0.933
  693    H    ARG  84           H        ARG  84 -10.355  16.249   0.071
  694    HA   ARG  84           HA       ARG  84 -10.331  16.298  -2.874
  695   1HB   ARG  84          2HB       ARG  84 -12.851  16.381  -2.706
  696   2HB   ARG  84          1HB       ARG  84 -12.106  14.857  -2.254
  697   1HG   ARG  84          2HG       ARG  84 -12.817  14.987  -0.129
  698   2HG   ARG  84          1HG       ARG  84 -12.534  16.726  -0.028
  699   1HD   ARG  84          2HD       ARG  84 -14.879  15.340  -1.319
  700   2HD   ARG  84          1HD       ARG  84 -14.898  16.285   0.169
  701    HE   ARG  84           HE       ARG  84 -13.940  17.955  -1.826
  702   1HH1  ARG  84          1HH1      ARG  84 -16.909  16.248  -1.093
  703   2HH1  ARG  84          2HH1      ARG  84 -17.910  17.365  -1.957
  704   1HH2  ARG  84          1HH2      ARG  84 -15.263  19.420  -2.971
  705   2HH2  ARG  84          2HH2      ARG  84 -16.976  19.163  -3.028
  706    H    ASN  85           H        ASN  85  -9.365  18.295  -3.073
  707    HA   ASN  85           HA       ASN  85 -10.550  20.612  -1.761
  708   1HB   ASN  85          2HB       ASN  85  -7.960  19.948  -2.792
  709   2HB   ASN  85          1HB       ASN  85  -8.536  21.394  -3.613
  710   1HD2  ASN  85          1HD2      ASN  85  -7.325  20.074  -0.693
  711   2HD2  ASN  85          2HD2      ASN  85  -7.322  21.538   0.226
  712    H    LEU  86           H        LEU  86 -10.366  22.643  -3.484
  713    HA   LEU  86           HA       LEU  86 -12.500  22.086  -5.368
  714   1HB   LEU  86          2HB       LEU  86 -12.117  24.184  -3.785
  715   2HB   LEU  86          1HB       LEU  86 -11.224  24.775  -5.170
  716    HG   LEU  86           HG       LEU  86 -13.465  25.648  -5.243
  717   1HD1  LEU  86          1HD1      LEU  86 -13.167  23.458  -7.294
  718   2HD1  LEU  86          2HD1      LEU  86 -12.449  25.067  -7.389
  719   3HD1  LEU  86          3HD1      LEU  86 -14.202  24.880  -7.426
  720   1HD2  LEU  86          1HD2      LEU  86 -14.193  22.861  -4.598
  721   2HD2  LEU  86          2HD2      LEU  86 -15.266  23.718  -5.705
  722   3HD2  LEU  86          3HD2      LEU  86 -14.941  24.379  -4.103
  723    H    GLU  87           H        GLU  87 -10.725  20.653  -6.492
  724    HA   GLU  87           HA       GLU  87  -9.924  22.125  -8.861
  725   1HB   GLU  87          2HB       GLU  87  -7.999  21.153  -6.855
  726   2HB   GLU  87          1HB       GLU  87  -7.625  20.695  -8.509
  727   1HG   GLU  87          2HG       GLU  87  -7.230  22.841  -9.166
  728   2HG   GLU  87          1HG       GLU  87  -8.332  23.527  -7.975
  729    H    HIS  88           H        HIS  88 -11.790  19.918  -8.080
  730    HA   HIS  88           HA       HIS  88 -10.758  17.812  -9.865
  731   1HB   HIS  88          2HB       HIS  88 -12.412  17.685  -7.380
  732   2HB   HIS  88          1HB       HIS  88 -12.658  16.463  -8.622
  733    HD1  HIS  88           HD1      HIS  88 -10.649  17.154  -5.721
  734    HD2  HIS  88           HD2      HIS  88 -10.076  15.112  -9.298
  735    HE1  HIS  88           HE1      HIS  88  -8.687  15.631  -5.321
  736    HE2  HIS  88           HE2      HIS  88  -8.346  14.420  -7.505
  737    H    HIS  89           H        HIS  89 -13.331  20.066  -9.282
  738    HA   HIS  89           HA       HIS  89 -15.113  20.728 -10.511
  739   1HB   HIS  89          2HB       HIS  89 -13.830  19.017 -12.655
  740   2HB   HIS  89          1HB       HIS  89 -15.190  20.095 -12.928
  741    HD1  HIS  89           HD1      HIS  89 -13.006  21.803 -10.661
  742    HD2  HIS  89           HD2      HIS  89 -13.027  21.108 -14.760
  743    HE1  HIS  89           HE1      HIS  89 -11.470  23.529 -11.642
  744    HE2  HIS  89           HE2      HIS  89 -11.555  23.140 -14.128
  745    H    HIS  90           H        HIS  90 -16.295  19.424  -8.904
  746    HA   HIS  90           HA       HIS  90 -17.880  17.351 -10.245
  747   1HB   HIS  90          2HB       HIS  90 -16.120  16.291  -8.779
  748   2HB   HIS  90          1HB       HIS  90 -16.885  17.063  -7.399
  749    HD1  HIS  90           HD1      HIS  90 -16.596  13.904  -8.102
  750    HD2  HIS  90           HD2      HIS  90 -20.024  16.248  -8.292
  751    HE1  HIS  90           HE1      HIS  90 -18.519  12.303  -7.864
  752    HE2  HIS  90           HE2      HIS  90 -20.583  13.747  -7.939
  753    H    HIS  91           H        HIS  91 -17.794  18.718  -6.939
  754    HA   HIS  91           HA       HIS  91 -19.959  20.474  -7.231
  755   1HB   HIS  91          2HB       HIS  91 -20.789  17.776  -7.130
  756   2HB   HIS  91          1HB       HIS  91 -21.154  18.455  -5.548
  757    HD1  HIS  91           HD1      HIS  91 -23.062  20.156  -5.404
  758    HD2  HIS  91           HD2      HIS  91 -22.219  18.930  -9.288
  759    HE1  HIS  91           HE1      HIS  91 -24.942  21.044  -6.814
  760    HE2  HIS  91           HE2      HIS  91 -24.488  20.161  -9.128
  761    H    HIS  92           H        HIS  92 -21.015  20.877  -4.923
  762    HA   HIS  92           HA       HIS  92 -19.154  20.387  -2.745
  763   1HB   HIS  92          2HB       HIS  92 -18.275  22.432  -3.802
  764   2HB   HIS  92          1HB       HIS  92 -19.849  23.199  -3.631
  765    HD1  HIS  92           HD1      HIS  92 -20.583  23.844  -1.192
  766    HD2  HIS  92           HD2      HIS  92 -16.680  22.461  -1.540
  767    HE1  HIS  92           HE1      HIS  92 -19.452  24.480   0.961
  768    HE2  HIS  92           HE2      HIS  92 -17.071  23.694   0.700
  769    H    HIS  93           H        HIS  93 -21.985  22.362  -3.651
  770    HA   HIS  93           HA       HIS  93 -23.296  21.496  -1.158
  771   1HB   HIS  93          2HB       HIS  93 -24.608  23.580  -1.266
  772   2HB   HIS  93          1HB       HIS  93 -22.881  23.909  -1.203
  773    HD1  HIS  93           HD1      HIS  93 -25.891  24.523  -3.211
  774    HD2  HIS  93           HD2      HIS  93 -21.776  24.774  -3.741
  775    HE1  HIS  93           HE1      HIS  93 -25.562  25.921  -5.275
  776    HE2  HIS  93           HE2      HIS  93 -23.070  25.934  -5.655
  Start of MODEL    3
    1    H    GLN   1           H        GLN   1   4.031 -24.117   1.936
    2    HA   GLN   1           HA       GLN   1   4.177 -21.995   2.848
    3   1HB   GLN   1          2HB       GLN   1   6.250 -23.407   1.852
    4   2HB   GLN   1          1HB       GLN   1   6.486 -21.903   0.974
    5   1HG   GLN   1          2HG       GLN   1   6.013 -21.225   3.672
    6   2HG   GLN   1          1HG       GLN   1   7.171 -22.552   3.662
    7   1HE2  GLN   1          1HE2      GLN   1   7.659 -19.871   4.479
    8   2HE2  GLN   1          2HE2      GLN   1   8.869 -19.221   3.432
    9    H    SER   2           H        SER   2   2.480 -20.628   2.046
   10    HA   SER   2           HA       SER   2   3.469 -18.515   0.320
   11   1HB   SER   2          2HB       SER   2   0.826 -19.808  -0.362
   12   2HB   SER   2          1HB       SER   2   1.726 -18.617  -1.298
   13    HG   SER   2           HG       SER   2   3.317 -20.210  -1.664
   14    H    ASP   3           H        ASP   3   3.269 -16.981   1.883
   15    HA   ASP   3           HA       ASP   3   0.713 -15.894   2.421
   16   1HB   ASP   3          2HB       ASP   3   1.008 -16.154   5.008
   17   2HB   ASP   3          1HB       ASP   3   0.265 -17.444   4.076
   18    H    VAL   4           H        VAL   4   1.690 -14.039   1.652
   19    HA   VAL   4           HA       VAL   4   3.978 -12.931   3.078
   20    HB   VAL   4           HB       VAL   4   2.446 -11.682   0.788
   21   1HG1  VAL   4          1HG1      VAL   4   4.959 -11.031   2.252
   22   2HG1  VAL   4          2HG1      VAL   4   3.694  -9.961   1.650
   23   3HG1  VAL   4          3HG1      VAL   4   4.864 -10.661   0.530
   24   1HG2  VAL   4          1HG2      VAL   4   3.999 -12.631  -0.735
   25   2HG2  VAL   4          2HG2      VAL   4   3.426 -13.955   0.279
   26   3HG2  VAL   4          3HG2      VAL   4   5.013 -13.244   0.571
   27    H    ARG   5           H        ARG   5   3.656 -11.747   4.862
   28    HA   ARG   5           HA       ARG   5   1.059 -10.510   5.338
   29   1HB   ARG   5          2HB       ARG   5   3.485 -10.937   7.074
   30   2HB   ARG   5          1HB       ARG   5   2.148  -9.914   7.579
   31   1HG   ARG   5          2HG       ARG   5   0.707 -12.019   7.021
   32   2HG   ARG   5          1HG       ARG   5   2.243 -12.867   7.222
   33   1HD   ARG   5          2HD       ARG   5   2.246 -11.244   9.399
   34   2HD   ARG   5          1HD       ARG   5   0.521 -11.565   9.219
   35    HE   ARG   5           HE       ARG   5   1.630 -14.024   9.028
   36   1HH1  ARG   5          1HH1      ARG   5   1.919 -11.456  11.394
   37   2HH1  ARG   5          2HH1      ARG   5   2.224 -12.539  12.710
   38   1HH2  ARG   5          1HH2      ARG   5   2.031 -15.440  10.762
   39   2HH2  ARG   5          2HH2      ARG   5   2.288 -14.801  12.352
   40    H    ILE   6           H        ILE   6   0.640  -8.457   4.860
   41    HA   ILE   6           HA       ILE   6   2.904  -6.580   4.608
   42    HB   ILE   6           HB       ILE   6   0.244  -6.327   3.200
   43   1HG1  ILE   6          2HG1      ILE   6   2.503  -6.882   1.468
   44   2HG1  ILE   6          1HG1      ILE   6   2.258  -8.190   2.621
   45   1HG2  ILE   6          1HG2      ILE   6   1.018  -4.434   2.244
   46   2HG2  ILE   6          2HG2      ILE   6   2.683  -5.011   2.185
   47   3HG2  ILE   6          3HG2      ILE   6   2.022  -4.377   3.692
   48   1HD1  ILE   6          1HD1      ILE   6   0.984  -7.945   0.238
   49   2HD1  ILE   6          2HD1      ILE   6  -0.195  -7.241   1.344
   50   3HD1  ILE   6          3HD1      ILE   6   0.392  -8.883   1.608
   51    H    LYS   7           H        LYS   7   2.912  -4.821   5.871
   52    HA   LYS   7           HA       LYS   7   0.624  -4.377   7.635
   53   1HB   LYS   7          2HB       LYS   7   3.296  -4.457   8.173
   54   2HB   LYS   7          1HB       LYS   7   3.040  -2.725   8.000
   55   1HG   LYS   7          2HG       LYS   7   1.669  -2.603   9.835
   56   2HG   LYS   7          1HG       LYS   7   1.187  -4.298   9.725
   57   1HD   LYS   7          2HD       LYS   7   3.387  -4.996  10.491
   58   2HD   LYS   7          1HD       LYS   7   3.923  -3.317  10.537
   59   1HE   LYS   7          2HE       LYS   7   1.828  -4.626  12.261
   60   2HE   LYS   7          1HE       LYS   7   3.389  -3.983  12.768
   61   1HZ   LYS   7          1HZ       LYS   7   0.907  -2.571  12.157
   62   2HZ   LYS   7          2HZ       LYS   7   2.351  -1.797  11.738
   63   3HZ   LYS   7          3HZ       LYS   7   2.068  -2.250  13.343
   64    H    PHE   8           H        PHE   8  -0.739  -2.732   7.376
   65    HA   PHE   8           HA       PHE   8   0.036  -0.547   5.552
   66   1HB   PHE   8          2HB       PHE   8  -2.658  -1.840   6.009
   67   2HB   PHE   8          1HB       PHE   8  -2.448  -0.331   5.127
   68    HD1  PHE   8           HD2      PHE   8  -0.960  -0.358   3.060
   69    HD2  PHE   8           HD1      PHE   8  -2.417  -3.892   4.932
   70    HE1  PHE   8           HE2      PHE   8  -0.539  -1.622   0.993
   71    HE2  PHE   8           HE1      PHE   8  -1.996  -5.163   2.868
   72    HZ   PHE   8           HZ       PHE   8  -1.056  -4.028   0.894
   73    H    GLU   9           H        GLU   9  -0.207   1.525   6.214
   74    HA   GLU   9           HA       GLU   9  -1.450   1.965   8.850
   75   1HB   GLU   9          2HB       GLU   9   1.234   2.532   7.961
   76   2HB   GLU   9          1HB       GLU   9   0.422   4.024   8.415
   77   1HG   GLU   9          2HG       GLU   9   0.012   3.244  10.610
   78   2HG   GLU   9          1HG       GLU   9   0.483   1.599  10.185
   79    H    HIS  10           H        HIS  10  -3.037   3.407   8.917
   80    HA   HIS  10           HA       HIS  10  -3.229   5.428   6.789
   81   1HB   HIS  10          2HB       HIS  10  -4.793   3.583   6.298
   82   2HB   HIS  10          1HB       HIS  10  -5.523   3.785   7.886
   83    HD1  HIS  10           HD1      HIS  10  -7.541   5.212   7.921
   84    HD2  HIS  10           HD2      HIS  10  -5.086   6.090   4.687
   85    HE1  HIS  10           HE1      HIS  10  -8.790   6.931   6.576
   86    HE2  HIS  10           HE2      HIS  10  -7.235   7.529   4.687
   87    H    ASN  11           H        ASN  11  -3.018   7.340   7.741
   88    HA   ASN  11           HA       ASN  11  -3.173   9.063   9.217
   89   1HB   ASN  11          2HB       ASN  11  -5.821   7.779   9.197
   90   2HB   ASN  11          1HB       ASN  11  -5.512   8.771  10.615
   91   1HD2  ASN  11          1HD2      ASN  11  -7.353   9.953   9.602
   92   2HD2  ASN  11          2HD2      ASN  11  -6.967  11.188   8.458
   93    H    GLY  12           H        GLY  12  -1.745   6.731  10.135
   94   1HA   GLY  12          2HA       GLY  12  -0.558   6.570  12.191
   95   2HA   GLY  12          1HA       GLY  12  -1.967   7.214  13.023
   96    H    GLU  13           H        GLU  13  -3.879   5.435  11.761
   97    HA   GLU  13           HA       GLU  13  -3.750   3.266  13.565
   98   1HB   GLU  13          2HB       GLU  13  -5.667   4.368  11.826
   99   2HB   GLU  13          1HB       GLU  13  -5.464   2.700  11.309
  100   1HG   GLU  13          2HG       GLU  13  -6.559   1.912  13.075
  101   2HG   GLU  13          1HG       GLU  13  -5.673   2.945  14.194
  102    H    ARG  14           H        ARG  14  -3.050   1.201  13.360
  103    HA   ARG  14           HA       ARG  14  -1.718   0.497  10.829
  104   1HB   ARG  14          2HB       ARG  14  -0.294  -1.015  12.226
  105   2HB   ARG  14          1HB       ARG  14  -0.084   0.697  12.560
  106   1HG   ARG  14          2HG       ARG  14  -2.062  -0.711  14.235
  107   2HG   ARG  14          1HG       ARG  14  -0.373  -1.174  14.461
  108   1HD   ARG  14          2HD       ARG  14  -0.193   1.543  14.382
  109   2HD   ARG  14          1HD       ARG  14  -1.762   1.319  15.153
  110    HE   ARG  14           HE       ARG  14  -0.055  -0.379  16.475
  111   1HH1  ARG  14          1HH1      ARG  14  -0.187   3.069  15.877
  112   2HH1  ARG  14          2HH1      ARG  14   0.633   3.478  17.346
  113   1HH2  ARG  14          1HH2      ARG  14   1.025   0.168  18.409
  114   2HH2  ARG  14          2HH2      ARG  14   1.321   1.833  18.783
  115    H    ARG  15           H        ARG  15  -1.961  -1.553   9.957
  116    HA   ARG  15           HA       ARG  15  -3.664  -3.494  11.288
  117   1HB   ARG  15          2HB       ARG  15  -4.752  -1.694   9.403
  118   2HB   ARG  15          1HB       ARG  15  -4.619  -3.244   8.584
  119   1HG   ARG  15          2HG       ARG  15  -5.963  -4.319  10.231
  120   2HG   ARG  15          1HG       ARG  15  -5.929  -2.891  11.267
  121   1HD   ARG  15          2HD       ARG  15  -7.420  -1.733   9.956
  122   2HD   ARG  15          1HD       ARG  15  -7.006  -2.636   8.500
  123    HE   ARG  15           HE       ARG  15  -8.608  -4.178   9.037
  124   1HH1  ARG  15          1HH1      ARG  15  -7.958  -2.218  11.868
  125   2HH1  ARG  15          2HH1      ARG  15  -9.267  -2.885  12.784
  126   1HH2  ARG  15          1HH2      ARG  15 -10.335  -5.056  10.253
  127   2HH2  ARG  15          2HH2      ARG  15 -10.616  -4.496  11.867
  128    H    ILE  16           H        ILE  16  -3.006  -5.510  10.884
  129    HA   ILE  16           HA       ILE  16  -1.015  -5.925   8.761
  130    HB   ILE  16           HB       ILE  16  -1.647  -7.791  11.052
  131   1HG1  ILE  16          2HG1      ILE  16   0.816  -6.660  11.596
  132   2HG1  ILE  16          1HG1      ILE  16  -0.122  -5.290  11.012
  133   1HG2  ILE  16          1HG2      ILE  16   0.280  -8.962  10.483
  134   2HG2  ILE  16          2HG2      ILE  16   0.923  -7.633   9.519
  135   3HG2  ILE  16          3HG2      ILE  16  -0.441  -8.576   8.921
  136   1HD1  ILE  16          1HD1      ILE  16  -0.442  -6.904  13.469
  137   2HD1  ILE  16          2HD1      ILE  16  -1.902  -6.278  12.706
  138   3HD1  ILE  16          3HD1      ILE  16  -0.629  -5.169  13.215
  139    H    ILE  17           H        ILE  17  -1.536  -7.066   6.993
  140    HA   ILE  17           HA       ILE  17  -3.801  -8.946   7.137
  141    HB   ILE  17           HB       ILE  17  -3.256  -7.150   4.771
  142   1HG1  ILE  17          2HG1      ILE  17  -5.653  -6.865   6.551
  143   2HG1  ILE  17          1HG1      ILE  17  -4.139  -6.095   7.010
  144   1HG2  ILE  17          1HG2      ILE  17  -5.565  -8.982   5.416
  145   2HG2  ILE  17          2HG2      ILE  17  -4.324  -9.254   4.192
  146   3HG2  ILE  17          3HG2      ILE  17  -5.461  -7.918   4.014
  147   1HD1  ILE  17          1HD1      ILE  17  -4.329  -5.263   4.463
  148   2HD1  ILE  17          2HD1      ILE  17  -4.986  -4.379   5.841
  149   3HD1  ILE  17          3HD1      ILE  17  -6.038  -5.416   4.875
  150    H    ALA  18           H        ALA  18  -3.479 -10.892   6.209
  151    HA   ALA  18           HA       ALA  18  -0.852 -11.425   5.055
  152   1HB   ALA  18          1HB       ALA  18  -1.099 -13.599   5.710
  153   2HB   ALA  18          2HB       ALA  18  -2.847 -13.591   5.474
  154   3HB   ALA  18          3HB       ALA  18  -2.145 -12.816   6.894
  155    H    PHE  19           H        PHE  19  -0.487 -12.110   3.005
  156    HA   PHE  19           HA       PHE  19  -2.801 -12.454   1.216
  157   1HB   PHE  19          2HB       PHE  19  -0.392 -10.687   0.844
  158   2HB   PHE  19          1HB       PHE  19  -1.274 -11.312  -0.544
  159    HD1  PHE  19           HD1      PHE  19  -1.696  -9.336   2.574
  160    HD2  PHE  19           HD2      PHE  19  -3.194 -10.239  -1.307
  161    HE1  PHE  19           HE1      PHE  19  -3.305  -7.486   2.768
  162    HE2  PHE  19           HE2      PHE  19  -4.804  -8.390  -1.119
  163    HZ   PHE  19           HZ       PHE  19  -4.862  -7.010   0.920
  164    H    SER  20           H        SER  20  -2.739 -14.428   0.353
  165    HA   SER  20           HA       SER  20  -0.350 -16.028   0.385
  166   1HB   SER  20          2HB       SER  20  -2.949 -16.688  -1.014
  167   2HB   SER  20          1HB       SER  20  -1.727 -17.812  -0.419
  168    HG   SER  20           HG       SER  20  -3.655 -17.519   0.929
  169    H    ARG  21           H        ARG  21   0.880 -16.737  -1.336
  170    HA   ARG  21           HA       ARG  21   0.696 -15.117  -3.765
  171   1HB   ARG  21          2HB       ARG  21   2.898 -16.931  -2.761
  172   2HB   ARG  21          1HB       ARG  21   2.974 -15.968  -4.231
  173   1HG   ARG  21          2HG       ARG  21   2.394 -14.030  -2.480
  174   2HG   ARG  21          1HG       ARG  21   3.235 -15.151  -1.408
  175   1HD   ARG  21          2HD       ARG  21   4.534 -14.689  -4.008
  176   2HD   ARG  21          1HD       ARG  21   4.461 -13.283  -2.948
  177    HE   ARG  21           HE       ARG  21   5.901 -14.336  -1.472
  178   1HH1  ARG  21          1HH1      ARG  21   4.981 -16.555  -4.027
  179   2HH1  ARG  21          2HH1      ARG  21   6.202 -17.714  -3.626
  180   1HH2  ARG  21          1HH2      ARG  21   7.504 -15.870  -0.949
  181   2HH2  ARG  21          2HH2      ARG  21   7.634 -17.327  -1.879
  182    HA   PRO  22           HA       PRO  22   1.964 -15.376  -5.798
  183   1HB   PRO  22          2HB       PRO  22   0.395 -15.572  -8.246
  184   2HB   PRO  22          1HB       PRO  22   2.137 -15.737  -8.028
  185   1HG   PRO  22          2HG       PRO  22   0.528 -17.821  -8.685
  186   2HG   PRO  22          1HG       PRO  22   2.018 -18.010  -7.744
  187   1HD   PRO  22          2HD       PRO  22  -0.824 -17.929  -6.799
  188   2HD   PRO  22          1HD       PRO  22   0.510 -18.978  -6.272
  189    H    VAL  23           H        VAL  23   1.393 -13.249  -5.760
  190    HA   VAL  23           HA       VAL  23  -1.477 -12.594  -5.838
  191    HB   VAL  23           HB       VAL  23  -0.719 -12.610  -3.498
  192   1HG1  VAL  23          1HG1      VAL  23   1.494 -11.045  -4.616
  193   2HG1  VAL  23          2HG1      VAL  23   1.435 -12.075  -3.187
  194   3HG1  VAL  23          3HG1      VAL  23   0.840 -10.418  -3.104
  195   1HG2  VAL  23          1HG2      VAL  23  -1.448 -10.335  -2.892
  196   2HG2  VAL  23          2HG2      VAL  23  -2.483 -11.069  -4.118
  197   3HG2  VAL  23          3HG2      VAL  23  -1.293  -9.852  -4.582
  198    H    LYS  24           H        LYS  24  -2.025 -10.558  -6.676
  199    HA   LYS  24           HA       LYS  24   0.162  -9.193  -8.104
  200   1HB   LYS  24          2HB       LYS  24  -1.733  -8.451  -9.681
  201   2HB   LYS  24          1HB       LYS  24  -1.161 -10.109  -9.798
  202   1HG   LYS  24          2HG       LYS  24  -3.457  -9.588  -7.998
  203   2HG   LYS  24          1HG       LYS  24  -3.741  -9.476  -9.735
  204   1HD   LYS  24          2HD       LYS  24  -2.509 -11.847  -8.325
  205   2HD   LYS  24          1HD       LYS  24  -4.197 -11.732  -8.833
  206   1HE   LYS  24          2HE       LYS  24  -2.963 -11.135 -11.152
  207   2HE   LYS  24          1HE       LYS  24  -1.752 -12.191 -10.427
  208   1HZ   LYS  24          1HZ       LYS  24  -3.675 -13.157 -11.879
  209   2HZ   LYS  24          2HZ       LYS  24  -4.553 -13.068 -10.436
  210   3HZ   LYS  24          3HZ       LYS  24  -3.135 -13.988 -10.508
  211    H    TYR  25           H        TYR  25   0.238  -6.974  -8.123
  212    HA   TYR  25           HA       TYR  25  -0.630  -5.593  -5.863
  213   1HB   TYR  25          2HB       TYR  25   1.255  -4.875  -7.302
  214   2HB   TYR  25          1HB       TYR  25   0.106  -4.418  -8.554
  215    HD1  TYR  25           HD2      TYR  25   1.463  -3.550  -5.257
  216    HD2  TYR  25           HD1      TYR  25  -1.225  -2.410  -8.351
  217    HE1  TYR  25           HE2      TYR  25   1.264  -1.317  -4.256
  218    HE2  TYR  25           HE1      TYR  25  -1.430  -0.174  -7.358
  219    HH   TYR  25           HH       TYR  25   0.389   1.251  -5.637
  220    H    GLU  26           H        GLU  26  -2.128  -5.893  -9.045
  221    HA   GLU  26           HA       GLU  26  -4.075  -3.900  -8.808
  222   1HB   GLU  26          2HB       GLU  26  -3.407  -5.466 -10.814
  223   2HB   GLU  26          1HB       GLU  26  -4.696  -6.485 -10.187
  224   1HG   GLU  26          2HG       GLU  26  -5.653  -3.812 -10.339
  225   2HG   GLU  26          1HG       GLU  26  -4.895  -4.234 -11.875
  226    H    ASP  27           H        ASP  27  -4.168  -7.326  -7.859
  227    HA   ASP  27           HA       ASP  27  -6.848  -7.266  -6.915
  228   1HB   ASP  27          2HB       ASP  27  -5.322  -9.305  -7.547
  229   2HB   ASP  27          1HB       ASP  27  -4.825  -9.219  -5.861
  230    H    VAL  28           H        VAL  28  -3.693  -6.985  -5.303
  231    HA   VAL  28           HA       VAL  28  -4.691  -6.834  -2.662
  232    HB   VAL  28           HB       VAL  28  -2.133  -5.590  -3.695
  233   1HG1  VAL  28          1HG1      VAL  28  -2.267  -6.725  -0.983
  234   2HG1  VAL  28          2HG1      VAL  28  -3.245  -5.281  -1.240
  235   3HG1  VAL  28          3HG1      VAL  28  -1.511  -5.238  -1.557
  236   1HG2  VAL  28          1HG2      VAL  28  -1.983  -8.188  -2.349
  237   2HG2  VAL  28          2HG2      VAL  28  -1.146  -7.603  -3.786
  238   3HG2  VAL  28          3HG2      VAL  28  -2.790  -8.227  -3.916
  239    H    GLU  29           H        GLU  29  -3.823  -4.319  -5.010
  240    HA   GLU  29           HA       GLU  29  -4.294  -2.081  -3.406
  241   1HB   GLU  29          2HB       GLU  29  -3.223  -2.230  -5.739
  242   2HB   GLU  29          1HB       GLU  29  -4.865  -2.150  -6.362
  243   1HG   GLU  29          2HG       GLU  29  -4.898  -0.046  -4.693
  244   2HG   GLU  29          1HG       GLU  29  -3.192  -0.063  -5.134
  245    H    HIS  30           H        HIS  30  -6.518  -3.927  -5.472
  246    HA   HIS  30           HA       HIS  30  -8.745  -2.256  -5.273
  247   1HB   HIS  30          2HB       HIS  30  -8.245  -4.582  -6.554
  248   2HB   HIS  30          1HB       HIS  30  -9.257  -5.176  -5.245
  249    HD1  HIS  30           HD1      HIS  30 -10.801  -2.159  -5.534
  250    HD2  HIS  30           HD2      HIS  30 -10.495  -5.333  -8.202
  251    HE1  HIS  30           HE1      HIS  30 -12.741  -1.902  -7.112
  252    HE2  HIS  30           HE2      HIS  30 -12.572  -3.869  -8.678
  253    H    LYS  31           H        LYS  31  -7.731  -4.945  -3.175
  254    HA   LYS  31           HA       LYS  31  -9.936  -4.711  -1.390
  255   1HB   LYS  31          2HB       LYS  31  -8.376  -6.726  -1.738
  256   2HB   LYS  31          1HB       LYS  31  -7.264  -5.891  -0.661
  257   1HG   LYS  31          2HG       LYS  31  -9.092  -5.829   1.046
  258   2HG   LYS  31          1HG       LYS  31 -10.041  -6.858  -0.028
  259   1HD   LYS  31          2HD       LYS  31  -8.256  -8.551   0.053
  260   2HD   LYS  31          1HD       LYS  31  -7.356  -7.529   1.176
  261   1HE   LYS  31          2HE       LYS  31  -8.409  -8.747   2.750
  262   2HE   LYS  31          1HE       LYS  31  -9.750  -7.649   2.427
  263   1HZ   LYS  31          1HZ       LYS  31 -10.904  -9.241   1.307
  264   2HZ   LYS  31          2HZ       LYS  31 -10.058 -10.242   2.376
  265   3HZ   LYS  31          3HZ       LYS  31  -9.522 -10.065   0.781
  266    H    VAL  32           H        VAL  32  -6.536  -3.630  -1.194
  267    HA   VAL  32           HA       VAL  32  -6.692  -2.462   1.346
  268    HB   VAL  32           HB       VAL  32  -4.946  -1.521  -0.937
  269   1HG1  VAL  32          1HG1      VAL  32  -3.425  -0.887   0.992
  270   2HG1  VAL  32          2HG1      VAL  32  -4.822  -1.123   2.042
  271   3HG1  VAL  32          3HG1      VAL  32  -4.869   0.103   0.777
  272   1HG2  VAL  32          1HG2      VAL  32  -4.989  -4.042   0.177
  273   2HG2  VAL  32          2HG2      VAL  32  -3.715  -3.222   1.079
  274   3HG2  VAL  32          3HG2      VAL  32  -3.635  -3.310  -0.680
  275    H    THR  33           H        THR  33  -7.365  -1.067  -1.853
  276    HA   THR  33           HA       THR  33  -7.794   1.572  -0.957
  277    HB   THR  33           HB       THR  33  -8.860   0.142  -3.403
  278    HG1  THR  33           HG1      THR  33  -7.050   0.762  -4.328
  279   1HG2  THR  33          1HG2      THR  33  -8.564   3.102  -3.246
  280   2HG2  THR  33          2HG2      THR  33 -10.043   2.342  -2.658
  281   3HG2  THR  33          3HG2      THR  33  -9.546   2.120  -4.335
  282    H    THR  34           H        THR  34  -9.999  -1.199  -1.303
  283    HA   THR  34           HA       THR  34 -12.334   0.320  -0.656
  284    HB   THR  34           HB       THR  34 -11.921  -2.672  -0.510
  285    HG1  THR  34           HG1      THR  34 -12.551  -2.732  -2.578
  286   1HG2  THR  34          1HG2      THR  34 -14.355  -2.810  -0.817
  287   2HG2  THR  34          2HG2      THR  34 -14.455  -1.058  -0.643
  288   3HG2  THR  34          3HG2      THR  34 -13.905  -2.047   0.709
  289    H    VAL  35           H        VAL  35 -10.166  -1.769   1.232
  290    HA   VAL  35           HA       VAL  35 -11.649  -1.729   3.618
  291    HB   VAL  35           HB       VAL  35  -8.646  -1.963   3.352
  292   1HG1  VAL  35          1HG1      VAL  35  -9.233  -3.433   5.501
  293   2HG1  VAL  35          2HG1      VAL  35 -10.534  -2.249   5.617
  294   3HG1  VAL  35          3HG1      VAL  35  -8.853  -1.714   5.598
  295   1HG2  VAL  35          1HG2      VAL  35 -10.558  -3.660   2.300
  296   2HG2  VAL  35          2HG2      VAL  35 -10.138  -4.413   3.838
  297   3HG2  VAL  35          3HG2      VAL  35  -8.880  -4.071   2.651
  298    H    PHE  36           H        PHE  36  -8.882   0.329   2.640
  299    HA   PHE  36           HA       PHE  36  -9.295   2.018   4.964
  300   1HB   PHE  36          2HB       PHE  36  -7.280   2.191   2.722
  301   2HB   PHE  36          1HB       PHE  36  -7.315   3.255   4.123
  302    HD1  PHE  36           HD1      PHE  36  -7.602   1.700   6.418
  303    HD2  PHE  36           HD2      PHE  36  -5.602   0.652   2.810
  304    HE1  PHE  36           HE1      PHE  36  -6.203   0.103   7.661
  305    HE2  PHE  36           HE2      PHE  36  -4.204  -0.947   4.047
  306    HZ   PHE  36           HZ       PHE  36  -4.504  -1.223   6.472
  307    H    GLY  37           H        GLY  37 -10.244   2.047   1.622
  308   1HA   GLY  37          2HA       GLY  37 -11.998   3.528   0.928
  309   2HA   GLY  37          1HA       GLY  37 -11.375   4.733   2.044
  310    H    GLN  38           H        GLN  38 -11.763   5.911  -0.149
  311    HA   GLN  38           HA       GLN  38  -9.137   6.187  -1.393
  312   1HB   GLN  38          2HB       GLN  38 -10.349   6.403  -3.663
  313   2HB   GLN  38          1HB       GLN  38 -10.041   4.795  -3.032
  314   1HG   GLN  38          2HG       GLN  38 -12.319   4.573  -2.319
  315   2HG   GLN  38          1HG       GLN  38 -12.659   6.250  -2.742
  316   1HE2  GLN  38          1HE2      GLN  38 -12.759   6.835  -4.947
  317   2HE2  GLN  38          2HE2      GLN  38 -13.033   5.653  -6.177
  318    HA   PRO  39           HA       PRO  39  -8.556   7.285  -3.307
  319   1HB   PRO  39          2HB       PRO  39  -7.035   9.405  -3.873
  320   2HB   PRO  39          1HB       PRO  39  -8.612   9.177  -4.640
  321   1HG   PRO  39          2HG       PRO  39  -7.847  10.973  -2.377
  322   2HG   PRO  39          1HG       PRO  39  -8.937  11.287  -3.738
  323   1HD   PRO  39          2HD       PRO  39  -9.740  10.550  -1.187
  324   2HD   PRO  39          1HD       PRO  39 -10.721  10.374  -2.653
  325    H    LEU  40           H        LEU  40  -6.713   6.295  -2.682
  326    HA   LEU  40           HA       LEU  40  -5.064   7.505  -0.579
  327   1HB   LEU  40          2HB       LEU  40  -6.046   4.648  -0.583
  328   2HB   LEU  40          1HB       LEU  40  -4.828   5.283   0.504
  329    HG   LEU  40           HG       LEU  40  -7.706   6.193   0.398
  330   1HD1  LEU  40          1HD1      LEU  40  -6.962   3.829   1.325
  331   2HD1  LEU  40          2HD1      LEU  40  -8.189   4.804   2.130
  332   3HD1  LEU  40          3HD1      LEU  40  -6.533   4.795   2.736
  333   1HD2  LEU  40          1HD2      LEU  40  -7.174   7.868   1.765
  334   2HD2  LEU  40          2HD2      LEU  40  -5.490   7.561   1.345
  335   3HD2  LEU  40          3HD2      LEU  40  -6.188   6.821   2.783
  336    H    ASP  41           H        ASP  41  -2.932   7.403  -1.012
  337    HA   ASP  41           HA       ASP  41  -2.080   5.716  -3.270
  338   1HB   ASP  41          2HB       ASP  41  -1.041   8.310  -2.156
  339   2HB   ASP  41          1HB       ASP  41  -0.010   7.283  -3.143
  340    H    LEU  42           H        LEU  42  -0.414   4.262  -3.063
  341    HA   LEU  42           HA       LEU  42   0.371   3.592  -0.333
  342   1HB   LEU  42          2HB       LEU  42   0.607   2.139  -2.961
  343   2HB   LEU  42          1HB       LEU  42   1.390   1.562  -1.503
  344    HG   LEU  42           HG       LEU  42  -1.583   2.029  -1.680
  345   1HD1  LEU  42          1HD1      LEU  42  -1.491   0.332  -3.179
  346   2HD1  LEU  42          2HD1      LEU  42  -1.411  -0.628  -1.703
  347   3HD1  LEU  42          3HD1      LEU  42   0.065  -0.256  -2.594
  348   1HD2  LEU  42          1HD2      LEU  42  -0.263   1.885   0.548
  349   2HD2  LEU  42          2HD2      LEU  42  -0.166   0.163   0.180
  350   3HD2  LEU  42          3HD2      LEU  42  -1.739   0.940   0.356
  351    H    HIS  43           H        HIS  43   2.101   4.647   0.425
  352    HA   HIS  43           HA       HIS  43   4.375   5.113  -1.384
  353   1HB   HIS  43          2HB       HIS  43   3.042   6.951   0.095
  354   2HB   HIS  43          1HB       HIS  43   4.313   6.499   1.227
  355    HD1  HIS  43           HD1      HIS  43   3.768   9.121  -0.853
  356    HD2  HIS  43           HD2      HIS  43   6.874   6.364  -0.707
  357    HE1  HIS  43           HE1      HIS  43   5.713  10.238  -1.991
  358    HE2  HIS  43           HE2      HIS  43   7.523   8.487  -2.032
  359    H    TYR  44           H        TYR  44   6.044   3.798  -1.143
  360    HA   TYR  44           HA       TYR  44   6.427   2.377   1.383
  361   1HB   TYR  44          2HB       TYR  44   6.420   0.918  -0.500
  362   2HB   TYR  44          1HB       TYR  44   7.493   1.967  -1.413
  363    HD1  TYR  44           HD2      TYR  44   9.903   2.130  -0.737
  364    HD2  TYR  44           HD1      TYR  44   7.275  -0.770   0.927
  365    HE1  TYR  44           HE2      TYR  44  11.842   0.815   0.015
  366    HE2  TYR  44           HE1      TYR  44   9.203  -2.094   1.684
  367    HH   TYR  44           HH       TYR  44  12.381  -1.503   0.625
  368    H    MET  45           H        MET  45   7.941   2.994   2.795
  369    HA   MET  45           HA       MET  45  10.120   4.749   1.848
  370   1HB   MET  45          2HB       MET  45   8.985   4.706   4.646
  371   2HB   MET  45          1HB       MET  45  10.102   5.876   3.960
  372   1HG   MET  45          2HG       MET  45   8.368   6.709   2.485
  373   2HG   MET  45          1HG       MET  45   7.247   5.491   3.088
  374   1HE   MET  45          1HE       MET  45   9.769   7.972   4.094
  375   2HE   MET  45          2HE       MET  45   9.473   8.090   5.830
  376   3HE   MET  45          3HE       MET  45   8.788   9.290   4.733
  377    H    ASN  46           H        ASN  46  12.127   3.977   2.076
  378    HA   ASN  46           HA       ASN  46  12.514   1.484   3.522
  379   1HB   ASN  46          2HB       ASN  46  13.530   2.326   1.175
  380   2HB   ASN  46          1HB       ASN  46  14.823   2.853   2.248
  381   1HD2  ASN  46          1HD2      ASN  46  16.191   1.325   1.203
  382   2HD2  ASN  46          2HD2      ASN  46  16.110  -0.351   1.616
  383    H    ASN  47           H        ASN  47  13.990   4.722   3.491
  384    HA   ASN  47           HA       ASN  47  14.141   4.941   6.294
  385   1HB   ASN  47          2HB       ASN  47  16.231   3.386   5.183
  386   2HB   ASN  47          1HB       ASN  47  16.934   4.944   5.605
  387   1HD2  ASN  47          1HD2      ASN  47  15.261   2.129   6.818
  388   2HD2  ASN  47          2HD2      ASN  47  15.661   2.369   8.481
  389    H    GLU  48           H        GLU  48  16.236   5.826   3.545
  390    HA   GLU  48           HA       GLU  48  15.837   8.658   4.246
  391   1HB   GLU  48          2HB       GLU  48  18.099   7.219   2.880
  392   2HB   GLU  48          1HB       GLU  48  17.917   8.964   2.776
  393   1HG   GLU  48          2HG       GLU  48  17.771   8.738   5.409
  394   2HG   GLU  48          1HG       GLU  48  18.683   7.266   5.081
  395    H    LEU  49           H        LEU  49  15.411   6.281   1.717
  396    HA   LEU  49           HA       LEU  49  14.535   8.407  -0.119
  397   1HB   LEU  49          2HB       LEU  49  15.948   5.851  -0.520
  398   2HB   LEU  49          1HB       LEU  49  14.680   6.189  -1.683
  399    HG   LEU  49           HG       LEU  49  16.560   8.412  -1.193
  400   1HD1  LEU  49          1HD1      LEU  49  18.165   6.645  -1.123
  401   2HD1  LEU  49          2HD1      LEU  49  18.249   7.388  -2.721
  402   3HD1  LEU  49          3HD1      LEU  49  17.426   5.845  -2.507
  403   1HD2  LEU  49          1HD2      LEU  49  14.626   8.113  -2.938
  404   2HD2  LEU  49          2HD2      LEU  49  15.864   7.248  -3.850
  405   3HD2  LEU  49          3HD2      LEU  49  16.122   8.931  -3.388
  406    H    SER  50           H        SER  50  12.587   8.170  -1.249
  407    HA   SER  50           HA       SER  50  10.694   6.266  -0.033
  408   1HB   SER  50          2HB       SER  50   9.852   8.802  -1.419
  409   2HB   SER  50          1HB       SER  50   8.974   7.853  -0.220
  410    HG   SER  50           HG       SER  50  11.002   9.737   0.131
  411    H    ILE  51           H        ILE  51   9.668   4.853  -1.302
  412    HA   ILE  51           HA       ILE  51   9.858   5.210  -4.227
  413    HB   ILE  51           HB       ILE  51   9.829   2.549  -2.805
  414   1HG1  ILE  51          2HG1      ILE  51  12.211   3.986  -4.002
  415   2HG1  ILE  51          1HG1      ILE  51  11.891   3.842  -2.277
  416   1HG2  ILE  51          1HG2      ILE  51   9.875   3.420  -5.627
  417   2HG2  ILE  51          2HG2      ILE  51   9.177   1.977  -4.894
  418   3HG2  ILE  51          3HG2      ILE  51  10.911   2.056  -5.205
  419   1HD1  ILE  51          1HD1      ILE  51  13.486   2.198  -2.779
  420   2HD1  ILE  51          2HD1      ILE  51  12.616   1.678  -4.222
  421   3HD1  ILE  51          3HD1      ILE  51  11.955   1.334  -2.623
  422    H    LEU  52           H        LEU  52   8.004   5.019  -5.376
  423    HA   LEU  52           HA       LEU  52   5.556   4.369  -3.878
  424   1HB   LEU  52          2HB       LEU  52   5.871   5.886  -6.470
  425   2HB   LEU  52          1HB       LEU  52   4.362   5.610  -5.622
  426    HG   LEU  52           HG       LEU  52   5.722   6.835  -3.659
  427   1HD1  LEU  52          1HD1      LEU  52   6.865   7.915  -6.231
  428   2HD1  LEU  52          2HD1      LEU  52   7.750   7.172  -4.898
  429   3HD1  LEU  52          3HD1      LEU  52   6.963   8.734  -4.671
  430   1HD2  LEU  52          1HD2      LEU  52   4.645   8.959  -4.492
  431   2HD2  LEU  52          2HD2      LEU  52   3.574   7.566  -4.336
  432   3HD2  LEU  52          3HD2      LEU  52   4.161   8.053  -5.927
  433    H    LEU  53           H        LEU  53   4.522   2.535  -4.318
  434    HA   LEU  53           HA       LEU  53   5.363   0.951  -6.618
  435   1HB   LEU  53          2HB       LEU  53   3.369   0.081  -4.544
  436   2HB   LEU  53          1HB       LEU  53   4.394  -0.915  -5.560
  437    HG   LEU  53           HG       LEU  53   6.290   0.393  -4.157
  438   1HD1  LEU  53          1HD1      LEU  53   5.121   0.002  -1.730
  439   2HD1  LEU  53          2HD1      LEU  53   3.792   0.695  -2.660
  440   3HD1  LEU  53          3HD1      LEU  53   5.317   1.567  -2.519
  441   1HD2  LEU  53          1HD2      LEU  53   6.306  -1.623  -2.664
  442   2HD2  LEU  53          2HD2      LEU  53   6.267  -1.976  -4.391
  443   3HD2  LEU  53          3HD2      LEU  53   4.797  -2.119  -3.429
  444    H    LYS  54           H        LYS  54   4.368   1.937  -8.363
  445    HA   LYS  54           HA       LYS  54   1.420   1.966  -8.330
  446   1HB   LYS  54          2HB       LYS  54   3.424   3.636  -9.827
  447   2HB   LYS  54          1HB       LYS  54   1.761   3.502 -10.379
  448   1HG   LYS  54          2HG       LYS  54   1.208   4.179  -7.907
  449   2HG   LYS  54          1HG       LYS  54   2.851   4.822  -7.943
  450   1HD   LYS  54          2HD       LYS  54   2.289   6.167  -9.905
  451   2HD   LYS  54          1HD       LYS  54   0.652   5.510  -9.894
  452   1HE   LYS  54          2HE       LYS  54   1.889   7.107  -7.652
  453   2HE   LYS  54          1HE       LYS  54   0.813   7.767  -8.882
  454   1HZ   LYS  54          1HZ       LYS  54   0.196   6.063  -6.594
  455   2HZ   LYS  54          2HZ       LYS  54  -0.694   5.788  -8.005
  456   3HZ   LYS  54          3HZ       LYS  54  -0.706   7.317  -7.282
  457    H    ASN  55           H        ASN  55   3.087  -0.391  -8.831
  458    HA   ASN  55           HA       ASN  55   1.718  -1.477 -11.020
  459   1HB   ASN  55          2HB       ASN  55   3.766  -1.869 -12.505
  460   2HB   ASN  55          1HB       ASN  55   3.063  -0.257 -12.534
  461   1HD2  ASN  55          1HD2      ASN  55   5.889  -1.908 -12.423
  462   2HD2  ASN  55          2HD2      ASN  55   6.908  -0.703 -11.720
  463    H    GLN  56           H        GLN  56   2.598  -3.690 -11.628
  464    HA   GLN  56           HA       GLN  56   3.009  -5.203  -9.292
  465   1HB   GLN  56          2HB       GLN  56   1.923  -6.103 -11.308
  466   2HB   GLN  56          1HB       GLN  56   3.445  -6.003 -12.178
  467   1HG   GLN  56          2HG       GLN  56   3.279  -8.240 -11.592
  468   2HG   GLN  56          1HG       GLN  56   4.370  -7.568 -10.383
  469   1HE2  GLN  56          1HE2      GLN  56   3.487  -9.774  -9.535
  470   2HE2  GLN  56          2HE2      GLN  56   2.149  -9.644  -8.451
  471    H    ASP  57           H        ASP  57   5.255  -4.068 -11.782
  472    HA   ASP  57           HA       ASP  57   7.506  -5.544 -11.076
  473   1HB   ASP  57          2HB       ASP  57   7.007  -3.684 -12.973
  474   2HB   ASP  57          1HB       ASP  57   7.993  -2.731 -11.867
  475    H    ASP  58           H        ASP  58   6.385  -2.420  -9.789
  476    HA   ASP  58           HA       ASP  58   8.589  -1.982  -8.077
  477   1HB   ASP  58          2HB       ASP  58   5.900  -0.815  -8.434
  478   2HB   ASP  58          1HB       ASP  58   6.564  -0.665  -6.812
  479    H    LEU  59           H        LEU  59   5.406  -3.451  -7.495
  480    HA   LEU  59           HA       LEU  59   5.744  -3.938  -4.749
  481   1HB   LEU  59          2HB       LEU  59   3.581  -4.069  -5.955
  482   2HB   LEU  59          1HB       LEU  59   4.127  -5.543  -6.730
  483    HG   LEU  59           HG       LEU  59   4.338  -6.556  -4.424
  484   1HD1  LEU  59          1HD1      LEU  59   3.702  -5.471  -2.549
  485   2HD1  LEU  59          2HD1      LEU  59   2.447  -4.547  -3.374
  486   3HD1  LEU  59          3HD1      LEU  59   4.132  -4.047  -3.495
  487   1HD2  LEU  59          1HD2      LEU  59   2.491  -7.127  -5.856
  488   2HD2  LEU  59          2HD2      LEU  59   1.633  -5.655  -5.403
  489   3HD2  LEU  59          3HD2      LEU  59   1.897  -6.923  -4.208
  490    H    ASP  60           H        ASP  60   6.556  -5.880  -7.600
  491    HA   ASP  60           HA       ASP  60   7.340  -8.222  -6.259
  492   1HB   ASP  60          2HB       ASP  60   6.992  -7.810  -8.795
  493   2HB   ASP  60          1HB       ASP  60   8.670  -7.278  -8.789
  494    H    LYS  61           H        LYS  61   9.162  -5.329  -7.192
  495    HA   LYS  61           HA       LYS  61  11.697  -6.242  -6.335
  496   1HB   LYS  61          2HB       LYS  61  10.572  -3.472  -6.748
  497   2HB   LYS  61          1HB       LYS  61  12.243  -3.759  -6.286
  498   1HG   LYS  61          2HG       LYS  61  12.618  -5.020  -8.324
  499   2HG   LYS  61          1HG       LYS  61  10.928  -4.811  -8.783
  500   1HD   LYS  61          2HD       LYS  61  11.366  -2.828  -9.687
  501   2HD   LYS  61          1HD       LYS  61  12.098  -2.260  -8.183
  502   1HE   LYS  61          2HE       LYS  61  13.725  -4.118  -9.799
  503   2HE   LYS  61          1HE       LYS  61  13.448  -2.525 -10.503
  504   1HZ   LYS  61          1HZ       LYS  61  14.626  -3.083  -7.831
  505   2HZ   LYS  61          2HZ       LYS  61  14.301  -1.539  -8.441
  506   3HZ   LYS  61          3HZ       LYS  61  15.454  -2.518  -9.194
  507    H    ALA  62           H        ALA  62   9.095  -4.500  -4.686
  508    HA   ALA  62           HA       ALA  62  10.500  -3.862  -2.330
  509   1HB   ALA  62          1HB       ALA  62   8.554  -2.692  -2.391
  510   2HB   ALA  62          2HB       ALA  62   8.022  -4.035  -1.379
  511   3HB   ALA  62          3HB       ALA  62   7.642  -4.025  -3.100
  512    H    ILE  63           H        ILE  63   8.615  -6.728  -3.246
  513    HA   ILE  63           HA       ILE  63   8.739  -8.002  -0.723
  514    HB   ILE  63           HB       ILE  63   8.518  -9.348  -3.424
  515   1HG1  ILE  63          2HG1      ILE  63   6.180  -8.763  -1.640
  516   2HG1  ILE  63          1HG1      ILE  63   6.795  -7.494  -2.691
  517   1HG2  ILE  63          1HG2      ILE  63   8.035 -10.260  -0.605
  518   2HG2  ILE  63          2HG2      ILE  63   9.003 -11.022  -1.867
  519   3HG2  ILE  63          3HG2      ILE  63   7.242 -11.044  -1.972
  520   1HD1  ILE  63          1HD1      ILE  63   4.948  -9.432  -3.349
  521   2HD1  ILE  63          2HD1      ILE  63   6.439  -9.984  -4.114
  522   3HD1  ILE  63          3HD1      ILE  63   5.809  -8.375  -4.468
  523    H    ASP  64           H        ASP  64  10.806  -8.197  -3.607
  524    HA   ASP  64           HA       ASP  64  12.517 -10.230  -2.806
  525   1HB   ASP  64          2HB       ASP  64  12.716  -7.933  -4.677
  526   2HB   ASP  64          1HB       ASP  64  14.234  -8.672  -4.183
  527    H    ILE  65           H        ILE  65  12.746  -6.743  -2.132
  528    HA   ILE  65           HA       ILE  65  15.196  -6.912  -0.709
  529    HB   ILE  65           HB       ILE  65  13.070  -4.781  -0.431
  530   1HG1  ILE  65          2HG1      ILE  65  15.500  -4.680  -2.220
  531   2HG1  ILE  65          1HG1      ILE  65  13.937  -5.250  -2.795
  532   1HG2  ILE  65          1HG2      ILE  65  15.103  -3.378   0.142
  533   2HG2  ILE  65          2HG2      ILE  65  15.983  -4.896   0.306
  534   3HG2  ILE  65          3HG2      ILE  65  14.603  -4.562   1.350
  535   1HD1  ILE  65          1HD1      ILE  65  13.323  -2.852  -1.607
  536   2HD1  ILE  65          2HD1      ILE  65  13.542  -3.134  -3.334
  537   3HD1  ILE  65          3HD1      ILE  65  14.889  -2.548  -2.357
  538    H    LEU  66           H        LEU  66  11.797  -6.823   0.360
  539    HA   LEU  66           HA       LEU  66  12.343  -6.854   3.137
  540   1HB   LEU  66          2HB       LEU  66  10.198  -6.140   2.378
  541   2HB   LEU  66          1HB       LEU  66   9.930  -7.635   1.511
  542    HG   LEU  66           HG       LEU  66   8.605  -7.311   3.630
  543   1HD1  LEU  66          1HD1      LEU  66   9.423  -9.555   2.446
  544   2HD1  LEU  66          2HD1      LEU  66   8.411  -9.535   3.889
  545   3HD1  LEU  66          3HD1      LEU  66  10.149  -9.787   4.036
  546   1HD2  LEU  66          1HD2      LEU  66  10.172  -6.367   5.118
  547   2HD2  LEU  66          2HD2      LEU  66  11.329  -7.668   4.845
  548   3HD2  LEU  66          3HD2      LEU  66   9.837  -7.986   5.725
  549    H    ASP  67           H        ASP  67  11.512  -9.464   0.868
  550    HA   ASP  67           HA       ASP  67  11.538 -11.576   2.709
  551   1HB   ASP  67          2HB       ASP  67  10.818 -11.469   0.172
  552   2HB   ASP  67          1HB       ASP  67  12.465 -12.028  -0.100
  553    H    ARG  68           H        ARG  68  14.154 -10.188   0.756
  554    HA   ARG  68           HA       ARG  68  16.101 -12.104   1.603
  555   1HB   ARG  68          2HB       ARG  68  16.065 -10.566  -0.509
  556   2HB   ARG  68          1HB       ARG  68  16.837  -9.399   0.555
  557   1HG   ARG  68          2HG       ARG  68  18.127 -11.952   0.795
  558   2HG   ARG  68          1HG       ARG  68  18.049 -11.461  -0.898
  559   1HD   ARG  68          2HD       ARG  68  19.024  -9.643   1.295
  560   2HD   ARG  68          1HD       ARG  68  20.093 -10.714   0.393
  561    HE   ARG  68           HE       ARG  68  19.693  -9.437  -1.555
  562   1HH1  ARG  68          1HH1      ARG  68  18.159  -8.058   1.288
  563   2HH1  ARG  68          2HH1      ARG  68  17.952  -6.500   0.565
  564   1HH2  ARG  68          1HH2      ARG  68  19.413  -7.379  -2.489
  565   2HH2  ARG  68          2HH2      ARG  68  18.661  -6.115  -1.575
  566    H    SER  69           H        SER  69  15.048  -8.968   2.781
  567    HA   SER  69           HA       SER  69  17.276  -8.676   4.594
  568   1HB   SER  69          2HB       SER  69  16.212  -6.642   5.324
  569   2HB   SER  69          1HB       SER  69  16.057  -6.722   3.572
  570    HG   SER  69           HG       SER  69  13.927  -7.915   4.561
  571    H    SER  70           H        SER  70  17.441  -9.928   6.333
  572    HA   SER  70           HA       SER  70  15.224 -11.302   7.489
  573   1HB   SER  70          2HB       SER  70  18.092 -10.957   8.372
  574   2HB   SER  70          1HB       SER  70  16.923 -11.918   9.274
  575    HG   SER  70           HG       SER  70  18.218 -13.118   7.740
  576    H    SER  71           H        SER  71  16.865  -8.287   8.184
  577    HA   SER  71           HA       SER  71  16.030  -7.871  10.820
  578   1HB   SER  71          2HB       SER  71  16.124  -5.343   9.953
  579   2HB   SER  71          1HB       SER  71  17.582  -6.296  10.227
  580    HG   SER  71           HG       SER  71  16.424  -5.452   7.846
  581    H    MET  72           H        MET  72  14.321  -7.374   7.778
  582    HA   MET  72           HA       MET  72  11.980  -6.420   9.291
  583   1HB   MET  72          2HB       MET  72  13.134  -5.111   7.285
  584   2HB   MET  72          1HB       MET  72  12.119  -6.175   6.324
  585   1HG   MET  72          2HG       MET  72  10.173  -5.223   7.066
  586   2HG   MET  72          1HG       MET  72  10.893  -4.666   8.575
  587   1HE   MET  72          1HE       MET  72  13.090  -2.844   8.329
  588   2HE   MET  72          2HE       MET  72  11.552  -2.298   8.998
  589   3HE   MET  72          3HE       MET  72  12.403  -1.302   7.818
  590    H    LYS  73           H        LYS  73  10.020  -7.446   9.085
  591    HA   LYS  73           HA       LYS  73  10.019  -9.944   7.522
  592   1HB   LYS  73          2HB       LYS  73   9.152  -9.342  10.280
  593   2HB   LYS  73          1HB       LYS  73   8.055 -10.358   9.351
  594   1HG   LYS  73          2HG       LYS  73  10.014 -11.836   8.833
  595   2HG   LYS  73          1HG       LYS  73  10.946 -10.887   9.992
  596   1HD   LYS  73          2HD       LYS  73   9.577 -11.566  11.795
  597   2HD   LYS  73          1HD       LYS  73   8.340 -12.206  10.711
  598   1HE   LYS  73          2HE       LYS  73  10.512 -13.651   9.948
  599   2HE   LYS  73          1HE       LYS  73  10.842 -13.424  11.665
  600   1HZ   LYS  73          1HZ       LYS  73   8.882 -14.516  12.256
  601   2HZ   LYS  73          2HZ       LYS  73   9.501 -15.454  10.993
  602   3HZ   LYS  73          3HZ       LYS  73   8.216 -14.393  10.705
  603    H    SER  74           H        SER  74   7.976  -7.265   8.672
  604    HA   SER  74           HA       SER  74   5.974  -7.950   6.639
  605   1HB   SER  74          2HB       SER  74   5.841  -6.040   8.987
  606   2HB   SER  74          1HB       SER  74   4.532  -6.302   7.837
  607    HG   SER  74           HG       SER  74   5.688  -8.257   9.546
  608    H    LEU  75           H        LEU  75   4.897  -5.934   5.615
  609    HA   LEU  75           HA       LEU  75   7.039  -4.341   4.436
  610   1HB   LEU  75          2HB       LEU  75   4.478  -5.345   3.549
  611   2HB   LEU  75          1HB       LEU  75   4.578  -3.617   3.281
  612    HG   LEU  75           HG       LEU  75   5.277  -4.856   1.302
  613   1HD1  LEU  75          1HD1      LEU  75   7.402  -3.753   0.908
  614   2HD1  LEU  75          2HD1      LEU  75   7.604  -3.481   2.637
  615   3HD1  LEU  75          3HD1      LEU  75   6.299  -2.677   1.766
  616   1HD2  LEU  75          1HD2      LEU  75   7.737  -5.839   2.647
  617   2HD2  LEU  75          2HD2      LEU  75   6.872  -6.485   1.252
  618   3HD2  LEU  75          3HD2      LEU  75   6.242  -6.745   2.879
  619    H    ARG  76           H        ARG  76   7.488  -2.357   5.149
  620    HA   ARG  76           HA       ARG  76   5.566  -0.982   6.861
  621   1HB   ARG  76          2HB       ARG  76   8.491  -0.579   6.275
  622   2HB   ARG  76          1HB       ARG  76   7.550   0.657   7.099
  623   1HG   ARG  76          2HG       ARG  76   7.799  -2.185   8.059
  624   2HG   ARG  76          1HG       ARG  76   8.828  -0.859   8.603
  625   1HD   ARG  76          2HD       ARG  76   7.227   0.011   9.917
  626   2HD   ARG  76          1HD       ARG  76   5.948  -0.311   8.748
  627    HE   ARG  76           HE       ARG  76   5.515  -2.301   9.800
  628   1HH1  ARG  76          1HH1      ARG  76   8.573  -1.046  10.966
  629   2HH1  ARG  76          2HH1      ARG  76   8.707  -2.213  12.240
  630   1HH2  ARG  76          1HH2      ARG  76   5.705  -3.842  11.476
  631   2HH2  ARG  76          2HH2      ARG  76   7.080  -3.800  12.529
  632    H    ILE  77           H        ILE  77   4.138  -0.638   4.975
  633    HA   ILE  77           HA       ILE  77   4.996   1.638   3.310
  634    HB   ILE  77           HB       ILE  77   2.693  -0.234   2.749
  635   1HG1  ILE  77          2HG1      ILE  77   5.417  -0.264   1.438
  636   2HG1  ILE  77          1HG1      ILE  77   4.952  -1.364   2.730
  637   1HG2  ILE  77          1HG2      ILE  77   4.113   1.743   0.967
  638   2HG2  ILE  77          2HG2      ILE  77   2.539   1.993   1.723
  639   3HG2  ILE  77          3HG2      ILE  77   2.747   0.722   0.520
  640   1HD1  ILE  77          1HD1      ILE  77   4.512  -1.610  -0.056
  641   2HD1  ILE  77          2HD1      ILE  77   2.945  -1.480   0.741
  642   3HD1  ILE  77          3HD1      ILE  77   4.082  -2.734   1.234
  643    H    LEU  78           H        LEU  78   4.082   3.552   3.696
  644    HA   LEU  78           HA       LEU  78   1.687   3.655   5.393
  645   1HB   LEU  78          2HB       LEU  78   3.686   4.872   6.173
  646   2HB   LEU  78          1HB       LEU  78   3.668   5.828   4.704
  647    HG   LEU  78           HG       LEU  78   1.184   6.353   5.585
  648   1HD1  LEU  78          1HD1      LEU  78   0.848   6.161   7.794
  649   2HD1  LEU  78          2HD1      LEU  78   2.524   6.540   8.190
  650   3HD1  LEU  78          3HD1      LEU  78   2.084   4.909   7.686
  651   1HD2  LEU  78          1HD2      LEU  78   3.417   7.778   5.158
  652   2HD2  LEU  78          2HD2      LEU  78   3.279   7.957   6.908
  653   3HD2  LEU  78          3HD2      LEU  78   1.951   8.459   5.862
  654    H    LEU  79           H        LEU  79  -0.214   4.038   4.445
  655    HA   LEU  79           HA       LEU  79  -0.221   5.401   1.837
  656   1HB   LEU  79          2HB       LEU  79  -2.390   4.370   1.424
  657   2HB   LEU  79          1HB       LEU  79  -1.162   3.166   1.750
  658    HG   LEU  79           HG       LEU  79  -2.282   3.590   4.239
  659   1HD1  LEU  79          1HD1      LEU  79  -4.076   4.922   3.231
  660   2HD1  LEU  79          2HD1      LEU  79  -4.684   3.424   3.935
  661   3HD1  LEU  79          3HD1      LEU  79  -4.490   3.562   2.188
  662   1HD2  LEU  79          1HD2      LEU  79  -1.705   1.489   2.699
  663   2HD2  LEU  79          2HD2      LEU  79  -3.462   1.477   2.539
  664   3HD2  LEU  79          3HD2      LEU  79  -2.720   1.370   4.135
  665    H    LEU  80           H        LEU  80  -1.025   7.378   1.687
  666    HA   LEU  80           HA       LEU  80  -2.755   8.342   3.871
  667   1HB   LEU  80          2HB       LEU  80  -1.874  10.649   3.154
  668   2HB   LEU  80          1HB       LEU  80  -0.839   9.617   4.118
  669    HG   LEU  80           HG       LEU  80   0.349   8.949   2.021
  670   1HD1  LEU  80          1HD1      LEU  80   0.019  10.671   0.125
  671   2HD1  LEU  80          2HD1      LEU  80  -1.567  10.931   0.854
  672   3HD1  LEU  80          3HD1      LEU  80  -1.117   9.330   0.265
  673   1HD2  LEU  80          1HD2      LEU  80   0.313  11.674   3.178
  674   2HD2  LEU  80          2HD2      LEU  80   1.222  11.449   1.684
  675   3HD2  LEU  80          3HD2      LEU  80   1.614  10.487   3.108
  676    H    SER  81           H        SER  81  -4.228  10.118   3.271
  677    HA   SER  81           HA       SER  81  -5.567   9.466   0.779
  678   1HB   SER  81          2HB       SER  81  -6.943   9.635   2.775
  679   2HB   SER  81          1HB       SER  81  -6.363  11.271   3.076
  680    HG   SER  81           HG       SER  81  -8.040  11.826   1.938
  681    H    GLN  82           H        GLN  82  -5.774  10.782  -0.958
  682    HA   GLN  82           HA       GLN  82  -4.049  13.104  -1.047
  683   1HB   GLN  82          2HB       GLN  82  -4.206  11.284  -2.861
  684   2HB   GLN  82          1HB       GLN  82  -5.697  12.080  -3.344
  685   1HG   GLN  82          2HG       GLN  82  -3.939  12.875  -4.736
  686   2HG   GLN  82          1HG       GLN  82  -4.405  14.181  -3.648
  687   1HE2  GLN  82          1HE2      GLN  82  -3.004  14.758  -1.950
  688   2HE2  GLN  82          2HE2      GLN  82  -1.328  14.336  -1.984
  689    H    ASP  83           H        ASP  83  -6.983  12.761   0.082
  690    HA   ASP  83           HA       ASP  83  -8.331  14.950  -1.244
  691   1HB   ASP  83          2HB       ASP  83  -9.292  12.740  -0.044
  692   2HB   ASP  83          1HB       ASP  83  -9.384  13.857   1.313
  693    H    ARG  84           H        ARG  84  -9.501  16.490   0.486
  694    HA   ARG  84           HA       ARG  84  -7.365  17.597   2.191
  695   1HB   ARG  84          2HB       ARG  84  -8.565  19.809   1.832
  696   2HB   ARG  84          1HB       ARG  84  -7.711  19.151   0.443
  697   1HG   ARG  84          2HG       ARG  84  -9.656  18.639  -0.683
  698   2HG   ARG  84          1HG       ARG  84 -10.616  18.574   0.795
  699   1HD   ARG  84          2HD       ARG  84  -9.825  21.153   0.843
  700   2HD   ARG  84          1HD       ARG  84  -9.887  20.876  -0.898
  701    HE   ARG  84           HE       ARG  84 -12.248  19.878  -0.020
  702   1HH1  ARG  84          1HH1      ARG  84 -10.658  22.974   0.383
  703   2HH1  ARG  84          2HH1      ARG  84 -12.143  23.853   0.536
  704   1HH2  ARG  84          1HH2      ARG  84 -14.194  21.040   0.181
  705   2HH2  ARG  84          2HH2      ARG  84 -14.151  22.754   0.422
  706    H    ASN  85           H        ASN  85  -9.285  15.620   3.058
  707    HA   ASN  85           HA       ASN  85 -11.115  17.136   4.767
  708   1HB   ASN  85          2HB       ASN  85 -11.595  14.910   3.335
  709   2HB   ASN  85          1HB       ASN  85 -11.085  14.164   4.847
  710   1HD2  ASN  85          1HD2      ASN  85 -12.430  14.203   6.579
  711   2HD2  ASN  85          2HD2      ASN  85 -14.018  14.884   6.553
  712    H    LEU  86           H        LEU  86  -9.601  17.971   6.253
  713    HA   LEU  86           HA       LEU  86  -8.915  16.125   8.376
  714   1HB   LEU  86          2HB       LEU  86  -6.989  16.227   6.657
  715   2HB   LEU  86          1HB       LEU  86  -6.699  17.837   7.283
  716    HG   LEU  86           HG       LEU  86  -6.863  15.683   9.305
  717   1HD1  LEU  86          1HD1      LEU  86  -5.636  14.503   7.604
  718   2HD1  LEU  86          2HD1      LEU  86  -4.523  15.001   8.878
  719   3HD1  LEU  86          3HD1      LEU  86  -4.575  15.889   7.355
  720   1HD2  LEU  86          1HD2      LEU  86  -4.652  17.032   9.880
  721   2HD2  LEU  86          2HD2      LEU  86  -6.253  17.643  10.296
  722   3HD2  LEU  86          3HD2      LEU  86  -5.426  18.243   8.859
  723    H    GLU  87           H        GLU  87 -10.354  17.315   9.632
  724    HA   GLU  87           HA       GLU  87  -9.282  19.845  10.628
  725   1HB   GLU  87          2HB       GLU  87 -12.159  19.494   9.756
  726   2HB   GLU  87          1HB       GLU  87 -11.510  20.902  10.586
  727   1HG   GLU  87          2HG       GLU  87  -9.934  21.181   8.643
  728   2HG   GLU  87          1HG       GLU  87 -10.876  19.944   7.811
  729    H    HIS  88           H        HIS  88  -8.718  18.826  12.534
  730    HA   HIS  88           HA       HIS  88 -10.981  18.005  14.236
  731   1HB   HIS  88          2HB       HIS  88  -8.218  16.794  14.425
  732   2HB   HIS  88          1HB       HIS  88  -9.685  16.265  15.240
  733    HD1  HIS  88           HD1      HIS  88 -11.524  16.274  12.673
  734    HD2  HIS  88           HD2      HIS  88  -7.774  14.505  12.973
  735    HE1  HIS  88           HE1      HIS  88 -11.484  14.479  10.914
  736    HE2  HIS  88           HE2      HIS  88  -9.244  13.358  11.180
  737    H    HIS  89           H        HIS  89  -7.603  19.130  14.281
  738    HA   HIS  89           HA       HIS  89  -8.124  21.251  16.071
  739   1HB   HIS  89          2HB       HIS  89  -6.681  20.338  17.977
  740   2HB   HIS  89          1HB       HIS  89  -8.327  19.731  17.857
  741    HD1  HIS  89           HD1      HIS  89  -4.818  18.653  17.890
  742    HD2  HIS  89           HD2      HIS  89  -8.500  17.030  16.856
  743    HE1  HIS  89           HE1      HIS  89  -4.448  16.167  17.767
  744    HE2  HIS  89           HE2      HIS  89  -6.679  15.210  17.093
  745    H    HIS  90           H        HIS  90  -5.721  19.005  14.767
  746    HA   HIS  90           HA       HIS  90  -3.385  20.411  15.191
  747   1HB   HIS  90          2HB       HIS  90  -4.292  18.569  13.000
  748   2HB   HIS  90          1HB       HIS  90  -2.729  19.366  12.879
  749    HD1  HIS  90           HD1      HIS  90  -2.062  16.676  12.957
  750    HD2  HIS  90           HD2      HIS  90  -3.273  18.478  16.500
  751    HE1  HIS  90           HE1      HIS  90  -1.228  15.174  14.794
  752    HE2  HIS  90           HE2      HIS  90  -2.077  16.224  16.922
  753    H    HIS  91           H        HIS  91  -3.350  22.587  14.941
  754    HA   HIS  91           HA       HIS  91  -3.346  23.633  12.249
  755   1HB   HIS  91          2HB       HIS  91  -5.760  23.748  13.456
  756   2HB   HIS  91          1HB       HIS  91  -5.057  25.240  14.064
  757    HD1  HIS  91           HD1      HIS  91  -6.444  23.671  11.001
  758    HD2  HIS  91           HD2      HIS  91  -4.529  27.200  12.078
  759    HE1  HIS  91           HE1      HIS  91  -6.797  25.244   9.072
  760    HE2  HIS  91           HE2      HIS  91  -5.678  27.391   9.768
  761    H    HIS  92           H        HIS  92  -3.524  24.771  15.641
  762    HA   HIS  92           HA       HIS  92  -2.183  26.130  16.875
  763   1HB   HIS  92          2HB       HIS  92  -0.388  24.634  15.162
  764   2HB   HIS  92          1HB       HIS  92   0.266  26.231  15.509
  765    HD1  HIS  92           HD1      HIS  92   0.640  23.021  16.713
  766    HD2  HIS  92           HD2      HIS  92  -0.243  26.619  18.596
  767    HE1  HIS  92           HE1      HIS  92   1.285  22.696  19.122
  768    HE2  HIS  92           HE2      HIS  92   0.849  24.924  20.215
  769    H    HIS  93           H        HIS  93  -0.382  28.034  16.456
  770    HA   HIS  93           HA       HIS  93  -1.644  29.833  14.494
  771   1HB   HIS  93          2HB       HIS  93  -1.676  30.215  17.148
  772   2HB   HIS  93          1HB       HIS  93  -0.123  30.962  16.790
  773    HD1  HIS  93           HD1      HIS  93  -2.552  32.604  17.815
  774    HD2  HIS  93           HD2      HIS  93  -1.508  32.174  13.816
  775    HE1  HIS  93           HE1      HIS  93  -3.551  34.592  16.642
  776    HE2  HIS  93           HE2      HIS  93  -2.785  34.379  14.250
  Start of MODEL    4
    1    H    GLN   1           H        GLN   1   7.669 -20.387   1.683
    2    HA   GLN   1           HA       GLN   1   6.912 -19.400   4.338
    3   1HB   GLN   1          2HB       GLN   1   7.159 -17.113   3.349
    4   2HB   GLN   1          1HB       GLN   1   8.686 -17.948   3.588
    5   1HG   GLN   1          2HG       GLN   1   7.688 -18.494   0.960
    6   2HG   GLN   1          1HG       GLN   1   7.714 -16.756   1.244
    7   1HE2  GLN   1          1HE2      GLN   1   9.583 -19.602   0.753
    8   2HE2  GLN   1          2HE2      GLN   1  11.133 -18.841   0.715
    9    H    SER   2           H        SER   2   4.765 -19.233   4.463
   10    HA   SER   2           HA       SER   2   3.224 -19.020   1.960
   11   1HB   SER   2          2HB       SER   2   1.466 -20.407   3.038
   12   2HB   SER   2          1HB       SER   2   2.987 -21.278   2.844
   13    HG   SER   2           HG       SER   2   1.628 -20.734   5.096
   14    H    ASP   3           H        ASP   3   1.404 -17.713   1.969
   15    HA   ASP   3           HA       ASP   3  -0.013 -16.048   2.584
   16   1HB   ASP   3          2HB       ASP   3   0.439 -17.468   5.077
   17   2HB   ASP   3          1HB       ASP   3   0.182 -15.747   5.354
   18    H    VAL   4           H        VAL   4   0.601 -14.097   2.004
   19    HA   VAL   4           HA       VAL   4   3.077 -12.939   2.980
   20    HB   VAL   4           HB       VAL   4   1.075 -11.693   1.086
   21   1HG1  VAL   4          1HG1      VAL   4   2.575 -10.043   0.716
   22   2HG1  VAL   4          2HG1      VAL   4   3.964 -11.110   0.911
   23   3HG1  VAL   4          3HG1      VAL   4   3.129 -10.481   2.331
   24   1HG2  VAL   4          1HG2      VAL   4   3.526 -12.865  -0.035
   25   2HG2  VAL   4          2HG2      VAL   4   1.876 -12.873  -0.656
   26   3HG2  VAL   4          3HG2      VAL   4   2.358 -14.033   0.580
   27    H    ARG   5           H        ARG   5   3.052 -11.959   4.896
   28    HA   ARG   5           HA       ARG   5   0.640 -10.683   5.897
   29   1HB   ARG   5          2HB       ARG   5   3.088 -11.763   7.038
   30   2HB   ARG   5          1HB       ARG   5   2.719 -10.176   7.694
   31   1HG   ARG   5          2HG       ARG   5   0.794 -10.887   8.708
   32   2HG   ARG   5          1HG       ARG   5   0.549 -12.210   7.564
   33   1HD   ARG   5          2HD       ARG   5   3.001 -12.400   9.172
   34   2HD   ARG   5          1HD       ARG   5   1.501 -12.504  10.095
   35    HE   ARG   5           HE       ARG   5   2.560 -14.457   8.275
   36   1HH1  ARG   5          1HH1      ARG   5  -0.368 -13.235   9.755
   37   2HH1  ARG   5          2HH1      ARG   5  -1.226 -14.728   9.583
   38   1HH2  ARG   5          1HH2      ARG   5   1.423 -16.421   8.042
   39   2HH2  ARG   5          2HH2      ARG   5  -0.210 -16.538   8.610
   40    H    ILE   6           H        ILE   6   0.215  -8.689   5.152
   41    HA   ILE   6           HA       ILE   6   2.462  -6.815   4.803
   42    HB   ILE   6           HB       ILE   6  -0.297  -6.490   3.629
   43   1HG1  ILE   6          2HG1      ILE   6   2.155  -7.671   2.299
   44   2HG1  ILE   6          1HG1      ILE   6   0.742  -8.588   2.806
   45   1HG2  ILE   6          1HG2      ILE   6   0.862  -4.957   2.094
   46   2HG2  ILE   6          2HG2      ILE   6   2.365  -5.233   2.975
   47   3HG2  ILE   6          3HG2      ILE   6   1.004  -4.450   3.777
   48   1HD1  ILE   6          1HD1      ILE   6   1.190  -7.055   0.399
   49   2HD1  ILE   6          2HD1      ILE   6  -0.306  -6.591   1.211
   50   3HD1  ILE   6          3HD1      ILE   6  -0.033  -8.273   0.755
   51    H    LYS   7           H        LYS   7   2.619  -5.090   6.083
   52    HA   LYS   7           HA       LYS   7   0.416  -4.524   7.939
   53   1HB   LYS   7          2HB       LYS   7   3.268  -4.639   8.216
   54   2HB   LYS   7          1HB       LYS   7   2.724  -3.014   8.611
   55   1HG   LYS   7          2HG       LYS   7   2.319  -3.808  10.647
   56   2HG   LYS   7          1HG       LYS   7   0.913  -4.601   9.936
   57   1HD   LYS   7          2HD       LYS   7   3.616  -5.906   9.913
   58   2HD   LYS   7          1HD       LYS   7   2.553  -6.026  11.316
   59   1HE   LYS   7          2HE       LYS   7   1.722  -7.830  10.272
   60   2HE   LYS   7          1HE       LYS   7   0.843  -6.653   9.297
   61   1HZ   LYS   7          1HZ       LYS   7   1.819  -7.887   7.676
   62   2HZ   LYS   7          2HZ       LYS   7   3.180  -8.271   8.597
   63   3HZ   LYS   7          3HZ       LYS   7   3.042  -6.741   7.893
   64    H    PHE   8           H        PHE   8  -0.809  -2.784   7.647
   65    HA   PHE   8           HA       PHE   8   0.222  -0.599   5.955
   66   1HB   PHE   8          2HB       PHE   8  -2.579  -1.672   6.294
   67   2HB   PHE   8          1HB       PHE   8  -2.238  -0.125   5.526
   68    HD1  PHE   8           HD2      PHE   8  -1.992  -3.760   5.215
   69    HD2  PHE   8           HD1      PHE   8  -1.189  -0.018   3.351
   70    HE1  PHE   8           HE2      PHE   8  -1.615  -4.910   3.074
   71    HE2  PHE   8           HE1      PHE   8  -0.812  -1.163   1.207
   72    HZ   PHE   8           HZ       PHE   8  -1.024  -3.612   1.066
   73    H    GLU   9           H        GLU   9   0.061   1.493   6.658
   74    HA   GLU   9           HA       GLU   9  -1.127   1.905   9.321
   75   1HB   GLU   9          2HB       GLU   9   1.558   2.659   8.272
   76   2HB   GLU   9          1HB       GLU   9   0.766   3.775   9.378
   77   1HG   GLU   9          2HG       GLU   9   1.225   2.503  11.138
   78   2HG   GLU   9          1HG       GLU   9   0.631   1.051  10.338
   79    H    HIS  10           H        HIS  10  -2.634   3.409   9.421
   80    HA   HIS  10           HA       HIS  10  -2.607   5.648   7.524
   81   1HB   HIS  10          2HB       HIS  10  -4.132   3.921   6.625
   82   2HB   HIS  10          1HB       HIS  10  -5.035   3.946   8.136
   83    HD1  HIS  10           HD1      HIS  10  -7.014   5.419   8.135
   84    HD2  HIS  10           HD2      HIS  10  -4.202   6.618   5.321
   85    HE1  HIS  10           HE1      HIS  10  -8.084   7.322   6.886
   86    HE2  HIS  10           HE2      HIS  10  -6.402   7.964   5.123
   87    H    ASN  11           H        ASN  11  -2.810   7.518   8.576
   88    HA   ASN  11           HA       ASN  11  -3.199   9.054  10.204
   89   1HB   ASN  11          2HB       ASN  11  -5.602   7.969   9.636
   90   2HB   ASN  11          1HB       ASN  11  -5.497   7.567  11.347
   91   1HD2  ASN  11          1HD2      ASN  11  -5.742  10.116   9.006
   92   2HD2  ASN  11          2HD2      ASN  11  -6.096  11.386  10.124
   93    H    GLY  12           H        GLY  12  -1.438   6.816  10.837
   94   1HA   GLY  12          2HA       GLY  12  -0.133   6.556  12.788
   95   2HA   GLY  12          1HA       GLY  12  -1.506   7.080  13.752
   96    H    GLU  13           H        GLU  13  -3.463   5.329  12.723
   97    HA   GLU  13           HA       GLU  13  -2.937   3.008  14.272
   98   1HB   GLU  13          2HB       GLU  13  -5.172   3.895  12.483
   99   2HB   GLU  13          1HB       GLU  13  -5.126   2.233  13.050
  100   1HG   GLU  13          2HG       GLU  13  -6.531   3.543  14.492
  101   2HG   GLU  13          1HG       GLU  13  -5.084   3.053  15.372
  102    H    ARG  14           H        ARG  14  -2.826   0.817  13.589
  103    HA   ARG  14           HA       ARG  14  -1.779   0.476  10.856
  104   1HB   ARG  14          2HB       ARG  14  -0.491  -1.465  11.775
  105   2HB   ARG  14          1HB       ARG  14   0.013   0.100  12.389
  106   1HG   ARG  14          2HG       ARG  14  -1.985  -0.996  14.118
  107   2HG   ARG  14          1HG       ARG  14  -0.713  -2.190  13.849
  108   1HD   ARG  14          2HD       ARG  14  -0.193   0.667  14.655
  109   2HD   ARG  14          1HD       ARG  14  -0.339  -0.660  15.801
  110    HE   ARG  14           HE       ARG  14   1.674  -1.572  14.975
  111   1HH1  ARG  14          1HH1      ARG  14   0.911   1.526  13.502
  112   2HH1  ARG  14          2HH1      ARG  14   2.514   1.763  12.895
  113   1HH2  ARG  14          1HH2      ARG  14   3.779  -1.237  14.167
  114   2HH2  ARG  14          2HH2      ARG  14   4.137   0.201  13.271
  115    H    ARG  15           H        ARG  15  -2.265  -1.458   9.742
  116    HA   ARG  15           HA       ARG  15  -4.521  -3.004  10.835
  117   1HB   ARG  15          2HB       ARG  15  -4.236  -1.715   8.134
  118   2HB   ARG  15          1HB       ARG  15  -5.247  -3.137   8.342
  119   1HG   ARG  15          2HG       ARG  15  -6.385  -1.797  10.220
  120   2HG   ARG  15          1HG       ARG  15  -5.592  -0.397   9.495
  121   1HD   ARG  15          2HD       ARG  15  -6.899  -0.444   7.640
  122   2HD   ARG  15          1HD       ARG  15  -7.047  -2.200   7.656
  123    HE   ARG  15           HE       ARG  15  -8.956  -1.999   8.897
  124   1HH1  ARG  15          1HH1      ARG  15  -7.256   1.061   8.968
  125   2HH1  ARG  15          2HH1      ARG  15  -8.550   1.906   9.748
  126   1HH2  ARG  15          1HH2      ARG  15 -10.662  -0.882   9.927
  127   2HH2  ARG  15          2HH2      ARG  15 -10.486   0.801  10.294
  128    H    ILE  16           H        ILE  16  -4.215  -5.144  10.807
  129    HA   ILE  16           HA       ILE  16  -1.903  -6.197   9.342
  130    HB   ILE  16           HB       ILE  16  -3.570  -7.620  11.426
  131   1HG1  ILE  16          2HG1      ILE  16  -0.919  -6.815  12.293
  132   2HG1  ILE  16          1HG1      ILE  16  -1.889  -5.417  11.845
  133   1HG2  ILE  16          1HG2      ILE  16  -1.178  -8.308   9.842
  134   2HG2  ILE  16          2HG2      ILE  16  -2.432  -9.345  10.523
  135   3HG2  ILE  16          3HG2      ILE  16  -1.131  -8.745  11.552
  136   1HD1  ILE  16          1HD1      ILE  16  -3.349  -7.321  13.484
  137   2HD1  ILE  16          2HD1      ILE  16  -3.139  -5.580  13.674
  138   3HD1  ILE  16          3HD1      ILE  16  -1.905  -6.688  14.272
  139    H    ILE  17           H        ILE  17  -2.259  -7.113   7.420
  140    HA   ILE  17           HA       ILE  17  -4.733  -8.661   7.024
  141    HB   ILE  17           HB       ILE  17  -3.490  -6.951   4.866
  142   1HG1  ILE  17          2HG1      ILE  17  -4.410  -5.520   6.660
  143   2HG1  ILE  17          1HG1      ILE  17  -5.339  -5.387   5.172
  144   1HG2  ILE  17          1HG2      ILE  17  -5.983  -7.356   4.039
  145   2HG2  ILE  17          2HG2      ILE  17  -5.797  -8.808   5.023
  146   3HG2  ILE  17          3HG2      ILE  17  -4.679  -8.493   3.696
  147   1HD1  ILE  17          1HD1      ILE  17  -6.569  -7.417   6.653
  148   2HD1  ILE  17          2HD1      ILE  17  -7.161  -5.781   6.360
  149   3HD1  ILE  17          3HD1      ILE  17  -6.202  -6.128   7.799
  150    H    ALA  18           H        ALA  18  -4.470 -10.626   6.129
  151    HA   ALA  18           HA       ALA  18  -1.763 -11.359   5.234
  152   1HB   ALA  18          1HB       ALA  18  -3.897 -13.306   6.064
  153   2HB   ALA  18          2HB       ALA  18  -2.833 -12.526   7.237
  154   3HB   ALA  18          3HB       ALA  18  -2.152 -13.552   5.975
  155    H    PHE  19           H        PHE  19  -1.425 -12.212   3.234
  156    HA   PHE  19           HA       PHE  19  -3.792 -12.590   1.511
  157   1HB   PHE  19          2HB       PHE  19  -1.262 -11.095   1.060
  158   2HB   PHE  19          1HB       PHE  19  -1.910 -11.993  -0.308
  159    HD1  PHE  19           HD1      PHE  19  -4.491 -11.615  -0.738
  160    HD2  PHE  19           HD2      PHE  19  -1.952  -8.926   1.371
  161    HE1  PHE  19           HE1      PHE  19  -6.058  -9.776  -1.202
  162    HE2  PHE  19           HE2      PHE  19  -3.515  -7.084   0.911
  163    HZ   PHE  19           HZ       PHE  19  -5.572  -7.507  -0.377
  164    H    SER  20           H        SER  20  -4.002 -14.526   0.593
  165    HA   SER  20           HA       SER  20  -1.943 -16.527   0.952
  166   1HB   SER  20          2HB       SER  20  -3.787 -17.859  -0.447
  167   2HB   SER  20          1HB       SER  20  -3.976 -17.542   1.278
  168    HG   SER  20           HG       SER  20  -5.145 -16.148  -0.896
  169    H    ARG  21           H        ARG  21  -0.948 -17.719  -0.725
  170    HA   ARG  21           HA       ARG  21  -0.472 -16.169  -3.136
  171   1HB   ARG  21          2HB       ARG  21   0.864 -18.461  -1.772
  172   2HB   ARG  21          1HB       ARG  21   1.122 -18.270  -3.500
  173   1HG   ARG  21          2HG       ARG  21   2.467 -16.504  -3.231
  174   2HG   ARG  21          1HG       ARG  21   1.465 -15.806  -1.956
  175   1HD   ARG  21          2HD       ARG  21   2.388 -17.631  -0.445
  176   2HD   ARG  21          1HD       ARG  21   3.570 -17.943  -1.716
  177    HE   ARG  21           HE       ARG  21   3.526 -15.724   0.110
  178   1HH1  ARG  21          1HH1      ARG  21   4.661 -16.837  -3.012
  179   2HH1  ARG  21          2HH1      ARG  21   5.980 -15.718  -3.071
  180   1HH2  ARG  21          1HH2      ARG  21   5.265 -14.249   0.027
  181   2HH2  ARG  21          2HH2      ARG  21   6.324 -14.247  -1.344
  182    HA   PRO  22           HA       PRO  22   0.282 -16.424  -5.168
  183   1HB   PRO  22          2HB       PRO  22  -0.727 -15.841  -7.579
  184   2HB   PRO  22          1HB       PRO  22   0.154 -17.347  -7.288
  185   1HG   PRO  22          2HG       PRO  22  -2.804 -16.880  -7.407
  186   2HG   PRO  22          1HG       PRO  22  -1.851 -18.187  -8.131
  187   1HD   PRO  22          2HD       PRO  22  -3.231 -18.440  -5.783
  188   2HD   PRO  22          1HD       PRO  22  -1.779 -19.381  -6.174
  189    H    VAL  23           H        VAL  23   0.149 -14.120  -5.777
  190    HA   VAL  23           HA       VAL  23  -2.421 -12.813  -5.353
  191    HB   VAL  23           HB       VAL  23  -1.465 -13.019  -3.092
  192   1HG1  VAL  23          1HG1      VAL  23   0.892 -13.081  -3.624
  193   2HG1  VAL  23          2HG1      VAL  23   0.568 -11.762  -2.497
  194   3HG1  VAL  23          3HG1      VAL  23   0.833 -11.417  -4.205
  195   1HG2  VAL  23          1HG2      VAL  23  -1.204 -10.350  -2.809
  196   2HG2  VAL  23          2HG2      VAL  23  -2.753 -11.172  -2.985
  197   3HG2  VAL  23          3HG2      VAL  23  -1.989 -10.423  -4.386
  198    H    LYS  24           H        LYS  24  -2.617 -10.882  -6.408
  199    HA   LYS  24           HA       LYS  24  -0.256  -9.943  -7.912
  200   1HB   LYS  24          2HB       LYS  24  -3.114 -10.300  -8.661
  201   2HB   LYS  24          1HB       LYS  24  -2.275  -8.910  -9.340
  202   1HG   LYS  24          2HG       LYS  24  -0.786 -10.228 -10.531
  203   2HG   LYS  24          1HG       LYS  24  -1.072 -11.642  -9.514
  204   1HD   LYS  24          2HD       LYS  24  -3.316 -11.869 -10.434
  205   2HD   LYS  24          1HD       LYS  24  -3.071 -10.427 -11.421
  206   1HE   LYS  24          2HE       LYS  24  -1.293 -12.846 -11.618
  207   2HE   LYS  24          1HE       LYS  24  -2.767 -12.676 -12.570
  208   1HZ   LYS  24          1HZ       LYS  24  -0.667 -10.592 -12.595
  209   2HZ   LYS  24          2HZ       LYS  24  -1.903 -10.859 -13.720
  210   3HZ   LYS  24          3HZ       LYS  24  -0.596 -11.931 -13.626
  211    H    TYR  25           H        TYR  25  -0.197  -7.603  -8.388
  212    HA   TYR  25           HA       TYR  25  -0.447  -6.038  -6.100
  213   1HB   TYR  25          2HB       TYR  25   1.041  -5.370  -7.904
  214   2HB   TYR  25          1HB       TYR  25  -0.327  -5.137  -8.989
  215    HD1  TYR  25           HD2      TYR  25   0.532  -4.024  -5.515
  216    HD2  TYR  25           HD1      TYR  25  -0.764  -2.898  -9.413
  217    HE1  TYR  25           HE2      TYR  25   0.339  -1.689  -4.773
  218    HE2  TYR  25           HE1      TYR  25  -0.962  -0.560  -8.674
  219    HH   TYR  25           HH       TYR  25  -1.370   0.576  -6.251
  220    H    GLU  26           H        GLU  26  -2.685  -6.425  -8.824
  221    HA   GLU  26           HA       GLU  26  -4.505  -4.409  -8.150
  222   1HB   GLU  26          2HB       GLU  26  -4.351  -6.352 -10.126
  223   2HB   GLU  26          1HB       GLU  26  -5.790  -6.805  -9.223
  224   1HG   GLU  26          2HG       GLU  26  -5.556  -3.950  -9.874
  225   2HG   GLU  26          1HG       GLU  26  -5.762  -5.032 -11.251
  226    H    ASP  27           H        ASP  27  -4.355  -7.804  -7.129
  227    HA   ASP  27           HA       ASP  27  -6.762  -7.840  -5.668
  228   1HB   ASP  27          2HB       ASP  27  -4.239  -9.479  -5.344
  229   2HB   ASP  27          1HB       ASP  27  -5.737  -9.811  -4.485
  230    H    VAL  28           H        VAL  28  -3.430  -7.150  -4.673
  231    HA   VAL  28           HA       VAL  28  -4.028  -6.769  -1.928
  232    HB   VAL  28           HB       VAL  28  -1.697  -5.608  -3.462
  233   1HG1  VAL  28          1HG1      VAL  28  -1.959  -6.251  -0.526
  234   2HG1  VAL  28          2HG1      VAL  28  -2.147  -4.639  -1.215
  235   3HG1  VAL  28          3HG1      VAL  28  -0.596  -5.469  -1.326
  236   1HG2  VAL  28          1HG2      VAL  28  -0.452  -7.591  -2.737
  237   2HG2  VAL  28          2HG2      VAL  28  -1.813  -8.028  -3.770
  238   3HG2  VAL  28          3HG2      VAL  28  -1.924  -8.255  -2.025
  239    H    GLU  29           H        GLU  29  -3.568  -4.499  -4.627
  240    HA   GLU  29           HA       GLU  29  -3.982  -2.148  -3.133
  241   1HB   GLU  29          2HB       GLU  29  -2.924  -2.181  -5.358
  242   2HB   GLU  29          1HB       GLU  29  -4.461  -2.629  -6.082
  243   1HG   GLU  29          2HG       GLU  29  -5.334  -0.452  -5.000
  244   2HG   GLU  29          1HG       GLU  29  -3.628  -0.024  -4.884
  245    H    HIS  30           H        HIS  30  -6.224  -4.139  -5.048
  246    HA   HIS  30           HA       HIS  30  -8.484  -2.533  -4.834
  247   1HB   HIS  30          2HB       HIS  30  -8.261  -4.543  -6.293
  248   2HB   HIS  30          1HB       HIS  30  -8.443  -5.556  -4.867
  249    HD1  HIS  30           HD1      HIS  30 -10.649  -6.619  -5.440
  250    HD2  HIS  30           HD2      HIS  30 -10.766  -2.470  -5.634
  251    HE1  HIS  30           HE1      HIS  30 -13.073  -6.029  -5.746
  252    HE2  HIS  30           HE2      HIS  30 -13.127  -3.511  -5.817
  253    H    LYS  31           H        LYS  31  -7.300  -5.040  -2.603
  254    HA   LYS  31           HA       LYS  31  -9.509  -4.853  -0.822
  255   1HB   LYS  31          2HB       LYS  31  -7.422  -6.595  -1.105
  256   2HB   LYS  31          1HB       LYS  31  -6.945  -5.712   0.339
  257   1HG   LYS  31          2HG       LYS  31  -9.432  -6.199   1.050
  258   2HG   LYS  31          1HG       LYS  31  -9.259  -7.519  -0.108
  259   1HD   LYS  31          2HD       LYS  31  -7.396  -8.419   1.091
  260   2HD   LYS  31          1HD       LYS  31  -7.325  -7.006   2.146
  261   1HE   LYS  31          2HE       LYS  31  -9.890  -8.480   2.064
  262   2HE   LYS  31          1HE       LYS  31  -8.534  -9.301   2.834
  263   1HZ   LYS  31          1HZ       LYS  31  -8.502  -7.844   4.543
  264   2HZ   LYS  31          2HZ       LYS  31 -10.134  -7.657   4.136
  265   3HZ   LYS  31          3HZ       LYS  31  -8.994  -6.525   3.604
  266    H    VAL  32           H        VAL  32  -6.208  -3.504  -0.703
  267    HA   VAL  32           HA       VAL  32  -6.533  -2.146   1.745
  268    HB   VAL  32           HB       VAL  32  -4.693  -1.382  -0.527
  269   1HG1  VAL  32          1HG1      VAL  32  -3.311  -0.481   1.402
  270   2HG1  VAL  32          2HG1      VAL  32  -4.759  -0.656   2.391
  271   3HG1  VAL  32          3HG1      VAL  32  -4.769   0.420   0.995
  272   1HG2  VAL  32          1HG2      VAL  32  -4.680  -3.789   0.654
  273   2HG2  VAL  32          2HG2      VAL  32  -3.691  -2.894   1.808
  274   3HG2  VAL  32          3HG2      VAL  32  -3.215  -2.973   0.113
  275    H    THR  33           H        THR  33  -6.970  -1.046  -1.610
  276    HA   THR  33           HA       THR  33  -7.514   1.637  -1.060
  277    HB   THR  33           HB       THR  33  -8.524  -0.104  -3.321
  278    HG1  THR  33           HG1      THR  33  -6.300   1.637  -3.065
  279   1HG2  THR  33          1HG2      THR  33  -8.956   1.865  -4.587
  280   2HG2  THR  33          2HG2      THR  33  -8.370   2.897  -3.282
  281   3HG2  THR  33          3HG2      THR  33  -9.861   1.976  -3.079
  282    H    THR  34           H        THR  34  -9.683  -1.181  -1.072
  283    HA   THR  34           HA       THR  34 -12.050   0.373  -0.673
  284    HB   THR  34           HB       THR  34 -11.644  -2.561  -0.061
  285    HG1  THR  34           HG1      THR  34 -11.623  -2.839  -2.124
  286   1HG2  THR  34          1HG2      THR  34 -13.836  -2.768   0.271
  287   2HG2  THR  34          2HG2      THR  34 -14.232  -1.677  -1.058
  288   3HG2  THR  34          3HG2      THR  34 -13.824  -1.024   0.529
  289    H    VAL  35           H        VAL  35  -9.841  -1.354   1.506
  290    HA   VAL  35           HA       VAL  35 -11.317  -1.151   3.861
  291    HB   VAL  35           HB       VAL  35  -8.304  -1.002   3.618
  292   1HG1  VAL  35          1HG1      VAL  35  -8.935  -0.309   5.805
  293   2HG1  VAL  35          2HG1      VAL  35  -8.385  -1.980   5.929
  294   3HG1  VAL  35          3HG1      VAL  35 -10.111  -1.616   5.949
  295   1HG2  VAL  35          1HG2      VAL  35  -9.336  -3.544   4.481
  296   2HG2  VAL  35          2HG2      VAL  35  -8.278  -3.168   3.121
  297   3HG2  VAL  35          3HG2      VAL  35 -10.027  -3.099   2.921
  298    H    PHE  36           H        PHE  36  -8.836   1.109   2.628
  299    HA   PHE  36           HA       PHE  36  -9.555   3.035   4.688
  300   1HB   PHE  36          2HB       PHE  36  -7.442   3.181   2.531
  301   2HB   PHE  36          1HB       PHE  36  -7.656   4.344   3.835
  302    HD1  PHE  36           HD2      PHE  36  -7.458   3.460   6.239
  303    HD2  PHE  36           HD1      PHE  36  -6.065   1.330   2.827
  304    HE1  PHE  36           HE2      PHE  36  -5.979   2.123   7.681
  305    HE2  PHE  36           HE1      PHE  36  -4.587  -0.011   4.266
  306    HZ   PHE  36           HZ       PHE  36  -4.540   0.386   6.694
  307    H    GLY  37           H        GLY  37 -10.081   2.541   1.265
  308   1HA   GLY  37          2HA       GLY  37 -11.930   3.589   0.182
  309   2HA   GLY  37          1HA       GLY  37 -11.727   4.973   1.242
  310    H    GLN  38           H        GLN  38 -11.827   6.244  -0.711
  311    HA   GLN  38           HA       GLN  38  -9.175   6.610  -1.869
  312   1HB   GLN  38          2HB       GLN  38 -11.626   5.846  -3.393
  313   2HB   GLN  38          1HB       GLN  38 -10.516   6.993  -4.131
  314   1HG   GLN  38          2HG       GLN  38  -8.764   5.119  -3.370
  315   2HG   GLN  38          1HG       GLN  38 -10.192   4.112  -3.591
  316   1HE2  GLN  38          1HE2      GLN  38  -7.607   4.415  -5.097
  317   2HE2  GLN  38          2HE2      GLN  38  -8.092   4.652  -6.739
  318    HA   PRO  39           HA       PRO  39  -8.631   7.782  -3.739
  319   1HB   PRO  39          2HB       PRO  39  -7.243   9.968  -4.375
  320   2HB   PRO  39          1HB       PRO  39  -8.843   9.671  -5.063
  321   1HG   PRO  39          2HG       PRO  39  -8.037  11.529  -2.873
  322   2HG   PRO  39          1HG       PRO  39  -9.252  11.751  -4.143
  323   1HD   PRO  39          2HD       PRO  39  -9.750  10.961  -1.503
  324   2HD   PRO  39          1HD       PRO  39 -10.880  10.825  -2.862
  325    H    LEU  40           H        LEU  40  -6.837   6.775  -3.040
  326    HA   LEU  40           HA       LEU  40  -5.088   8.121  -1.104
  327   1HB   LEU  40          2HB       LEU  40  -6.103   5.286  -0.858
  328   2HB   LEU  40          1HB       LEU  40  -4.839   5.983   0.135
  329    HG   LEU  40           HG       LEU  40  -7.563   7.237   0.050
  330   1HD1  LEU  40          1HD1      LEU  40  -7.318   4.627   0.697
  331   2HD1  LEU  40          2HD1      LEU  40  -8.513   5.719   1.397
  332   3HD1  LEU  40          3HD1      LEU  40  -7.010   5.387   2.258
  333   1HD2  LEU  40          1HD2      LEU  40  -5.783   7.065   2.431
  334   2HD2  LEU  40          2HD2      LEU  40  -6.928   8.321   1.964
  335   3HD2  LEU  40          3HD2      LEU  40  -5.376   8.194   1.138
  336    H    ASP  41           H        ASP  41  -2.903   7.520  -1.193
  337    HA   ASP  41           HA       ASP  41  -2.156   5.922  -3.558
  338   1HB   ASP  41          2HB       ASP  41  -0.984   8.416  -2.371
  339   2HB   ASP  41          1HB       ASP  41   0.055   7.314  -3.269
  340    H    LEU  42           H        LEU  42  -0.917   4.162  -3.262
  341    HA   LEU  42           HA       LEU  42  -0.099   3.473  -0.556
  342   1HB   LEU  42          2HB       LEU  42   0.029   1.886  -3.125
  343   2HB   LEU  42          1HB       LEU  42   0.447   1.266  -1.539
  344    HG   LEU  42           HG       LEU  42  -2.263   2.414  -1.763
  345   1HD1  LEU  42          1HD1      LEU  42  -3.203   0.918  -3.181
  346   2HD1  LEU  42          2HD1      LEU  42  -2.010  -0.335  -2.834
  347   3HD1  LEU  42          3HD1      LEU  42  -1.603   0.995  -3.920
  348   1HD2  LEU  42          1HD2      LEU  42  -1.520   1.368   0.281
  349   2HD2  LEU  42          2HD2      LEU  42  -1.113  -0.113  -0.586
  350   3HD2  LEU  42          3HD2      LEU  42  -2.797   0.394  -0.449
  351    H    HIS  43           H        HIS  43   1.799   4.228   0.132
  352    HA   HIS  43           HA       HIS  43   4.070   4.244  -1.747
  353   1HB   HIS  43          2HB       HIS  43   3.005   6.338  -0.208
  354   2HB   HIS  43          1HB       HIS  43   4.507   5.885   0.590
  355    HD1  HIS  43           HD1      HIS  43   3.271   7.987  -2.034
  356    HD2  HIS  43           HD2      HIS  43   6.747   5.806  -1.396
  357    HE1  HIS  43           HE1      HIS  43   4.979   8.972  -3.597
  358    HE2  HIS  43           HE2      HIS  43   7.106   7.719  -3.097
  359    H    TYR  44           H        TYR  44   5.575   2.764  -1.362
  360    HA   TYR  44           HA       TYR  44   5.760   1.552   1.298
  361   1HB   TYR  44          2HB       TYR  44   5.496  -0.078  -0.416
  362   2HB   TYR  44          1HB       TYR  44   6.701   0.694  -1.437
  363    HD1  TYR  44           HD2      TYR  44   9.119   0.548  -0.803
  364    HD2  TYR  44           HD1      TYR  44   6.117  -1.706   1.197
  365    HE1  TYR  44           HE2      TYR  44  10.850  -0.961   0.084
  366    HE2  TYR  44           HE1      TYR  44   7.836  -3.219   2.089
  367    HH   TYR  44           HH       TYR  44  10.356  -3.050   2.600
  368    H    MET  45           H        MET  45   7.474   1.877   2.607
  369    HA   MET  45           HA       MET  45   9.694   3.499   1.565
  370   1HB   MET  45          2HB       MET  45  10.198   3.992   3.942
  371   2HB   MET  45          1HB       MET  45   8.587   4.505   3.462
  372   1HG   MET  45          2HG       MET  45   7.602   3.179   4.955
  373   2HG   MET  45          1HG       MET  45   8.645   1.813   4.570
  374   1HE   MET  45          1HE       MET  45  11.055   1.438   5.649
  375   2HE   MET  45          2HE       MET  45   9.684   0.754   6.520
  376   3HE   MET  45          3HE       MET  45  10.977   1.559   7.407
  377    H    ASN  46           H        ASN  46  11.716   2.701   1.414
  378    HA   ASN  46           HA       ASN  46  12.136  -0.105   1.926
  379   1HB   ASN  46          2HB       ASN  46  14.392   0.293   0.982
  380   2HB   ASN  46          1HB       ASN  46  13.112   0.894  -0.065
  381   1HD2  ASN  46          1HD2      ASN  46  15.998   1.630   1.484
  382   2HD2  ASN  46          2HD2      ASN  46  15.993   3.339   1.229
  383    H    ASN  47           H        ASN  47  13.253   2.934   3.309
  384    HA   ASN  47           HA       ASN  47  13.633   1.876   5.884
  385   1HB   ASN  47          2HB       ASN  47  15.645   0.881   4.677
  386   2HB   ASN  47          1HB       ASN  47  16.248   2.527   4.516
  387   1HD2  ASN  47          1HD2      ASN  47  16.625  -0.151   6.267
  388   2HD2  ASN  47          2HD2      ASN  47  17.081   0.526   7.790
  389    H    GLU  48           H        GLU  48  15.076   4.292   3.696
  390    HA   GLU  48           HA       GLU  48  14.460   6.369   5.694
  391   1HB   GLU  48          2HB       GLU  48  16.716   6.019   3.767
  392   2HB   GLU  48          1HB       GLU  48  16.215   7.652   4.184
  393   1HG   GLU  48          2HG       GLU  48  17.361   7.552   6.069
  394   2HG   GLU  48          1HG       GLU  48  16.442   6.139   6.583
  395    H    LEU  49           H        LEU  49  14.400   5.611   2.217
  396    HA   LEU  49           HA       LEU  49  12.768   7.993   1.733
  397   1HB   LEU  49          2HB       LEU  49  14.603   6.359   0.120
  398   2HB   LEU  49          1HB       LEU  49  13.139   6.830  -0.716
  399    HG   LEU  49           HG       LEU  49  14.999   8.382  -1.135
  400   1HD1  LEU  49          1HD1      LEU  49  12.500   9.050  -0.948
  401   2HD1  LEU  49          2HD1      LEU  49  13.734  10.306  -1.053
  402   3HD1  LEU  49          3HD1      LEU  49  13.020   9.900   0.507
  403   1HD2  LEU  49          1HD2      LEU  49  16.373   8.564   0.659
  404   2HD2  LEU  49          2HD2      LEU  49  15.055   8.461   1.826
  405   3HD2  LEU  49          3HD2      LEU  49  15.360   9.973   0.971
  406    H    SER  50           H        SER  50  10.969   7.738   0.148
  407    HA   SER  50           HA       SER  50   9.510   5.212   0.578
  408   1HB   SER  50          2HB       SER  50   8.625   8.051   0.851
  409   2HB   SER  50          1HB       SER  50   7.461   6.877   0.238
  410    HG   SER  50           HG       SER  50   8.774   6.932   2.734
  411    H    ILE  51           H        ILE  51   9.069   4.140  -1.232
  412    HA   ILE  51           HA       ILE  51   8.984   5.627  -3.775
  413    HB   ILE  51           HB       ILE  51   9.361   3.127  -4.637
  414   1HG1  ILE  51          2HG1      ILE  51  11.069   3.137  -2.157
  415   2HG1  ILE  51          1HG1      ILE  51   9.481   2.378  -2.177
  416   1HG2  ILE  51          1HG2      ILE  51  10.770   5.397  -4.727
  417   2HG2  ILE  51          2HG2      ILE  51  11.371   3.863  -5.355
  418   3HG2  ILE  51          3HG2      ILE  51  11.866   4.416  -3.755
  419   1HD1  ILE  51          1HD1      ILE  51  11.172   1.563  -4.403
  420   2HD1  ILE  51          2HD1      ILE  51  10.234   0.591  -3.267
  421   3HD1  ILE  51          3HD1      ILE  51  11.840   1.166  -2.820
  422    H    LEU  52           H        LEU  52   7.179   5.513  -4.991
  423    HA   LEU  52           HA       LEU  52   4.895   4.072  -3.941
  424   1HB   LEU  52          2HB       LEU  52   4.779   6.420  -4.842
  425   2HB   LEU  52          1HB       LEU  52   5.051   5.755  -6.442
  426    HG   LEU  52           HG       LEU  52   2.863   4.358  -5.235
  427   1HD1  LEU  52          1HD1      LEU  52   1.297   6.085  -4.813
  428   2HD1  LEU  52          2HD1      LEU  52   2.416   7.331  -5.362
  429   3HD1  LEU  52          3HD1      LEU  52   2.732   6.460  -3.861
  430   1HD2  LEU  52          1HD2      LEU  52   1.665   5.283  -7.203
  431   2HD2  LEU  52          2HD2      LEU  52   3.194   4.504  -7.609
  432   3HD2  LEU  52          3HD2      LEU  52   3.086   6.264  -7.561
  433    H    LEU  53           H        LEU  53   3.986   2.266  -4.779
  434    HA   LEU  53           HA       LEU  53   5.406   0.955  -6.981
  435   1HB   LEU  53          2HB       LEU  53   3.320  -0.280  -5.189
  436   2HB   LEU  53          1HB       LEU  53   4.467  -1.105  -6.223
  437    HG   LEU  53           HG       LEU  53   5.304  -1.441  -4.075
  438   1HD1  LEU  53          1HD1      LEU  53   7.413  -0.671  -4.265
  439   2HD1  LEU  53          2HD1      LEU  53   6.903   1.000  -4.505
  440   3HD1  LEU  53          3HD1      LEU  53   6.836  -0.142  -5.846
  441   1HD2  LEU  53          1HD2      LEU  53   4.899  -0.158  -2.294
  442   2HD2  LEU  53          2HD2      LEU  53   3.793   0.722  -3.349
  443   3HD2  LEU  53          3HD2      LEU  53   5.438   1.310  -3.110
  444    H    LYS  54           H        LYS  54   4.463   2.133  -8.708
  445    HA   LYS  54           HA       LYS  54   1.567   1.826  -9.066
  446   1HB   LYS  54          2HB       LYS  54   3.319   3.953  -9.587
  447   2HB   LYS  54          1HB       LYS  54   2.868   3.332 -11.168
  448   1HG   LYS  54          2HG       LYS  54   0.535   3.644 -10.688
  449   2HG   LYS  54          1HG       LYS  54   0.899   4.104  -9.025
  450   1HD   LYS  54          2HD       LYS  54   1.647   6.185  -9.617
  451   2HD   LYS  54          1HD       LYS  54   2.177   5.657 -11.217
  452   1HE   LYS  54          2HE       LYS  54  -0.466   5.287 -11.479
  453   2HE   LYS  54          1HE       LYS  54  -0.477   6.596 -10.300
  454   1HZ   LYS  54          1HZ       LYS  54   0.344   8.067 -11.792
  455   2HZ   LYS  54          2HZ       LYS  54  -0.401   7.027 -12.896
  456   3HZ   LYS  54          3HZ       LYS  54   1.265   6.917 -12.623
  457    H    ASN  55           H        ASN  55   3.596  -0.358  -9.471
  458    HA   ASN  55           HA       ASN  55   2.474  -1.441 -11.857
  459   1HB   ASN  55          2HB       ASN  55   4.897   0.059 -12.151
  460   2HB   ASN  55          1HB       ASN  55   5.259  -1.643 -12.420
  461   1HD2  ASN  55          1HD2      ASN  55   4.419  -2.685 -14.193
  462   2HD2  ASN  55          2HD2      ASN  55   3.618  -1.854 -15.478
  463    H    GLN  56           H        GLN  56   3.231  -3.678 -12.261
  464    HA   GLN  56           HA       GLN  56   3.460  -5.152  -9.881
  465   1HB   GLN  56          2HB       GLN  56   3.595  -5.783 -12.775
  466   2HB   GLN  56          1HB       GLN  56   4.370  -6.938 -11.700
  467   1HG   GLN  56          2HG       GLN  56   1.775  -6.209 -10.696
  468   2HG   GLN  56          1HG       GLN  56   1.667  -6.779 -12.359
  469   1HE2  GLN  56          1HE2      GLN  56   2.344  -7.623  -9.080
  470   2HE2  GLN  56          2HE2      GLN  56   2.469  -9.330  -9.321
  471    H    ASP  57           H        ASP  57   5.891  -4.106 -12.227
  472    HA   ASP  57           HA       ASP  57   8.085  -5.500 -11.161
  473   1HB   ASP  57          2HB       ASP  57   7.718  -3.168 -12.970
  474   2HB   ASP  57          1HB       ASP  57   9.300  -3.351 -12.221
  475    H    ASP  58           H        ASP  58   6.878  -2.212 -10.509
  476    HA   ASP  58           HA       ASP  58   8.888  -1.441  -8.705
  477   1HB   ASP  58          2HB       ASP  58   6.004  -0.568  -8.954
  478   2HB   ASP  58          1HB       ASP  58   7.141   0.179  -7.836
  479    H    LEU  59           H        LEU  59   5.762  -3.026  -8.160
  480    HA   LEU  59           HA       LEU  59   5.884  -3.091  -5.347
  481   1HB   LEU  59          2HB       LEU  59   3.830  -3.478  -6.639
  482   2HB   LEU  59          1HB       LEU  59   4.490  -4.983  -7.245
  483    HG   LEU  59           HG       LEU  59   4.666  -5.458  -4.600
  484   1HD1  LEU  59          1HD1      LEU  59   2.282  -4.670  -3.825
  485   2HD1  LEU  59          2HD1      LEU  59   2.589  -3.362  -4.968
  486   3HD1  LEU  59          3HD1      LEU  59   3.696  -3.635  -3.623
  487   1HD2  LEU  59          1HD2      LEU  59   2.630  -6.008  -6.677
  488   2HD2  LEU  59          2HD2      LEU  59   2.195  -6.381  -5.009
  489   3HD2  LEU  59          3HD2      LEU  59   3.622  -7.120  -5.734
  490    H    ASP  60           H        ASP  60   6.963  -5.421  -7.805
  491    HA   ASP  60           HA       ASP  60   7.789  -7.411  -5.948
  492   1HB   ASP  60          2HB       ASP  60   7.396  -7.432  -8.615
  493   2HB   ASP  60          1HB       ASP  60   9.148  -7.280  -8.583
  494    H    LYS  61           H        LYS  61   9.400  -4.660  -7.445
  495    HA   LYS  61           HA       LYS  61  12.051  -5.319  -6.774
  496   1HB   LYS  61          2HB       LYS  61  10.813  -3.257  -8.118
  497   2HB   LYS  61          1HB       LYS  61  11.424  -2.455  -6.675
  498   1HG   LYS  61          2HG       LYS  61  13.657  -3.558  -7.215
  499   2HG   LYS  61          1HG       LYS  61  12.960  -3.913  -8.797
  500   1HD   LYS  61          2HD       LYS  61  14.048  -1.892  -9.146
  501   2HD   LYS  61          1HD       LYS  61  12.382  -1.397  -8.848
  502   1HE   LYS  61          2HE       LYS  61  12.947  -0.938  -6.505
  503   2HE   LYS  61          1HE       LYS  61  14.618  -1.410  -6.822
  504   1HZ   LYS  61          1HZ       LYS  61  14.312   0.428  -8.692
  505   2HZ   LYS  61          2HZ       LYS  61  14.817   0.808  -7.122
  506   3HZ   LYS  61          3HZ       LYS  61  13.200   1.026  -7.567
  507    H    ALA  62           H        ALA  62   9.496  -3.698  -4.963
  508    HA   ALA  62           HA       ALA  62  11.081  -2.809  -2.799
  509   1HB   ALA  62          1HB       ALA  62   9.150  -2.046  -1.923
  510   2HB   ALA  62          2HB       ALA  62   8.292  -3.559  -2.214
  511   3HB   ALA  62          3HB       ALA  62   8.519  -2.405  -3.529
  512    H    ILE  63           H        ILE  63   9.389  -5.843  -3.443
  513    HA   ILE  63           HA       ILE  63   9.680  -7.004  -0.888
  514    HB   ILE  63           HB       ILE  63   9.598  -8.504  -3.511
  515   1HG1  ILE  63          2HG1      ILE  63   7.715  -6.987  -3.474
  516   2HG1  ILE  63          1HG1      ILE  63   7.133  -8.611  -3.135
  517   1HG2  ILE  63          1HG2      ILE  63   8.333  -9.547  -1.048
  518   2HG2  ILE  63          2HG2      ILE  63  10.096  -9.523  -1.086
  519   3HG2  ILE  63          3HG2      ILE  63   9.201 -10.396  -2.329
  520   1HD1  ILE  63          1HD1      ILE  63   7.060  -8.065  -0.744
  521   2HD1  ILE  63          2HD1      ILE  63   6.039  -6.997  -1.708
  522   3HD1  ILE  63          3HD1      ILE  63   7.601  -6.429  -1.116
  523    H    ASP  64           H        ASP  64  11.723  -7.144  -3.794
  524    HA   ASP  64           HA       ASP  64  13.593  -9.013  -2.952
  525   1HB   ASP  64          2HB       ASP  64  14.210  -6.549  -4.597
  526   2HB   ASP  64          1HB       ASP  64  15.133  -8.047  -4.561
  527    H    ILE  65           H        ILE  65  13.355  -5.593  -2.186
  528    HA   ILE  65           HA       ILE  65  15.878  -5.342  -0.937
  529    HB   ILE  65           HB       ILE  65  13.408  -3.710  -0.336
  530   1HG1  ILE  65          2HG1      ILE  65  15.530  -3.218  -2.443
  531   2HG1  ILE  65          1HG1      ILE  65  13.899  -3.788  -2.775
  532   1HG2  ILE  65          1HG2      ILE  65  14.941  -2.003   0.374
  533   2HG2  ILE  65          2HG2      ILE  65  16.323  -2.973  -0.137
  534   3HG2  ILE  65          3HG2      ILE  65  15.332  -3.497   1.223
  535   1HD1  ILE  65          1HD1      ILE  65  14.864  -1.092  -2.104
  536   2HD1  ILE  65          2HD1      ILE  65  13.320  -1.567  -1.399
  537   3HD1  ILE  65          3HD1      ILE  65  13.538  -1.602  -3.149
  538    H    LEU  66           H        LEU  66  12.657  -6.196   0.275
  539    HA   LEU  66           HA       LEU  66  13.267  -6.194   3.024
  540   1HB   LEU  66          2HB       LEU  66  10.975  -6.261   2.070
  541   2HB   LEU  66          1HB       LEU  66  11.260  -7.915   1.568
  542    HG   LEU  66           HG       LEU  66  11.640  -8.461   4.023
  543   1HD1  LEU  66          1HD1      LEU  66  10.663  -5.639   4.243
  544   2HD1  LEU  66          2HD1      LEU  66  11.997  -6.431   5.083
  545   3HD1  LEU  66          3HD1      LEU  66  10.330  -6.815   5.515
  546   1HD2  LEU  66          1HD2      LEU  66   9.042  -7.715   2.770
  547   2HD2  LEU  66          2HD2      LEU  66   9.066  -8.193   4.467
  548   3HD2  LEU  66          3HD2      LEU  66   9.662  -9.301   3.230
  549    H    ASP  67           H        ASP  67  13.542  -8.721   0.557
  550    HA   ASP  67           HA       ASP  67  14.128 -10.909   2.187
  551   1HB   ASP  67          2HB       ASP  67  14.874 -10.210  -0.642
  552   2HB   ASP  67          1HB       ASP  67  15.468 -11.689   0.102
  553    H    ARG  68           H        ARG  68  16.203  -8.304   1.056
  554    HA   ARG  68           HA       ARG  68  18.678  -9.471   1.809
  555   1HB   ARG  68          2HB       ARG  68  17.863  -7.159   0.486
  556   2HB   ARG  68          1HB       ARG  68  18.639  -6.563   1.946
  557   1HG   ARG  68          2HG       ARG  68  20.267  -6.675   0.203
  558   2HG   ARG  68          1HG       ARG  68  20.628  -7.936   1.384
  559   1HD   ARG  68          2HD       ARG  68  20.678  -9.361  -0.328
  560   2HD   ARG  68          1HD       ARG  68  18.930  -9.176  -0.414
  561    HE   ARG  68           HE       ARG  68  19.177  -7.941  -2.325
  562   1HH1  ARG  68          1HH1      ARG  68  22.301  -8.222  -0.764
  563   2HH1  ARG  68          2HH1      ARG  68  23.171  -7.565  -2.108
  564   1HH2  ARG  68          1HH2      ARG  68  20.330  -7.074  -4.095
  565   2HH2  ARG  68          2HH2      ARG  68  22.051  -6.911  -3.998
  566    H    SER  69           H        SER  69  16.292  -7.526   3.511
  567    HA   SER  69           HA       SER  69  17.976  -7.148   5.825
  568   1HB   SER  69          2HB       SER  69  16.202  -5.508   5.070
  569   2HB   SER  69          1HB       SER  69  14.997  -6.664   5.636
  570    HG   SER  69           HG       SER  69  15.881  -4.878   7.107
  571    H    SER  70           H        SER  70  18.490  -9.079   6.765
  572    HA   SER  70           HA       SER  70  16.738 -11.264   7.089
  573   1HB   SER  70          2HB       SER  70  18.490 -11.772   9.029
  574   2HB   SER  70          1HB       SER  70  18.926 -11.939   7.329
  575    HG   SER  70           HG       SER  70  19.510  -9.797   9.087
  576    H    SER  71           H        SER  71  17.386  -8.448   9.103
  577    HA   SER  71           HA       SER  71  16.054  -9.422  11.426
  578   1HB   SER  71          2HB       SER  71  16.048  -6.952  12.072
  579   2HB   SER  71          1HB       SER  71  17.628  -7.678  11.777
  580    HG   SER  71           HG       SER  71  16.298  -5.705  10.385
  581    H    MET  72           H        MET  72  15.070  -7.165   8.843
  582    HA   MET  72           HA       MET  72  12.446  -6.769   9.851
  583   1HB   MET  72          2HB       MET  72  14.005  -5.787   7.691
  584   2HB   MET  72          1HB       MET  72  12.506  -6.402   7.011
  585   1HG   MET  72          2HG       MET  72  11.197  -4.913   8.235
  586   2HG   MET  72          1HG       MET  72  12.499  -4.564   9.371
  587   1HE   MET  72          1HE       MET  72  13.206  -2.328   9.454
  588   2HE   MET  72          2HE       MET  72  13.980  -1.458   8.129
  589   3HE   MET  72          3HE       MET  72  14.665  -2.979   8.703
  590    H    LYS  73           H        LYS  73  10.473  -7.624   9.177
  591    HA   LYS  73           HA       LYS  73  10.556  -9.986   7.446
  592   1HB   LYS  73          2HB       LYS  73   8.922 -11.089   9.093
  593   2HB   LYS  73          1HB       LYS  73  10.628 -11.075   9.509
  594   1HG   LYS  73          2HG       LYS  73  10.088 -10.190  11.461
  595   2HG   LYS  73          1HG       LYS  73   9.557  -8.736  10.618
  596   1HD   LYS  73          2HD       LYS  73   7.564  -9.189  11.555
  597   2HD   LYS  73          1HD       LYS  73   7.416 -10.371  10.251
  598   1HE   LYS  73          2HE       LYS  73   8.557 -10.960  12.982
  599   2HE   LYS  73          1HE       LYS  73   6.892 -11.287  12.500
  600   1HZ   LYS  73          1HZ       LYS  73   7.652 -12.827  10.859
  601   2HZ   LYS  73          2HZ       LYS  73   8.382 -13.235  12.328
  602   3HZ   LYS  73          3HZ       LYS  73   9.272 -12.429  11.140
  603    H    SER  74           H        SER  74   8.415  -7.752   9.236
  604    HA   SER  74           HA       SER  74   6.198  -8.263   7.477
  605   1HB   SER  74          2HB       SER  74   6.226  -5.830   9.198
  606   2HB   SER  74          1HB       SER  74   4.939  -7.002   8.925
  607    HG   SER  74           HG       SER  74   5.841  -8.351  10.390
  608    H    LEU  75           H        LEU  75   5.056  -6.275   6.478
  609    HA   LEU  75           HA       LEU  75   7.064  -4.833   4.893
  610   1HB   LEU  75          2HB       LEU  75   4.199  -5.590   4.393
  611   2HB   LEU  75          1HB       LEU  75   4.972  -4.329   3.457
  612    HG   LEU  75           HG       LEU  75   4.966  -6.511   2.309
  613   1HD1  LEU  75          1HD1      LEU  75   7.692  -5.477   3.072
  614   2HD1  LEU  75          2HD1      LEU  75   6.678  -4.899   1.750
  615   3HD1  LEU  75          3HD1      LEU  75   7.347  -6.531   1.700
  616   1HD2  LEU  75          1HD2      LEU  75   6.987  -7.486   4.294
  617   2HD2  LEU  75          2HD2      LEU  75   6.066  -8.399   3.099
  618   3HD2  LEU  75          3HD2      LEU  75   5.264  -7.770   4.539
  619    H    ARG  76           H        ARG  76   7.454  -2.772   5.419
  620    HA   ARG  76           HA       ARG  76   5.502  -1.310   7.025
  621   1HB   ARG  76          2HB       ARG  76   8.405  -0.915   6.378
  622   2HB   ARG  76          1HB       ARG  76   7.450   0.434   6.978
  623   1HG   ARG  76          2HG       ARG  76   6.791  -1.287   8.855
  624   2HG   ARG  76          1HG       ARG  76   8.302  -2.057   8.362
  625   1HD   ARG  76          2HD       ARG  76   9.063  -0.632   9.993
  626   2HD   ARG  76          1HD       ARG  76   9.249   0.379   8.560
  627    HE   ARG  76           HE       ARG  76   6.710   0.691   9.881
  628   1HH1  ARG  76          1HH1      ARG  76  10.044   1.768   9.792
  629   2HH1  ARG  76          2HH1      ARG  76   9.697   3.294  10.533
  630   1HH2  ARG  76          1HH2      ARG  76   6.265   2.707  10.859
  631   2HH2  ARG  76          2HH2      ARG  76   7.557   3.825  11.139
  632    H    ILE  77           H        ILE  77   3.934  -0.964   5.376
  633    HA   ILE  77           HA       ILE  77   4.734   0.942   3.275
  634    HB   ILE  77           HB       ILE  77   2.214  -0.720   3.362
  635   1HG1  ILE  77          2HG1      ILE  77   4.106  -1.439   1.287
  636   2HG1  ILE  77          1HG1      ILE  77   4.823  -1.628   2.884
  637   1HG2  ILE  77          1HG2      ILE  77   2.538  -0.125   0.786
  638   2HG2  ILE  77          2HG2      ILE  77   3.337   1.280   1.490
  639   3HG2  ILE  77          3HG2      ILE  77   1.660   0.921   1.901
  640   1HD1  ILE  77          1HD1      ILE  77   3.677  -3.649   1.937
  641   2HD1  ILE  77          2HD1      ILE  77   2.155  -2.783   2.145
  642   3HD1  ILE  77          3HD1      ILE  77   3.155  -3.157   3.549
  643    H    LEU  78           H        LEU  78   4.002   2.971   3.357
  644    HA   LEU  78           HA       LEU  78   1.855   3.599   5.276
  645   1HB   LEU  78          2HB       LEU  78   2.852   5.846   5.438
  646   2HB   LEU  78          1HB       LEU  78   3.946   4.579   5.959
  647    HG   LEU  78           HG       LEU  78   4.261   5.312   3.135
  648   1HD1  LEU  78          1HD1      LEU  78   4.888   7.481   3.297
  649   2HD1  LEU  78          2HD1      LEU  78   5.411   7.322   4.974
  650   3HD1  LEU  78          3HD1      LEU  78   3.695   7.469   4.596
  651   1HD2  LEU  78          1HD2      LEU  78   6.510   4.967   3.574
  652   2HD2  LEU  78          2HD2      LEU  78   5.725   3.857   4.696
  653   3HD2  LEU  78          3HD2      LEU  78   6.351   5.403   5.275
  654    H    LEU  79           H        LEU  79   0.003   4.340   4.470
  655    HA   LEU  79           HA       LEU  79   0.030   5.475   1.751
  656   1HB   LEU  79          2HB       LEU  79  -2.371   4.792   1.630
  657   2HB   LEU  79          1HB       LEU  79  -1.229   3.466   1.695
  658    HG   LEU  79           HG       LEU  79  -1.814   3.668   4.318
  659   1HD1  LEU  79          1HD1      LEU  79  -4.557   3.981   3.336
  660   2HD1  LEU  79          2HD1      LEU  79  -3.594   5.460   3.309
  661   3HD1  LEU  79          3HD1      LEU  79  -3.801   4.570   4.817
  662   1HD2  LEU  79          1HD2      LEU  79  -2.821   1.646   4.052
  663   2HD2  LEU  79          2HD2      LEU  79  -2.085   1.793   2.456
  664   3HD2  LEU  79          3HD2      LEU  79  -3.791   2.183   2.680
  665    H    LEU  80           H        LEU  80  -0.696   7.484   1.443
  666    HA   LEU  80           HA       LEU  80  -2.037   8.829   3.700
  667   1HB   LEU  80          2HB       LEU  80  -0.258  10.218   1.710
  668   2HB   LEU  80          1HB       LEU  80  -0.844  10.825   3.247
  669    HG   LEU  80           HG       LEU  80   0.567   8.731   4.149
  670   1HD1  LEU  80          1HD1      LEU  80   2.474   9.587   2.071
  671   2HD1  LEU  80          2HD1      LEU  80   1.185   8.507   1.542
  672   3HD1  LEU  80          3HD1      LEU  80   2.263   8.018   2.848
  673   1HD2  LEU  80          1HD2      LEU  80   2.187  10.261   4.849
  674   2HD2  LEU  80          2HD2      LEU  80   0.739  11.243   4.628
  675   3HD2  LEU  80          3HD2      LEU  80   2.008  11.257   3.401
  676    H    SER  81           H        SER  81  -3.578  10.437   3.207
  677    HA   SER  81           HA       SER  81  -4.866  10.045   0.605
  678   1HB   SER  81          2HB       SER  81  -6.066   9.842   2.919
  679   2HB   SER  81          1HB       SER  81  -6.099  11.605   2.857
  680    HG   SER  81           HG       SER  81  -7.973  10.794   1.916
  681    H    GLN  82           H        GLN  82  -5.485  11.759  -0.714
  682    HA   GLN  82           HA       GLN  82  -3.845  14.136  -0.417
  683   1HB   GLN  82          2HB       GLN  82  -4.376  14.631  -2.727
  684   2HB   GLN  82          1HB       GLN  82  -3.862  12.957  -2.586
  685   1HG   GLN  82          2HG       GLN  82  -6.643  12.911  -2.297
  686   2HG   GLN  82          1HG       GLN  82  -6.315  14.036  -3.615
  687   1HE2  GLN  82          1HE2      GLN  82  -4.924  10.964  -2.492
  688   2HE2  GLN  82          2HE2      GLN  82  -4.970  10.183  -4.032
  689    H    ASP  83           H        ASP  83  -6.643  13.354   0.829
  690    HA   ASP  83           HA       ASP  83  -8.147  15.735   0.147
  691   1HB   ASP  83          2HB       ASP  83  -8.858  13.615   2.179
  692   2HB   ASP  83          1HB       ASP  83  -9.938  14.802   1.460
  693    H    ARG  84           H        ARG  84  -6.866  17.396   0.985
  694    HA   ARG  84           HA       ARG  84  -6.235  18.946   2.516
  695   1HB   ARG  84          2HB       ARG  84  -8.119  17.362   4.260
  696   2HB   ARG  84          1HB       ARG  84  -7.295  18.810   4.821
  697   1HG   ARG  84          2HG       ARG  84  -8.421  20.169   3.226
  698   2HG   ARG  84          1HG       ARG  84  -9.063  18.756   2.387
  699   1HD   ARG  84          2HD       ARG  84 -10.904  19.160   3.612
  700   2HD   ARG  84          1HD       ARG  84 -10.012  18.330   4.886
  701    HE   ARG  84           HE       ARG  84  -9.266  20.941   5.137
  702   1HH1  ARG  84          1HH1      ARG  84 -12.342  19.266   5.123
  703   2HH1  ARG  84          2HH1      ARG  84 -13.116  20.423   6.152
  704   1HH2  ARG  84          1HH2      ARG  84 -10.296  22.460   6.502
  705   2HH2  ARG  84          2HH2      ARG  84 -11.958  22.234   6.932
  706    H    ASN  85           H        ASN  85  -4.092  18.738   2.809
  707    HA   ASN  85           HA       ASN  85  -3.172  16.909   4.931
  708   1HB   ASN  85          2HB       ASN  85  -2.625  16.121   2.571
  709   2HB   ASN  85          1HB       ASN  85  -1.567  17.523   2.444
  710   1HD2  ASN  85          1HD2      ASN  85   0.485  17.146   2.905
  711   2HD2  ASN  85          2HD2      ASN  85   1.078  15.911   3.959
  712    H    LEU  86           H        LEU  86  -1.220  17.569   6.032
  713    HA   LEU  86           HA       LEU  86  -0.781  20.486   5.954
  714   1HB   LEU  86          2HB       LEU  86  -1.523  18.823   8.095
  715   2HB   LEU  86          1HB       LEU  86   0.162  19.220   8.375
  716    HG   LEU  86           HG       LEU  86  -0.452  21.647   8.142
  717   1HD1  LEU  86          1HD1      LEU  86  -2.438  21.899   7.075
  718   2HD1  LEU  86          2HD1      LEU  86  -3.038  21.878   8.733
  719   3HD1  LEU  86          3HD1      LEU  86  -3.118  20.417   7.749
  720   1HD2  LEU  86          1HD2      LEU  86  -1.853  20.123  10.335
  721   2HD2  LEU  86          2HD2      LEU  86  -1.366  21.817  10.383
  722   3HD2  LEU  86          3HD2      LEU  86  -0.142  20.549  10.317
  723    H    GLU  87           H        GLU  87   1.428  21.163   6.744
  724    HA   GLU  87           HA       GLU  87   3.421  19.936   5.148
  725   1HB   GLU  87          2HB       GLU  87   3.805  21.935   7.389
  726   2HB   GLU  87          1HB       GLU  87   4.962  21.561   6.118
  727   1HG   GLU  87          2HG       GLU  87   2.948  22.288   4.568
  728   2HG   GLU  87          1HG       GLU  87   2.473  23.176   6.014
  729    H    HIS  88           H        HIS  88   3.494  20.398   8.700
  730    HA   HIS  88           HA       HIS  88   3.955  17.706   9.336
  731   1HB   HIS  88          2HB       HIS  88   6.342  17.749   9.917
  732   2HB   HIS  88          1HB       HIS  88   6.101  18.009   8.196
  733    HD1  HIS  88           HD1      HIS  88   8.119  19.192  10.813
  734    HD2  HIS  88           HD2      HIS  88   6.042  21.063   7.739
  735    HE1  HIS  88           HE1      HIS  88   9.198  21.449  10.548
  736    HE2  HIS  88           HE2      HIS  88   7.823  22.616   8.788
  737    H    HIS  89           H        HIS  89   3.045  17.648  11.275
  738    HA   HIS  89           HA       HIS  89   3.986  19.445  13.356
  739   1HB   HIS  89          2HB       HIS  89   1.786  20.256  12.046
  740   2HB   HIS  89          1HB       HIS  89   1.028  19.188  13.224
  741    HD1  HIS  89           HD1      HIS  89   4.009  21.419  13.909
  742    HD2  HIS  89           HD2      HIS  89  -0.017  21.096  14.894
  743    HE1  HIS  89           HE1      HIS  89   3.618  23.132  15.706
  744    HE2  HIS  89           HE2      HIS  89   1.148  23.010  16.186
  745    H    HIS  90           H        HIS  90   3.421  18.756  15.505
  746    HA   HIS  90           HA       HIS  90   3.242  17.203  17.151
  747   1HB   HIS  90          2HB       HIS  90   1.060  16.534  15.280
  748   2HB   HIS  90          1HB       HIS  90   1.530  15.230  16.363
  749    HD1  HIS  90           HD1      HIS  90   1.560  18.846  17.432
  750    HD2  HIS  90           HD2      HIS  90  -0.719  15.410  17.961
  751    HE1  HIS  90           HE1      HIS  90  -0.074  19.395  19.264
  752    HE2  HIS  90           HE2      HIS  90  -1.390  17.278  19.619
  753    H    HIS  91           H        HIS  91   5.293  16.887  15.097
  754    HA   HIS  91           HA       HIS  91   5.944  14.086  15.610
  755   1HB   HIS  91          2HB       HIS  91   4.888  14.545  13.241
  756   2HB   HIS  91          1HB       HIS  91   6.485  15.181  12.868
  757    HD1  HIS  91           HD1      HIS  91   6.205  13.040  11.129
  758    HD2  HIS  91           HD2      HIS  91   6.975  12.208  15.127
  759    HE1  HIS  91           HE1      HIS  91   7.082  10.685  11.167
  760    HE2  HIS  91           HE2      HIS  91   7.614  10.229  13.587
  761    H    HIS  92           H        HIS  92   7.335  15.207  17.179
  762    HA   HIS  92           HA       HIS  92   9.802  16.203  15.907
  763   1HB   HIS  92          2HB       HIS  92   8.601  17.177  18.512
  764   2HB   HIS  92          1HB       HIS  92  10.112  17.733  17.804
  765    HD1  HIS  92           HD1      HIS  92   6.915  18.975  18.244
  766    HD2  HIS  92           HD2      HIS  92   9.320  18.605  14.872
  767    HE1  HIS  92           HE1      HIS  92   6.018  20.645  16.590
  768    HE2  HIS  92           HE2      HIS  92   7.461  20.373  14.541
  769    H    HIS  93           H        HIS  93  11.696  15.360  16.619
  770    HA   HIS  93           HA       HIS  93  11.922  13.990  19.139
  771   1HB   HIS  93          2HB       HIS  93  10.816  12.378  17.407
  772   2HB   HIS  93          1HB       HIS  93  12.438  12.266  16.733
  773    HD1  HIS  93           HD1      HIS  93  14.201  10.979  18.098
  774    HD2  HIS  93           HD2      HIS  93  10.460  11.133  19.900
  775    HE1  HIS  93           HE1      HIS  93  14.280   9.287  19.956
  776    HE2  HIS  93           HE2      HIS  93  12.048   9.481  21.104
  Start of MODEL    5
    1    H    GLN   1           H        GLN   1   2.143 -22.410   1.054
    2    HA   GLN   1           HA       GLN   1   0.120 -21.127   1.066
    3   1HB   GLN   1          2HB       GLN   1  -0.392 -22.611   3.358
    4   2HB   GLN   1          1HB       GLN   1  -0.058 -21.001   3.980
    5   1HG   GLN   1          2HG       GLN   1  -2.349 -20.989   3.649
    6   2HG   GLN   1          1HG       GLN   1  -1.724 -20.186   2.208
    7   1HE2  GLN   1          1HE2      GLN   1  -3.525 -22.810   3.428
    8   2HE2  GLN   1          2HE2      GLN   1  -3.848 -23.590   1.922
    9    H    SER   2           H        SER   2   1.688 -19.677   0.366
   10    HA   SER   2           HA       SER   2   3.434 -18.436   2.342
   11   1HB   SER   2          2HB       SER   2   3.966 -19.110  -0.197
   12   2HB   SER   2          1HB       SER   2   3.401 -17.461  -0.473
   13    HG   SER   2           HG       SER   2   4.993 -16.729   0.962
   14    H    ASP   3           H        ASP   3   1.685 -17.436   3.525
   15    HA   ASP   3           HA       ASP   3   0.338 -15.225   2.173
   16   1HB   ASP   3          2HB       ASP   3  -0.882 -15.019   4.401
   17   2HB   ASP   3          1HB       ASP   3  -1.195 -16.469   3.461
   18    H    VAL   4           H        VAL   4   1.682 -13.545   1.979
   19    HA   VAL   4           HA       VAL   4   3.568 -12.788   4.002
   20    HB   VAL   4           HB       VAL   4   2.663 -11.154   1.623
   21   1HG1  VAL   4          1HG1      VAL   4   4.670  -9.916   1.897
   22   2HG1  VAL   4          2HG1      VAL   4   5.288 -11.051   3.096
   23   3HG1  VAL   4          3HG1      VAL   4   3.919 -10.013   3.489
   24   1HG2  VAL   4          1HG2      VAL   4   4.010 -12.328   0.244
   25   2HG2  VAL   4          2HG2      VAL   4   3.762 -13.617   1.421
   26   3HG2  VAL   4          3HG2      VAL   4   5.216 -12.622   1.494
   27    H    ARG   5           H        ARG   5   3.300 -11.420   5.659
   28    HA   ARG   5           HA       ARG   5   0.685 -10.215   6.064
   29   1HB   ARG   5          2HB       ARG   5   3.056 -10.776   7.785
   30   2HB   ARG   5          1HB       ARG   5   1.979  -9.475   8.267
   31   1HG   ARG   5          2HG       ARG   5   0.351 -10.879   8.900
   32   2HG   ARG   5          1HG       ARG   5   0.633 -11.981   7.551
   33   1HD   ARG   5          2HD       ARG   5   2.895 -12.113   9.242
   34   2HD   ARG   5          1HD       ARG   5   1.468 -12.217  10.270
   35    HE   ARG   5           HE       ARG   5   0.935 -13.961   8.261
   36   1HH1  ARG   5          1HH1      ARG   5   3.629 -13.576  10.459
   37   2HH1  ARG   5          2HH1      ARG   5   4.019 -15.263  10.473
   38   1HH2  ARG   5          1HH2      ARG   5   1.453 -16.181   8.275
   39   2HH2  ARG   5          2HH2      ARG   5   2.783 -16.742   9.230
   40    H    ILE   6           H        ILE   6   0.296  -8.280   5.206
   41    HA   ILE   6           HA       ILE   6   2.503  -6.371   4.902
   42    HB   ILE   6           HB       ILE   6  -0.290  -6.098   3.788
   43   1HG1  ILE   6          2HG1      ILE   6   2.119  -7.070   2.250
   44   2HG1  ILE   6          1HG1      ILE   6   0.988  -8.181   3.016
   45   1HG2  ILE   6          1HG2      ILE   6   2.319  -4.695   3.281
   46   2HG2  ILE   6          2HG2      ILE   6   0.776  -4.003   3.783
   47   3HG2  ILE   6          3HG2      ILE   6   0.973  -4.624   2.145
   48   1HD1  ILE   6          1HD1      ILE   6   0.566  -6.357   0.696
   49   2HD1  ILE   6          2HD1      ILE   6  -0.805  -6.887   1.670
   50   3HD1  ILE   6          3HD1      ILE   6   0.210  -8.076   0.853
   51    H    LYS   7           H        LYS   7   2.708  -4.678   6.212
   52    HA   LYS   7           HA       LYS   7   0.527  -4.078   8.074
   53   1HB   LYS   7          2HB       LYS   7   3.483  -3.491   8.121
   54   2HB   LYS   7          1HB       LYS   7   2.361  -2.710   9.229
   55   1HG   LYS   7          2HG       LYS   7   1.630  -5.089   9.854
   56   2HG   LYS   7          1HG       LYS   7   3.112  -5.605   9.047
   57   1HD   LYS   7          2HD       LYS   7   4.419  -4.872  10.721
   58   2HD   LYS   7          1HD       LYS   7   3.486  -3.389  10.925
   59   1HE   LYS   7          2HE       LYS   7   1.706  -5.084  11.914
   60   2HE   LYS   7          1HE       LYS   7   3.151  -6.047  12.218
   61   1HZ   LYS   7          1HZ       LYS   7   3.903  -4.601  13.769
   62   2HZ   LYS   7          2HZ       LYS   7   2.253  -4.270  13.937
   63   3HZ   LYS   7          3HZ       LYS   7   3.231  -3.239  13.020
   64    H    PHE   8           H        PHE   8  -0.765  -2.435   7.622
   65    HA   PHE   8           HA       PHE   8   0.227  -0.251   5.916
   66   1HB   PHE   8          2HB       PHE   8  -2.621  -1.100   6.494
   67   2HB   PHE   8          1HB       PHE   8  -2.144   0.218   5.430
   68    HD1  PHE   8           HD2      PHE   8  -2.160  -3.435   5.864
   69    HD2  PHE   8           HD1      PHE   8  -1.379  -0.198   3.212
   70    HE1  PHE   8           HE2      PHE   8  -2.046  -5.010   3.980
   71    HE2  PHE   8           HE1      PHE   8  -1.263  -1.771   1.323
   72    HZ   PHE   8           HZ       PHE   8  -1.596  -4.180   1.706
   73    H    GLU   9           H        GLU   9  -0.084   1.901   6.502
   74    HA   GLU   9           HA       GLU   9  -1.018   2.365   9.256
   75   1HB   GLU   9          2HB       GLU   9   1.574   2.958   8.054
   76   2HB   GLU   9          1HB       GLU   9   0.825   4.379   8.769
   77   1HG   GLU   9          2HG       GLU   9   0.506   3.042  10.863
   78   2HG   GLU   9          1HG       GLU   9   1.488   1.779  10.126
   79    H    HIS  10           H        HIS  10  -2.586   3.815   9.437
   80    HA   HIS  10           HA       HIS  10  -2.808   5.985   7.486
   81   1HB   HIS  10          2HB       HIS  10  -4.272   4.128   6.704
   82   2HB   HIS  10          1HB       HIS  10  -5.136   4.199   8.235
   83    HD1  HIS  10           HD1      HIS  10  -7.367   5.083   7.583
   84    HD2  HIS  10           HD2      HIS  10  -4.262   7.277   5.907
   85    HE1  HIS  10           HE1      HIS  10  -8.462   7.041   6.451
   86    HE2  HIS  10           HE2      HIS  10  -6.553   8.427   5.572
   87    H    ASN  11           H        ASN  11  -2.854   7.811   8.611
   88    HA   ASN  11           HA       ASN  11  -3.196   9.343  10.256
   89   1HB   ASN  11          2HB       ASN  11  -5.684   7.668  10.463
   90   2HB   ASN  11          1HB       ASN  11  -5.411   9.009  11.569
   91   1HD2  ASN  11          1HD2      ASN  11  -4.927  11.122  10.536
   92   2HD2  ASN  11          2HD2      ASN  11  -5.773  11.512   9.081
   93    H    GLY  12           H        GLY  12  -1.506   7.102  10.897
   94   1HA   GLY  12          2HA       GLY  12  -0.265   6.771  12.878
   95   2HA   GLY  12          1HA       GLY  12  -1.662   7.284  13.814
   96    H    GLU  13           H        GLU  13  -3.579   5.552  12.587
   97    HA   GLU  13           HA       GLU  13  -3.239   3.237  14.165
   98   1HB   GLU  13          2HB       GLU  13  -5.222   4.179  12.152
   99   2HB   GLU  13          1HB       GLU  13  -5.208   2.463  12.533
  100   1HG   GLU  13          2HG       GLU  13  -5.615   2.921  14.857
  101   2HG   GLU  13          1HG       GLU  13  -5.469   4.656  14.577
  102    H    ARG  14           H        ARG  14  -2.968   1.051  13.545
  103    HA   ARG  14           HA       ARG  14  -1.733   0.657  10.902
  104   1HB   ARG  14          2HB       ARG  14  -0.214  -1.015  11.979
  105   2HB   ARG  14          1HB       ARG  14   0.066   0.646  12.481
  106   1HG   ARG  14          2HG       ARG  14   0.146  -0.342  14.513
  107   2HG   ARG  14          1HG       ARG  14  -1.593  -0.067  14.427
  108   1HD   ARG  14          2HD       ARG  14  -0.766  -2.579  13.195
  109   2HD   ARG  14          1HD       ARG  14  -0.360  -2.480  14.908
  110    HE   ARG  14           HE       ARG  14  -2.947  -2.822  13.791
  111   1HH1  ARG  14          1HH1      ARG  14  -1.274  -1.281  16.451
  112   2HH1  ARG  14          2HH1      ARG  14  -2.657  -1.293  17.492
  113   1HH2  ARG  14          1HH2      ARG  14  -4.771  -2.828  15.160
  114   2HH2  ARG  14          2HH2      ARG  14  -4.645  -2.172  16.758
  115    H    ARG  15           H        ARG  15  -1.839  -1.528  10.051
  116    HA   ARG  15           HA       ARG  15  -3.718  -3.355  11.308
  117   1HB   ARG  15          2HB       ARG  15  -4.641  -1.553   9.386
  118   2HB   ARG  15          1HB       ARG  15  -4.429  -3.062   8.509
  119   1HG   ARG  15          2HG       ARG  15  -5.689  -3.937  10.743
  120   2HG   ARG  15          1HG       ARG  15  -6.389  -2.326  10.559
  121   1HD   ARG  15          2HD       ARG  15  -6.994  -2.860   8.247
  122   2HD   ARG  15          1HD       ARG  15  -6.302  -4.472   8.439
  123    HE   ARG  15           HE       ARG  15  -8.163  -4.207  10.452
  124   1HH1  ARG  15          1HH1      ARG  15  -8.200  -4.122   6.953
  125   2HH1  ARG  15          2HH1      ARG  15  -9.832  -4.689   6.835
  126   1HH2  ARG  15          1HH2      ARG  15 -10.306  -4.959  10.293
  127   2HH2  ARG  15          2HH2      ARG  15 -11.027  -5.165   8.733
  128    H    ILE  16           H        ILE  16  -3.438  -5.477  10.714
  129    HA   ILE  16           HA       ILE  16  -1.224  -6.008   8.840
  130    HB   ILE  16           HB       ILE  16  -2.086  -7.795  11.117
  131   1HG1  ILE  16          2HG1      ILE  16   0.375  -6.812  11.831
  132   2HG1  ILE  16          1HG1      ILE  16  -0.379  -5.396  11.106
  133   1HG2  ILE  16          1HG2      ILE  16   0.201  -7.810   9.179
  134   2HG2  ILE  16          2HG2      ILE  16  -0.936  -9.100   9.570
  135   3HG2  ILE  16          3HG2      ILE  16   0.309  -8.642  10.731
  136   1HD1  ILE  16          1HD1      ILE  16  -2.128  -6.819  12.950
  137   2HD1  ILE  16          2HD1      ILE  16  -1.738  -5.103  12.844
  138   3HD1  ILE  16          3HD1      ILE  16  -0.656  -6.201  13.699
  139    H    ILE  17           H        ILE  17  -1.813  -6.975   7.005
  140    HA   ILE  17           HA       ILE  17  -4.101  -8.834   7.059
  141    HB   ILE  17           HB       ILE  17  -3.448  -7.000   4.747
  142   1HG1  ILE  17          2HG1      ILE  17  -6.002  -6.542   6.060
  143   2HG1  ILE  17          1HG1      ILE  17  -4.655  -6.279   7.161
  144   1HG2  ILE  17          1HG2      ILE  17  -6.094  -8.280   5.038
  145   2HG2  ILE  17          2HG2      ILE  17  -4.749  -9.341   4.625
  146   3HG2  ILE  17          3HG2      ILE  17  -5.136  -7.967   3.592
  147   1HD1  ILE  17          1HD1      ILE  17  -3.699  -4.652   5.691
  148   2HD1  ILE  17          2HD1      ILE  17  -5.392  -4.245   5.969
  149   3HD1  ILE  17          3HD1      ILE  17  -4.904  -5.001   4.453
  150    H    ALA  18           H        ALA  18  -3.734 -10.791   6.202
  151    HA   ALA  18           HA       ALA  18  -1.116 -11.307   5.011
  152   1HB   ALA  18          1HB       ALA  18  -2.162 -13.754   5.214
  153   2HB   ALA  18          2HB       ALA  18  -3.135 -12.935   6.437
  154   3HB   ALA  18          3HB       ALA  18  -1.376 -12.938   6.564
  155    H    PHE  19           H        PHE  19  -0.803 -12.205   2.998
  156    HA   PHE  19           HA       PHE  19  -3.155 -12.658   1.304
  157   1HB   PHE  19          2HB       PHE  19  -0.893 -10.747   0.768
  158   2HB   PHE  19          1HB       PHE  19  -1.787 -11.479  -0.560
  159    HD1  PHE  19           HD2      PHE  19  -4.331 -11.173  -0.576
  160    HD2  PHE  19           HD1      PHE  19  -1.699  -8.839   1.821
  161    HE1  PHE  19           HE2      PHE  19  -6.065  -9.440  -0.366
  162    HE2  PHE  19           HE1      PHE  19  -3.428  -7.104   2.036
  163    HZ   PHE  19           HZ       PHE  19  -5.614  -7.401   0.941
  164    H    SER  20           H        SER  20  -3.010 -14.646   0.512
  165    HA   SER  20           HA       SER  20  -0.573 -16.132   0.510
  166   1HB   SER  20          2HB       SER  20  -1.980 -17.885  -0.643
  167   2HB   SER  20          1HB       SER  20  -2.611 -17.332   0.907
  168    HG   SER  20           HG       SER  20  -3.640 -17.021  -1.637
  169    H    ARG  21           H        ARG  21   0.699 -16.804  -1.203
  170    HA   ARG  21           HA       ARG  21   0.387 -15.241  -3.667
  171   1HB   ARG  21          2HB       ARG  21   2.673 -16.165  -2.093
  172   2HB   ARG  21          1HB       ARG  21   2.855 -16.469  -3.816
  173   1HG   ARG  21          2HG       ARG  21   3.633 -14.387  -3.918
  174   2HG   ARG  21          1HG       ARG  21   1.944 -13.895  -3.785
  175   1HD   ARG  21          2HD       ARG  21   2.760 -12.684  -2.055
  176   2HD   ARG  21          1HD       ARG  21   2.493 -14.197  -1.191
  177    HE   ARG  21           HE       ARG  21   4.745 -14.350  -0.892
  178   1HH1  ARG  21          1HH1      ARG  21   4.165 -12.235  -3.623
  179   2HH1  ARG  21          2HH1      ARG  21   5.833 -11.802  -3.801
  180   1HH2  ARG  21          1HH2      ARG  21   6.942 -13.781  -1.131
  181   2HH2  ARG  21          2HH2      ARG  21   7.412 -12.682  -2.386
  182    HA   PRO  22           HA       PRO  22   1.672 -15.368  -5.658
  183   1HB   PRO  22          2HB       PRO  22   0.222 -15.847  -8.132
  184   2HB   PRO  22          1HB       PRO  22   1.964 -15.778  -7.862
  185   1HG   PRO  22          2HG       PRO  22   0.655 -18.073  -8.494
  186   2HG   PRO  22          1HG       PRO  22   2.133 -18.038  -7.517
  187   1HD   PRO  22          2HD       PRO  22  -0.719 -18.298  -6.629
  188   2HD   PRO  22          1HD       PRO  22   0.725 -19.157  -6.049
  189    H    VAL  23           H        VAL  23   0.809 -13.353  -5.638
  190    HA   VAL  23           HA       VAL  23  -2.120 -13.099  -5.833
  191    HB   VAL  23           HB       VAL  23  -1.428 -12.958  -3.474
  192   1HG1  VAL  23          1HG1      VAL  23   0.830 -12.115  -3.758
  193   2HG1  VAL  23          2HG1      VAL  23  -0.088 -11.058  -2.689
  194   3HG1  VAL  23          3HG1      VAL  23   0.202 -10.581  -4.361
  195   1HG2  VAL  23          1HG2      VAL  23  -3.386 -11.742  -4.041
  196   2HG2  VAL  23          2HG2      VAL  23  -2.446 -10.421  -4.734
  197   3HG2  VAL  23          3HG2      VAL  23  -2.426 -10.700  -2.993
  198    H    LYS  24           H        LYS  24  -2.914 -11.268  -6.846
  199    HA   LYS  24           HA       LYS  24  -0.976  -9.813  -8.477
  200   1HB   LYS  24          2HB       LYS  24  -3.827 -10.528  -8.711
  201   2HB   LYS  24          1HB       LYS  24  -3.424  -8.921  -9.299
  202   1HG   LYS  24          2HG       LYS  24  -3.360 -10.590 -11.078
  203   2HG   LYS  24          1HG       LYS  24  -1.776  -9.857 -10.813
  204   1HD   LYS  24          2HD       LYS  24  -2.361 -12.329  -9.294
  205   2HD   LYS  24          1HD       LYS  24  -2.161 -12.506 -11.039
  206   1HE   LYS  24          2HE       LYS  24  -0.110 -10.789 -10.029
  207   2HE   LYS  24          1HE       LYS  24  -0.156 -12.260  -9.058
  208   1HZ   LYS  24          1HZ       LYS  24  -0.269 -13.355 -11.434
  209   2HZ   LYS  24          2HZ       LYS  24   1.208 -12.927 -10.731
  210   3HZ   LYS  24          3HZ       LYS  24   0.502 -11.918 -11.889
  211    H    TYR  25           H        TYR  25  -0.732  -7.600  -8.472
  212    HA   TYR  25           HA       TYR  25  -1.120  -6.225  -6.061
  213   1HB   TYR  25          2HB       TYR  25   0.615  -5.588  -7.681
  214   2HB   TYR  25          1HB       TYR  25  -0.624  -5.076  -8.820
  215    HD1  TYR  25           HD2      TYR  25   0.216  -4.442  -5.223
  216    HD2  TYR  25           HD1      TYR  25  -0.916  -2.792  -8.980
  217    HE1  TYR  25           HE2      TYR  25   0.250  -2.191  -4.238
  218    HE2  TYR  25           HE1      TYR  25  -0.882  -0.535  -8.003
  219    HH   TYR  25           HH       TYR  25   0.534   0.181  -5.057
  220    H    GLU  26           H        GLU  26  -3.070  -6.321  -9.011
  221    HA   GLU  26           HA       GLU  26  -4.785  -4.182  -8.463
  222   1HB   GLU  26          2HB       GLU  26  -5.017  -6.673 -10.098
  223   2HB   GLU  26          1HB       GLU  26  -6.463  -5.718  -9.807
  224   1HG   GLU  26          2HG       GLU  26  -5.848  -4.625 -11.653
  225   2HG   GLU  26          1HG       GLU  26  -4.724  -3.792 -10.579
  226    H    ASP  27           H        ASP  27  -5.046  -7.606  -7.540
  227    HA   ASP  27           HA       ASP  27  -7.556  -7.418  -6.279
  228   1HB   ASP  27          2HB       ASP  27  -5.257  -9.346  -5.922
  229   2HB   ASP  27          1HB       ASP  27  -6.778  -9.512  -5.050
  230    H    VAL  28           H        VAL  28  -4.254  -7.110  -4.990
  231    HA   VAL  28           HA       VAL  28  -5.040  -6.769  -2.287
  232    HB   VAL  28           HB       VAL  28  -2.507  -5.720  -3.560
  233   1HG1  VAL  28          1HG1      VAL  28  -2.608  -4.804  -1.432
  234   2HG1  VAL  28          2HG1      VAL  28  -1.684  -6.284  -1.169
  235   3HG1  VAL  28          3HG1      VAL  28  -3.395  -6.226  -0.748
  236   1HG2  VAL  28          1HG2      VAL  28  -3.365  -8.469  -2.909
  237   2HG2  VAL  28          2HG2      VAL  28  -1.741  -8.020  -2.389
  238   3HG2  VAL  28          3HG2      VAL  28  -2.187  -7.894  -4.090
  239    H    GLU  29           H        GLU  29  -4.205  -4.454  -4.851
  240    HA   GLU  29           HA       GLU  29  -4.443  -2.101  -3.362
  241   1HB   GLU  29          2HB       GLU  29  -3.741  -2.655  -5.914
  242   2HB   GLU  29          1HB       GLU  29  -5.354  -2.012  -6.181
  243   1HG   GLU  29          2HG       GLU  29  -3.985  -0.306  -4.364
  244   2HG   GLU  29          1HG       GLU  29  -2.950  -0.604  -5.759
  245    H    HIS  30           H        HIS  30  -6.879  -3.870  -5.241
  246    HA   HIS  30           HA       HIS  30  -9.003  -2.093  -4.951
  247   1HB   HIS  30          2HB       HIS  30  -8.678  -4.501  -6.179
  248   2HB   HIS  30          1HB       HIS  30  -9.711  -4.959  -4.831
  249    HD1  HIS  30           HD1      HIS  30 -12.150  -4.533  -5.106
  250    HD2  HIS  30           HD2      HIS  30  -9.862  -2.395  -7.839
  251    HE1  HIS  30           HE1      HIS  30 -13.799  -3.471  -6.678
  252    HE2  HIS  30           HE2      HIS  30 -12.397  -2.082  -8.245
  253    H    LYS  31           H        LYS  31  -8.029  -4.805  -2.870
  254    HA   LYS  31           HA       LYS  31 -10.117  -4.469  -0.990
  255   1HB   LYS  31          2HB       LYS  31  -8.212  -6.385  -1.411
  256   2HB   LYS  31          1HB       LYS  31  -7.603  -5.603   0.042
  257   1HG   LYS  31          2HG       LYS  31  -9.506  -6.148   1.280
  258   2HG   LYS  31          1HG       LYS  31 -10.456  -6.493  -0.166
  259   1HD   LYS  31          2HD       LYS  31  -9.987  -8.641   0.284
  260   2HD   LYS  31          1HD       LYS  31  -8.406  -8.279  -0.408
  261   1HE   LYS  31          2HE       LYS  31  -7.575  -8.979   1.547
  262   2HE   LYS  31          1HE       LYS  31  -8.128  -7.432   2.187
  263   1HZ   LYS  31          1HZ       LYS  31  -9.527 -10.044   2.312
  264   2HZ   LYS  31          2HZ       LYS  31 -10.282  -8.577   2.691
  265   3HZ   LYS  31          3HZ       LYS  31  -8.960  -9.109   3.604
  266    H    VAL  32           H        VAL  32  -6.696  -3.440  -0.929
  267    HA   VAL  32           HA       VAL  32  -6.750  -2.200   1.577
  268    HB   VAL  32           HB       VAL  32  -5.075  -1.361  -0.795
  269   1HG1  VAL  32          1HG1      VAL  32  -5.101  -0.617   2.067
  270   2HG1  VAL  32          2HG1      VAL  32  -4.604   0.316   0.654
  271   3HG1  VAL  32          3HG1      VAL  32  -3.522  -0.897   1.338
  272   1HG2  VAL  32          1HG2      VAL  32  -5.109  -3.842   0.378
  273   2HG2  VAL  32          2HG2      VAL  32  -3.820  -3.019   1.254
  274   3HG2  VAL  32          3HG2      VAL  32  -3.752  -3.142  -0.502
  275    H    THR  33           H        THR  33  -7.474  -0.869  -1.634
  276    HA   THR  33           HA       THR  33  -7.839   1.797  -0.816
  277    HB   THR  33           HB       THR  33  -9.059   0.315  -3.156
  278    HG1  THR  33           HG1      THR  33  -6.711   1.884  -2.890
  279   1HG2  THR  33          1HG2      THR  33  -9.208   2.547  -4.213
  280   2HG2  THR  33          2HG2      THR  33  -8.840   3.271  -2.647
  281   3HG2  THR  33          3HG2      THR  33 -10.315   2.326  -2.858
  282    H    THR  34           H        THR  34 -10.099  -0.943  -0.977
  283    HA   THR  34           HA       THR  34 -12.395   0.629  -0.328
  284    HB   THR  34           HB       THR  34 -12.015  -2.357  -0.024
  285    HG1  THR  34           HG1      THR  34 -12.876  -0.783  -2.213
  286   1HG2  THR  34          1HG2      THR  34 -14.639  -1.147  -0.661
  287   2HG2  THR  34          2HG2      THR  34 -14.074  -1.055   1.007
  288   3HG2  THR  34          3HG2      THR  34 -14.250  -2.624   0.222
  289    H    VAL  35           H        VAL  35 -10.195  -1.404   1.587
  290    HA   VAL  35           HA       VAL  35 -11.555  -1.330   4.014
  291    HB   VAL  35           HB       VAL  35  -8.555  -1.335   3.639
  292   1HG1  VAL  35          1HG1      VAL  35  -8.467  -2.372   5.838
  293   2HG1  VAL  35          2HG1      VAL  35 -10.221  -2.261   5.978
  294   3HG1  VAL  35          3HG1      VAL  35  -9.247  -0.793   5.930
  295   1HG2  VAL  35          1HG2      VAL  35  -9.769  -3.877   4.295
  296   2HG2  VAL  35          2HG2      VAL  35  -8.668  -3.459   2.982
  297   3HG2  VAL  35          3HG2      VAL  35 -10.404  -3.228   2.783
  298    H    PHE  36           H        PHE  36  -8.986   0.889   2.879
  299    HA   PHE  36           HA       PHE  36  -9.476   2.648   5.140
  300   1HB   PHE  36          2HB       PHE  36  -7.516   2.906   2.850
  301   2HB   PHE  36          1HB       PHE  36  -7.581   3.954   4.264
  302    HD1  PHE  36           HD2      PHE  36  -7.318   2.787   6.568
  303    HD2  PHE  36           HD1      PHE  36  -6.145   1.041   2.867
  304    HE1  PHE  36           HE2      PHE  36  -5.804   1.264   7.769
  305    HE2  PHE  36           HE1      PHE  36  -4.631  -0.484   4.063
  306    HZ   PHE  36           HZ       PHE  36  -4.459  -0.373   6.517
  307    H    GLY  37           H        GLY  37 -10.247   2.524   1.724
  308   1HA   GLY  37          2HA       GLY  37 -12.102   3.754   0.867
  309   2HA   GLY  37          1HA       GLY  37 -11.783   5.004   2.058
  310    H    GLN  38           H        GLN  38 -11.930   6.486   0.260
  311    HA   GLN  38           HA       GLN  38  -9.325   6.887  -0.991
  312   1HB   GLN  38          2HB       GLN  38 -10.480   7.463  -3.180
  313   2HB   GLN  38          1HB       GLN  38 -10.395   5.755  -2.775
  314   1HG   GLN  38          2HG       GLN  38 -12.583   5.595  -3.016
  315   2HG   GLN  38          1HG       GLN  38 -12.814   6.752  -1.706
  316   1HE2  GLN  38          1HE2      GLN  38 -12.420   6.413  -5.181
  317   2HE2  GLN  38          2HE2      GLN  38 -13.180   7.907  -5.599
  318    HA   PRO  39           HA       PRO  39  -8.751   8.245  -2.672
  319   1HB   PRO  39          2HB       PRO  39  -7.278  10.431  -3.068
  320   2HB   PRO  39          1HB       PRO  39  -8.896  10.285  -3.767
  321   1HG   PRO  39          2HG       PRO  39  -7.987  11.843  -1.393
  322   2HG   PRO  39          1HG       PRO  39  -9.215  12.252  -2.602
  323   1HD   PRO  39          2HD       PRO  39  -9.689  11.178  -0.054
  324   2HD   PRO  39          1HD       PRO  39 -10.857  11.258  -1.386
  325    H    LEU  40           H        LEU  40  -6.995   7.093  -2.111
  326    HA   LEU  40           HA       LEU  40  -5.147   8.165  -0.103
  327   1HB   LEU  40          2HB       LEU  40  -6.482   5.465  -0.017
  328   2HB   LEU  40          1HB       LEU  40  -5.002   5.813   0.859
  329    HG   LEU  40           HG       LEU  40  -7.285   7.659   1.300
  330   1HD1  LEU  40          1HD1      LEU  40  -8.726   6.065   1.856
  331   2HD1  LEU  40          2HD1      LEU  40  -7.653   5.664   3.197
  332   3HD1  LEU  40          3HD1      LEU  40  -7.509   4.802   1.665
  333   1HD2  LEU  40          1HD2      LEU  40  -5.501   6.373   3.337
  334   2HD2  LEU  40          2HD2      LEU  40  -6.339   7.922   3.409
  335   3HD2  LEU  40          3HD2      LEU  40  -4.941   7.725   2.354
  336    H    ASP  41           H        ASP  41  -3.066   7.923  -0.642
  337    HA   ASP  41           HA       ASP  41  -2.433   6.286  -2.998
  338   1HB   ASP  41          2HB       ASP  41  -1.887   8.819  -2.803
  339   2HB   ASP  41          1HB       ASP  41  -0.571   8.299  -1.754
  340    H    LEU  42           H        LEU  42  -1.031   4.598  -2.912
  341    HA   LEU  42           HA       LEU  42  -0.125   3.752  -0.273
  342   1HB   LEU  42          2HB       LEU  42   0.212   2.211  -2.837
  343   2HB   LEU  42          1HB       LEU  42   0.203   1.596  -1.197
  344    HG   LEU  42           HG       LEU  42  -2.250   2.836  -2.419
  345   1HD1  LEU  42          1HD1      LEU  42  -1.834   1.125  -3.950
  346   2HD1  LEU  42          2HD1      LEU  42  -2.922   0.385  -2.775
  347   3HD1  LEU  42          3HD1      LEU  42  -1.193   0.045  -2.712
  348   1HD2  LEU  42          1HD2      LEU  42  -1.728   0.978  -0.106
  349   2HD2  LEU  42          2HD2      LEU  42  -3.338   1.310  -0.748
  350   3HD2  LEU  42          3HD2      LEU  42  -2.379   2.616  -0.053
  351    H    HIS  43           H        HIS  43   1.739   4.705   0.325
  352    HA   HIS  43           HA       HIS  43   3.928   4.872  -1.634
  353   1HB   HIS  43          2HB       HIS  43   2.948   6.871  -0.126
  354   2HB   HIS  43          1HB       HIS  43   4.153   6.245   0.993
  355    HD1  HIS  43           HD1      HIS  43   4.949   8.876   0.328
  356    HD2  HIS  43           HD2      HIS  43   5.668   5.807  -2.380
  357    HE1  HIS  43           HE1      HIS  43   6.765   9.728  -1.189
  358    HE2  HIS  43           HE2      HIS  43   7.082   7.907  -2.901
  359    H    TYR  44           H        TYR  44   5.713   3.662  -1.398
  360    HA   TYR  44           HA       TYR  44   5.980   2.069   1.060
  361   1HB   TYR  44          2HB       TYR  44   5.747   0.655  -0.849
  362   2HB   TYR  44          1HB       TYR  44   6.900   1.602  -1.780
  363    HD1  TYR  44           HD1      TYR  44   9.327   1.489  -1.193
  364    HD2  TYR  44           HD2      TYR  44   6.459  -1.124   0.547
  365    HE1  TYR  44           HE1      TYR  44  11.135  -0.036  -0.516
  366    HE2  TYR  44           HE2      TYR  44   8.256  -2.655   1.232
  367    HH   TYR  44           HH       TYR  44  10.813  -2.386   1.740
  368    H    MET  45           H        MET  45   7.514   2.682   2.440
  369    HA   MET  45           HA       MET  45   9.986   3.883   1.381
  370   1HB   MET  45          2HB       MET  45   8.119   4.961   3.439
  371   2HB   MET  45          1HB       MET  45   9.844   5.187   3.704
  372   1HG   MET  45          2HG       MET  45  10.023   6.275   1.513
  373   2HG   MET  45          1HG       MET  45   8.286   6.080   1.287
  374   1HE   MET  45          1HE       MET  45  10.699   9.117   3.338
  375   2HE   MET  45          2HE       MET  45  10.008   9.480   1.757
  376   3HE   MET  45          3HE       MET  45  10.975   8.023   1.981
  377    H    ASN  46           H        ASN  46  11.863   3.259   2.363
  378    HA   ASN  46           HA       ASN  46  11.624   1.086   4.321
  379   1HB   ASN  46          2HB       ASN  46  13.629   1.811   2.239
  380   2HB   ASN  46          1HB       ASN  46  14.212   0.974   3.675
  381   1HD2  ASN  46          1HD2      ASN  46  13.444   0.396   0.648
  382   2HD2  ASN  46          2HD2      ASN  46  12.740  -1.178   0.770
  383    H    ASN  47           H        ASN  47  13.423   4.091   3.739
  384    HA   ASN  47           HA       ASN  47  13.372   4.886   6.442
  385   1HB   ASN  47          2HB       ASN  47  15.284   2.964   6.081
  386   2HB   ASN  47          1HB       ASN  47  16.214   4.432   5.797
  387   1HD2  ASN  47          1HD2      ASN  47  14.254   2.684   8.104
  388   2HD2  ASN  47          2HD2      ASN  47  14.806   3.531   9.505
  389    H    GLU  48           H        GLU  48  15.759   5.088   3.799
  390    HA   GLU  48           HA       GLU  48  15.458   8.016   3.852
  391   1HB   GLU  48          2HB       GLU  48  17.761   6.287   2.942
  392   2HB   GLU  48          1HB       GLU  48  17.690   8.027   2.700
  393   1HG   GLU  48          2HG       GLU  48  17.194   7.297   5.459
  394   2HG   GLU  48          1HG       GLU  48  18.748   6.698   4.880
  395    H    LEU  49           H        LEU  49  15.332   5.173   1.788
  396    HA   LEU  49           HA       LEU  49  14.918   6.802  -0.595
  397   1HB   LEU  49          2HB       LEU  49  15.518   3.945  -0.054
  398   2HB   LEU  49          1HB       LEU  49  14.608   4.308  -1.506
  399    HG   LEU  49           HG       LEU  49  17.151   5.789  -0.980
  400   1HD1  LEU  49          1HD1      LEU  49  18.483   4.073  -1.940
  401   2HD1  LEU  49          2HD1      LEU  49  17.068   3.085  -2.301
  402   3HD1  LEU  49          3HD1      LEU  49  17.565   3.337  -0.628
  403   1HD2  LEU  49          1HD2      LEU  49  16.201   6.640  -2.875
  404   2HD2  LEU  49          2HD2      LEU  49  15.415   5.120  -3.300
  405   3HD2  LEU  49          3HD2      LEU  49  17.143   5.328  -3.581
  406    H    SER  50           H        SER  50  12.995   7.148  -1.530
  407    HA   SER  50           HA       SER  50  10.644   5.806  -0.364
  408   1HB   SER  50          2HB       SER  50   9.344   7.782  -0.929
  409   2HB   SER  50          1HB       SER  50  10.749   8.263   0.020
  410    HG   SER  50           HG       SER  50  10.076   9.319  -2.191
  411    H    ILE  51           H        ILE  51   9.583   4.446  -1.642
  412    HA   ILE  51           HA       ILE  51   9.719   4.840  -4.563
  413    HB   ILE  51           HB       ILE  51   9.681   2.143  -3.209
  414   1HG1  ILE  51          2HG1      ILE  51  12.116   2.612  -4.631
  415   2HG1  ILE  51          1HG1      ILE  51  11.877   3.937  -3.500
  416   1HG2  ILE  51          1HG2      ILE  51  10.631   1.705  -5.685
  417   2HG2  ILE  51          2HG2      ILE  51   9.576   3.082  -6.000
  418   3HG2  ILE  51          3HG2      ILE  51   8.920   1.619  -5.264
  419   1HD1  ILE  51          1HD1      ILE  51  12.743   2.631  -1.940
  420   2HD1  ILE  51          2HD1      ILE  51  12.703   1.229  -3.009
  421   3HD1  ILE  51          3HD1      ILE  51  11.286   1.644  -2.045
  422    H    LEU  52           H        LEU  52   7.808   4.775  -5.615
  423    HA   LEU  52           HA       LEU  52   5.417   4.122  -4.035
  424   1HB   LEU  52          2HB       LEU  52   5.882   6.388  -5.351
  425   2HB   LEU  52          1HB       LEU  52   5.224   5.463  -6.687
  426    HG   LEU  52           HG       LEU  52   3.785   5.873  -4.064
  427   1HD1  LEU  52          1HD1      LEU  52   3.800   7.475  -6.588
  428   2HD1  LEU  52          2HD1      LEU  52   3.820   8.021  -4.911
  429   3HD1  LEU  52          3HD1      LEU  52   2.337   7.370  -5.609
  430   1HD2  LEU  52          1HD2      LEU  52   1.868   5.335  -5.835
  431   2HD2  LEU  52          2HD2      LEU  52   2.708   4.076  -4.935
  432   3HD2  LEU  52          3HD2      LEU  52   3.189   4.444  -6.590
  433    H    LEU  53           H        LEU  53   4.148   2.439  -4.554
  434    HA   LEU  53           HA       LEU  53   5.027   0.584  -6.548
  435   1HB   LEU  53          2HB       LEU  53   2.431   0.501  -5.016
  436   2HB   LEU  53          1HB       LEU  53   3.255  -0.840  -5.786
  437    HG   LEU  53           HG       LEU  53   4.521   0.668  -3.515
  438   1HD1  LEU  53          1HD1      LEU  53   3.646  -1.399  -2.187
  439   2HD1  LEU  53          2HD1      LEU  53   2.393  -1.422  -3.427
  440   3HD1  LEU  53          3HD1      LEU  53   2.611   0.009  -2.419
  441   1HD2  LEU  53          1HD2      LEU  53   5.671  -1.056  -5.142
  442   2HD2  LEU  53          2HD2      LEU  53   4.884  -2.230  -4.088
  443   3HD2  LEU  53          3HD2      LEU  53   6.017  -1.059  -3.413
  444    H    LYS  54           H        LYS  54   4.852   1.788  -8.493
  445    HA   LYS  54           HA       LYS  54   2.312   2.792  -9.380
  446   1HB   LYS  54          2HB       LYS  54   4.517   3.773 -10.044
  447   2HB   LYS  54          1HB       LYS  54   4.823   2.328 -10.996
  448   1HG   LYS  54          2HG       LYS  54   3.937   3.488 -12.679
  449   2HG   LYS  54          1HG       LYS  54   2.384   3.101 -11.936
  450   1HD   LYS  54          2HD       LYS  54   2.424   5.208 -10.715
  451   2HD   LYS  54          1HD       LYS  54   4.009   5.587 -11.391
  452   1HE   LYS  54          2HE       LYS  54   2.414   5.025 -13.602
  453   2HE   LYS  54          1HE       LYS  54   1.371   5.958 -12.530
  454   1HZ   LYS  54          1HZ       LYS  54   3.947   6.754 -13.739
  455   2HZ   LYS  54          2HZ       LYS  54   3.339   7.553 -12.379
  456   3HZ   LYS  54          3HZ       LYS  54   2.453   7.544 -13.820
  457    H    ASN  55           H        ASN  55   4.248  -0.100  -9.960
  458    HA   ASN  55           HA       ASN  55   1.899  -1.406 -11.096
  459   1HB   ASN  55          2HB       ASN  55   4.423  -0.834 -12.562
  460   2HB   ASN  55          1HB       ASN  55   3.709  -2.426 -12.798
  461   1HD2  ASN  55          1HD2      ASN  55   3.463   0.938 -13.446
  462   2HD2  ASN  55          2HD2      ASN  55   2.083   0.860 -14.480
  463    H    GLN  56           H        GLN  56   2.672  -3.829 -11.666
  464    HA   GLN  56           HA       GLN  56   3.171  -5.092  -9.229
  465   1HB   GLN  56          2HB       GLN  56   2.073  -6.158 -11.189
  466   2HB   GLN  56          1HB       GLN  56   3.631  -6.216 -12.002
  467   1HG   GLN  56          2HG       GLN  56   3.764  -8.274 -11.160
  468   2HG   GLN  56          1HG       GLN  56   4.202  -7.465  -9.656
  469   1HE2  GLN  56          1HE2      GLN  56   3.085  -8.058  -7.943
  470   2HE2  GLN  56          2HE2      GLN  56   1.490  -8.723  -7.943
  471    H    ASP  57           H        ASP  57   5.376  -4.083 -11.785
  472    HA   ASP  57           HA       ASP  57   7.671  -5.476 -11.047
  473   1HB   ASP  57          2HB       ASP  57   7.051  -3.110 -12.659
  474   2HB   ASP  57          1HB       ASP  57   8.641  -3.031 -11.907
  475    H    ASP  58           H        ASP  58   6.499  -2.315  -9.920
  476    HA   ASP  58           HA       ASP  58   8.651  -1.696  -8.224
  477   1HB   ASP  58          2HB       ASP  58   5.736  -0.906  -7.971
  478   2HB   ASP  58          1HB       ASP  58   7.067  -0.157  -7.093
  479    H    LEU  59           H        LEU  59   5.656  -3.490  -7.642
  480    HA   LEU  59           HA       LEU  59   5.971  -3.834  -4.864
  481   1HB   LEU  59          2HB       LEU  59   3.887  -4.220  -6.247
  482   2HB   LEU  59          1HB       LEU  59   4.593  -5.749  -6.739
  483    HG   LEU  59           HG       LEU  59   4.779  -6.013  -4.063
  484   1HD1  LEU  59          1HD1      LEU  59   2.121  -4.676  -4.323
  485   2HD1  LEU  59          2HD1      LEU  59   3.559  -3.717  -3.974
  486   3HD1  LEU  59          3HD1      LEU  59   3.076  -5.010  -2.879
  487   1HD2  LEU  59          1HD2      LEU  59   2.115  -6.641  -5.194
  488   2HD2  LEU  59          2HD2      LEU  59   3.253  -7.670  -4.325
  489   3HD2  LEU  59          3HD2      LEU  59   3.520  -7.306  -6.029
  490    H    ASP  60           H        ASP  60   6.984  -5.841  -7.617
  491    HA   ASP  60           HA       ASP  60   7.976  -8.014  -6.127
  492   1HB   ASP  60          2HB       ASP  60   7.766  -7.364  -8.833
  493   2HB   ASP  60          1HB       ASP  60   9.499  -7.535  -8.557
  494    H    LYS  61           H        LYS  61   9.533  -5.035  -7.244
  495    HA   LYS  61           HA       LYS  61  12.161  -5.680  -6.463
  496   1HB   LYS  61          2HB       LYS  61  11.061  -3.632  -7.829
  497   2HB   LYS  61          1HB       LYS  61  11.296  -2.848  -6.273
  498   1HG   LYS  61          2HG       LYS  61  13.538  -2.802  -6.480
  499   2HG   LYS  61          1HG       LYS  61  13.604  -4.363  -7.302
  500   1HD   LYS  61          2HD       LYS  61  12.335  -2.155  -8.801
  501   2HD   LYS  61          1HD       LYS  61  14.072  -2.006  -8.524
  502   1HE   LYS  61          2HE       LYS  61  14.572  -3.848  -9.793
  503   2HE   LYS  61          1HE       LYS  61  13.012  -4.613  -9.493
  504   1HZ   LYS  61          1HZ       LYS  61  13.454  -3.694 -11.809
  505   2HZ   LYS  61          2HZ       LYS  61  13.230  -2.161 -11.130
  506   3HZ   LYS  61          3HZ       LYS  61  11.975  -3.296 -11.089
  507    H    ALA  62           H        ALA  62   9.435  -4.295  -4.712
  508    HA   ALA  62           HA       ALA  62  10.817  -3.452  -2.409
  509   1HB   ALA  62          1HB       ALA  62   8.788  -2.908  -1.590
  510   2HB   ALA  62          2HB       ALA  62   8.070  -4.457  -2.029
  511   3HB   ALA  62          3HB       ALA  62   8.272  -3.200  -3.251
  512    H    ILE  63           H        ILE  63   9.411  -6.572  -3.308
  513    HA   ILE  63           HA       ILE  63   9.685  -7.831  -0.798
  514    HB   ILE  63           HB       ILE  63   9.821  -9.210  -3.487
  515   1HG1  ILE  63          2HG1      ILE  63   7.828  -7.824  -3.445
  516   2HG1  ILE  63          1HG1      ILE  63   7.363  -9.508  -3.230
  517   1HG2  ILE  63          1HG2      ILE  63   9.078 -10.157  -0.725
  518   2HG2  ILE  63          2HG2      ILE  63  10.455 -10.668  -1.698
  519   3HG2  ILE  63          3HG2      ILE  63   8.819 -11.095  -2.195
  520   1HD1  ILE  63          1HD1      ILE  63   6.853  -7.252  -1.549
  521   2HD1  ILE  63          2HD1      ILE  63   7.745  -8.481  -0.653
  522   3HD1  ILE  63          3HD1      ILE  63   6.222  -8.894  -1.438
  523    H    ASP  64           H        ASP  64  11.871  -7.618  -3.586
  524    HA   ASP  64           HA       ASP  64  13.864  -9.364  -2.720
  525   1HB   ASP  64          2HB       ASP  64  14.292  -6.807  -4.286
  526   2HB   ASP  64          1HB       ASP  64  15.365  -8.202  -4.243
  527    H    ILE  65           H        ILE  65  13.342  -5.955  -1.954
  528    HA   ILE  65           HA       ILE  65  15.771  -5.585  -0.536
  529    HB   ILE  65           HB       ILE  65  13.203  -4.035  -0.165
  530   1HG1  ILE  65          2HG1      ILE  65  15.496  -3.377  -2.026
  531   2HG1  ILE  65          1HG1      ILE  65  14.022  -4.178  -2.555
  532   1HG2  ILE  65          1HG2      ILE  65  14.753  -2.217   0.509
  533   2HG2  ILE  65          2HG2      ILE  65  16.085  -3.369   0.424
  534   3HG2  ILE  65          3HG2      ILE  65  14.787  -3.606   1.594
  535   1HD1  ILE  65          1HD1      ILE  65  13.409  -2.073  -3.038
  536   2HD1  ILE  65          2HD1      ILE  65  14.497  -1.365  -1.842
  537   3HD1  ILE  65          3HD1      ILE  65  12.953  -2.051  -1.333
  538    H    LEU  66           H        LEU  66  12.498  -6.514   0.453
  539    HA   LEU  66           HA       LEU  66  12.894  -6.423   3.231
  540   1HB   LEU  66          2HB       LEU  66  11.050  -8.120   1.554
  541   2HB   LEU  66          1HB       LEU  66  11.004  -8.087   3.306
  542    HG   LEU  66           HG       LEU  66  10.569  -5.663   1.561
  543   1HD1  LEU  66          1HD1      LEU  66   8.865  -7.728   1.646
  544   2HD1  LEU  66          2HD1      LEU  66   8.344  -6.049   1.521
  545   3HD1  LEU  66          3HD1      LEU  66   8.343  -6.856   3.088
  546   1HD2  LEU  66          1HD2      LEU  66   9.419  -5.078   3.906
  547   2HD2  LEU  66          2HD2      LEU  66  11.105  -4.710   3.547
  548   3HD2  LEU  66          3HD2      LEU  66  10.698  -6.150   4.477
  549    H    ASP  67           H        ASP  67  13.287  -9.116   0.930
  550    HA   ASP  67           HA       ASP  67  14.013 -11.077   2.808
  551   1HB   ASP  67          2HB       ASP  67  13.895 -10.847  -0.053
  552   2HB   ASP  67          1HB       ASP  67  15.410 -11.620   0.406
  553    H    ARG  68           H        ARG  68  15.871  -8.544   1.264
  554    HA   ARG  68           HA       ARG  68  18.458  -9.524   1.866
  555   1HB   ARG  68          2HB       ARG  68  17.290  -7.146   0.718
  556   2HB   ARG  68          1HB       ARG  68  18.568  -6.709   1.844
  557   1HG   ARG  68          2HG       ARG  68  18.847  -8.604  -0.481
  558   2HG   ARG  68          1HG       ARG  68  19.403  -6.931  -0.431
  559   1HD   ARG  68          2HD       ARG  68  20.864  -7.521   1.483
  560   2HD   ARG  68          1HD       ARG  68  20.364  -9.203   1.304
  561    HE   ARG  68           HE       ARG  68  21.439  -8.081  -1.107
  562   1HH1  ARG  68          1HH1      ARG  68  22.269  -9.622   1.925
  563   2HH1  ARG  68          2HH1      ARG  68  23.779 -10.238   1.341
  564   1HH2  ARG  68          1HH2      ARG  68  23.429  -8.890  -1.871
  565   2HH2  ARG  68          2HH2      ARG  68  24.438  -9.822  -0.814
  566    H    SER  69           H        SER  69  16.074  -7.789   3.743
  567    HA   SER  69           HA       SER  69  17.706  -6.673   5.721
  568   1HB   SER  69          2HB       SER  69  15.269  -6.194   5.398
  569   2HB   SER  69          1HB       SER  69  14.912  -7.765   6.115
  570    HG   SER  69           HG       SER  69  15.217  -6.921   8.011
  571    H    SER  70           H        SER  70  18.297  -7.357   7.794
  572    HA   SER  70           HA       SER  70  19.040 -10.098   7.990
  573   1HB   SER  70          2HB       SER  70  19.865  -7.718   9.193
  574   2HB   SER  70          1HB       SER  70  19.188  -8.668  10.515
  575    HG   SER  70           HG       SER  70  21.465  -9.085   9.025
  576    H    SER  71           H        SER  71  16.446  -8.149   9.397
  577    HA   SER  71           HA       SER  71  14.995 -10.535  10.053
  578   1HB   SER  71          2HB       SER  71  16.436  -9.042  12.134
  579   2HB   SER  71          1HB       SER  71  14.735  -9.339  12.498
  580    HG   SER  71           HG       SER  71  15.849 -11.553  11.467
  581    H    MET  72           H        MET  72  13.407  -9.812   8.729
  582    HA   MET  72           HA       MET  72  11.474  -8.053   9.861
  583   1HB   MET  72          2HB       MET  72  13.371  -6.950   7.923
  584   2HB   MET  72          1HB       MET  72  11.695  -6.727   7.448
  585   1HG   MET  72          2HG       MET  72  11.528  -5.016   8.828
  586   2HG   MET  72          1HG       MET  72  11.903  -6.068  10.190
  587   1HE   MET  72          1HE       MET  72  13.658  -2.922   8.082
  588   2HE   MET  72          2HE       MET  72  13.269  -4.394   7.191
  589   3HE   MET  72          3HE       MET  72  14.950  -3.999   7.552
  590    H    LYS  73           H        LYS  73   9.775  -9.346   9.504
  591    HA   LYS  73           HA       LYS  73   9.486 -10.646   6.890
  592   1HB   LYS  73          2HB       LYS  73   7.932 -11.117   9.444
  593   2HB   LYS  73          1HB       LYS  73   7.780 -12.042   7.957
  594   1HG   LYS  73          2HG       LYS  73  10.501 -12.120   8.615
  595   2HG   LYS  73          1HG       LYS  73   9.627 -12.369  10.129
  596   1HD   LYS  73          2HD       LYS  73   8.642 -13.866   7.773
  597   2HD   LYS  73          1HD       LYS  73  10.211 -14.355   8.416
  598   1HE   LYS  73          2HE       LYS  73   8.825 -15.684   9.665
  599   2HE   LYS  73          1HE       LYS  73   8.940 -14.271  10.713
  600   1HZ   LYS  73          1HZ       LYS  73   6.692 -15.134   9.009
  601   2HZ   LYS  73          2HZ       LYS  73   6.845 -13.508   9.450
  602   3HZ   LYS  73          3HZ       LYS  73   6.685 -14.696  10.642
  603    H    SER  74           H        SER  74   7.945  -8.289   8.992
  604    HA   SER  74           HA       SER  74   5.507  -8.117   7.516
  605   1HB   SER  74          2HB       SER  74   6.383  -5.758   9.088
  606   2HB   SER  74          1HB       SER  74   4.844  -6.616   9.102
  607    HG   SER  74           HG       SER  74   5.808  -8.222  10.375
  608    H    LEU  75           H        LEU  75   4.779  -6.050   6.465
  609    HA   LEU  75           HA       LEU  75   6.943  -4.990   4.770
  610   1HB   LEU  75          2HB       LEU  75   4.255  -5.950   4.200
  611   2HB   LEU  75          1HB       LEU  75   4.536  -4.349   3.542
  612    HG   LEU  75           HG       LEU  75   6.756  -5.488   2.646
  613   1HD1  LEU  75          1HD1      LEU  75   4.831  -7.799   2.864
  614   2HD1  LEU  75          2HD1      LEU  75   6.358  -7.632   3.732
  615   3HD1  LEU  75          3HD1      LEU  75   6.356  -7.801   1.976
  616   1HD2  LEU  75          1HD2      LEU  75   4.471  -4.603   1.519
  617   2HD2  LEU  75          2HD2      LEU  75   4.413  -6.303   1.059
  618   3HD2  LEU  75          3HD2      LEU  75   5.803  -5.315   0.611
  619    H    ARG  76           H        ARG  76   7.361  -2.860   4.744
  620    HA   ARG  76           HA       ARG  76   5.861  -1.146   6.544
  621   1HB   ARG  76          2HB       ARG  76   8.517  -1.330   6.005
  622   2HB   ARG  76          1HB       ARG  76   8.073   0.015   4.961
  623   1HG   ARG  76          2HG       ARG  76   7.030   0.169   7.705
  624   2HG   ARG  76          1HG       ARG  76   8.786   0.256   7.554
  625   1HD   ARG  76          2HD       ARG  76   8.591   2.098   5.994
  626   2HD   ARG  76          1HD       ARG  76   6.833   1.977   6.032
  627    HE   ARG  76           HE       ARG  76   8.532   3.232   7.980
  628   1HH1  ARG  76          1HH1      ARG  76   5.408   1.733   7.464
  629   2HH1  ARG  76          2HH1      ARG  76   4.654   2.564   8.783
  630   1HH2  ARG  76          1HH2      ARG  76   7.532   4.323   9.718
  631   2HH2  ARG  76          2HH2      ARG  76   5.859   4.034  10.063
  632    H    ILE  77           H        ILE  77   3.906  -1.129   5.248
  633    HA   ILE  77           HA       ILE  77   4.074   0.507   2.810
  634    HB   ILE  77           HB       ILE  77   1.690  -1.063   3.803
  635   1HG1  ILE  77          2HG1      ILE  77   3.550  -2.590   3.321
  636   2HG1  ILE  77          1HG1      ILE  77   2.275  -2.754   2.121
  637   1HG2  ILE  77          1HG2      ILE  77   2.236   0.648   1.458
  638   2HG2  ILE  77          2HG2      ILE  77   0.725   0.329   2.311
  639   3HG2  ILE  77          3HG2      ILE  77   1.347  -0.844   1.152
  640   1HD1  ILE  77          1HD1      ILE  77   4.148  -2.774   0.807
  641   2HD1  ILE  77          2HD1      ILE  77   5.016  -1.634   1.833
  642   3HD1  ILE  77          3HD1      ILE  77   3.731  -1.062   0.771
  643    H    LEU  78           H        LEU  78   3.763   2.617   3.128
  644    HA   LEU  78           HA       LEU  78   1.905   3.464   5.252
  645   1HB   LEU  78          2HB       LEU  78   4.359   4.146   5.347
  646   2HB   LEU  78          1HB       LEU  78   4.026   5.168   3.961
  647    HG   LEU  78           HG       LEU  78   2.291   5.488   6.359
  648   1HD1  LEU  78          1HD1      LEU  78   4.171   7.270   6.981
  649   2HD1  LEU  78          2HD1      LEU  78   5.202   6.017   6.291
  650   3HD1  LEU  78          3HD1      LEU  78   4.145   5.639   7.651
  651   1HD2  LEU  78          1HD2      LEU  78   3.487   7.768   4.923
  652   2HD2  LEU  78          2HD2      LEU  78   1.829   7.503   5.461
  653   3HD2  LEU  78          3HD2      LEU  78   2.407   6.744   3.979
  654    H    LEU  79           H        LEU  79  -0.015   4.143   4.547
  655    HA   LEU  79           HA       LEU  79  -0.157   5.379   1.877
  656   1HB   LEU  79          2HB       LEU  79  -2.522   4.702   1.825
  657   2HB   LEU  79          1HB       LEU  79  -1.426   3.341   1.932
  658    HG   LEU  79           HG       LEU  79  -2.008   3.767   4.568
  659   1HD1  LEU  79          1HD1      LEU  79  -4.217   4.851   2.933
  660   2HD1  LEU  79          2HD1      LEU  79  -3.725   5.236   4.581
  661   3HD1  LEU  79          3HD1      LEU  79  -4.666   3.779   4.260
  662   1HD2  LEU  79          1HD2      LEU  79  -3.061   1.713   4.469
  663   2HD2  LEU  79          2HD2      LEU  79  -2.076   1.690   3.007
  664   3HD2  LEU  79          3HD2      LEU  79  -3.799   2.049   2.903
  665    H    LEU  80           H        LEU  80  -0.842   7.413   1.689
  666    HA   LEU  80           HA       LEU  80  -2.044   8.692   4.061
  667   1HB   LEU  80          2HB       LEU  80  -0.342  10.141   2.048
  668   2HB   LEU  80          1HB       LEU  80  -0.837  10.683   3.639
  669    HG   LEU  80           HG       LEU  80   0.743   8.245   3.779
  670   1HD1  LEU  80          1HD1      LEU  80   2.862   9.182   3.098
  671   2HD1  LEU  80          2HD1      LEU  80   2.077  10.682   2.608
  672   3HD1  LEU  80          3HD1      LEU  80   1.743   9.185   1.735
  673   1HD2  LEU  80          1HD2      LEU  80   0.724  10.968   5.013
  674   2HD2  LEU  80          2HD2      LEU  80   2.111   9.903   5.241
  675   3HD2  LEU  80          3HD2      LEU  80   0.509   9.391   5.770
  676    H    SER  81           H        SER  81  -3.458  10.500   3.640
  677    HA   SER  81           HA       SER  81  -5.139  10.028   1.333
  678   1HB   SER  81          2HB       SER  81  -5.956  10.533   3.716
  679   2HB   SER  81          1HB       SER  81  -5.527  12.211   3.383
  680    HG   SER  81           HG       SER  81  -7.688  10.792   2.569
  681    H    GLN  82           H        GLN  82  -5.647  11.538  -0.270
  682    HA   GLN  82           HA       GLN  82  -3.509  13.377  -0.884
  683   1HB   GLN  82          2HB       GLN  82  -4.700  11.787  -2.535
  684   2HB   GLN  82          1HB       GLN  82  -5.975  12.996  -2.556
  685   1HG   GLN  82          2HG       GLN  82  -4.637  13.473  -4.409
  686   2HG   GLN  82          1HG       GLN  82  -4.180  14.666  -3.196
  687   1HE2  GLN  82          1HE2      GLN  82  -2.089  14.904  -2.791
  688   2HE2  GLN  82          2HE2      GLN  82  -0.843  13.785  -3.220
  689    H    ASP  83           H        ASP  83  -5.961  13.726   1.093
  690    HA   ASP  83           HA       ASP  83  -6.952  16.305   0.195
  691   1HB   ASP  83          2HB       ASP  83  -7.863  14.234   1.985
  692   2HB   ASP  83          1HB       ASP  83  -7.875  15.791   2.806
  693    H    ARG  84           H        ARG  84  -5.899  18.118   0.646
  694    HA   ARG  84           HA       ARG  84  -4.709  19.730   1.709
  695   1HB   ARG  84          2HB       ARG  84  -6.207  18.693   3.689
  696   2HB   ARG  84          1HB       ARG  84  -4.608  18.307   4.311
  697   1HG   ARG  84          2HG       ARG  84  -4.659  21.019   3.382
  698   2HG   ARG  84          1HG       ARG  84  -5.995  20.736   4.501
  699   1HD   ARG  84          2HD       ARG  84  -4.489  19.940   6.191
  700   2HD   ARG  84          1HD       ARG  84  -3.130  19.984   5.067
  701    HE   ARG  84           HE       ARG  84  -4.286  22.555   5.300
  702   1HH1  ARG  84          1HH1      ARG  84  -2.292  20.296   7.086
  703   2HH1  ARG  84          2HH1      ARG  84  -1.483  21.534   7.988
  704   1HH2  ARG  84          1HH2      ARG  84  -3.217  24.181   6.488
  705   2HH2  ARG  84          2HH2      ARG  84  -2.009  23.739   7.649
  706    H    ASN  85           H        ASN  85  -2.741  19.609   0.752
  707    HA   ASN  85           HA       ASN  85  -0.646  18.178   2.208
  708   1HB   ASN  85          2HB       ASN  85  -1.587  17.526  -0.488
  709   2HB   ASN  85          1HB       ASN  85   0.146  17.818  -0.414
  710   1HD2  ASN  85          1HD2      ASN  85   1.441  16.270   0.383
  711   2HD2  ASN  85          2HD2      ASN  85   0.889  14.794   1.091
  712    H    LEU  86           H        LEU  86  -0.317  20.445   2.881
  713    HA   LEU  86           HA       LEU  86   0.772  22.437   2.840
  714   1HB   LEU  86          2HB       LEU  86   2.397  20.732   1.003
  715   2HB   LEU  86          1HB       LEU  86   2.783  22.437   1.140
  716    HG   LEU  86           HG       LEU  86   2.494  21.101   3.732
  717   1HD1  LEU  86          1HD1      LEU  86   5.021  20.407   2.347
  718   2HD1  LEU  86          2HD1      LEU  86   3.598  19.429   1.989
  719   3HD1  LEU  86          3HD1      LEU  86   4.173  19.575   3.650
  720   1HD2  LEU  86          1HD2      LEU  86   3.428  23.166   3.947
  721   2HD2  LEU  86          2HD2      LEU  86   4.259  23.078   2.395
  722   3HD2  LEU  86          3HD2      LEU  86   4.900  22.210   3.788
  723    H    GLU  87           H        GLU  87  -1.265  23.289   1.932
  724    HA   GLU  87           HA       GLU  87  -0.706  24.877  -0.408
  725   1HB   GLU  87          2HB       GLU  87  -2.820  24.187  -1.576
  726   2HB   GLU  87          1HB       GLU  87  -1.550  22.973  -1.571
  727   1HG   GLU  87          2HG       GLU  87  -2.873  22.210   0.623
  728   2HG   GLU  87          1HG       GLU  87  -4.198  22.960  -0.265
  729    H    HIS  88           H        HIS  88  -3.319  23.826   1.791
  730    HA   HIS  88           HA       HIS  88  -4.566  26.428   1.698
  731   1HB   HIS  88          2HB       HIS  88  -5.382  23.804   2.391
  732   2HB   HIS  88          1HB       HIS  88  -5.579  24.795   3.831
  733    HD1  HIS  88           HD1      HIS  88  -7.269  26.797   3.662
  734    HD2  HIS  88           HD2      HIS  88  -7.191  24.288   0.349
  735    HE1  HIS  88           HE1      HIS  88  -9.343  27.349   2.350
  736    HE2  HIS  88           HE2      HIS  88  -9.312  25.766   0.390
  737    H    HIS  89           H        HIS  89  -4.603  27.965   3.289
  738    HA   HIS  89           HA       HIS  89  -3.896  29.219   5.042
  739   1HB   HIS  89          2HB       HIS  89  -3.702  26.459   6.214
  740   2HB   HIS  89          1HB       HIS  89  -3.170  27.860   7.136
  741    HD1  HIS  89           HD1      HIS  89  -6.066  25.845   6.573
  742    HD2  HIS  89           HD2      HIS  89  -5.391  29.881   7.296
  743    HE1  HIS  89           HE1      HIS  89  -8.264  26.759   7.381
  744    HE2  HIS  89           HE2      HIS  89  -7.801  29.177   7.917
  745    H    HIS  90           H        HIS  90  -2.144  29.850   3.578
  746    HA   HIS  90           HA       HIS  90   0.460  29.206   4.758
  747   1HB   HIS  90          2HB       HIS  90   0.163  27.835   2.694
  748   2HB   HIS  90          1HB       HIS  90  -0.033  29.321   1.773
  749    HD1  HIS  90           HD1      HIS  90   2.044  29.072   0.349
  750    HD2  HIS  90           HD2      HIS  90   2.839  28.897   4.425
  751    HE1  HIS  90           HE1      HIS  90   4.549  29.182   0.552
  752    HE2  HIS  90           HE2      HIS  90   5.001  29.160   3.030
  753    H    HIS  91           H        HIS  91   0.828  31.150   5.693
  754    HA   HIS  91           HA       HIS  91   0.889  33.491   3.913
  755   1HB   HIS  91          2HB       HIS  91  -0.638  33.137   6.323
  756   2HB   HIS  91          1HB       HIS  91   0.550  34.412   6.572
  757    HD1  HIS  91           HD1      HIS  91   0.404  35.454   3.546
  758    HD2  HIS  91           HD2      HIS  91  -2.801  34.870   6.129
  759    HE1  HIS  91           HE1      HIS  91  -1.435  36.930   2.680
  760    HE2  HIS  91           HE2      HIS  91  -3.319  36.653   4.328
  761    H    HIS  92           H        HIS  92   2.867  34.259   3.669
  762    HA   HIS  92           HA       HIS  92   4.886  33.651   5.712
  763   1HB   HIS  92          2HB       HIS  92   6.539  34.126   3.895
  764   2HB   HIS  92          1HB       HIS  92   5.478  32.766   3.554
  765    HD1  HIS  92           HD1      HIS  92   6.263  36.247   2.437
  766    HD2  HIS  92           HD2      HIS  92   3.730  33.122   1.399
  767    HE1  HIS  92           HE1      HIS  92   5.316  36.868   0.192
  768    HE2  HIS  92           HE2      HIS  92   3.657  35.046  -0.327
  769    H    HIS  93           H        HIS  93   5.924  35.200   6.793
  770    HA   HIS  93           HA       HIS  93   6.593  37.229   7.546
  771   1HB   HIS  93          2HB       HIS  93   6.539  37.546   4.714
  772   2HB   HIS  93          1HB       HIS  93   5.880  39.014   5.428
  773    HD1  HIS  93           HD1      HIS  93   9.008  36.891   5.473
  774    HD2  HIS  93           HD2      HIS  93   7.735  40.696   6.554
  775    HE1  HIS  93           HE1      HIS  93  11.097  38.146   6.100
  776    HE2  HIS  93           HE2      HIS  93  10.307  40.465   6.692
  Start of MODEL    6
    1    H    GLN   1           H        GLN   1   7.764 -19.063  -1.236
    2    HA   GLN   1           HA       GLN   1   6.956 -19.717   0.814
    3   1HB   GLN   1          2HB       GLN   1   8.171 -17.160   1.620
    4   2HB   GLN   1          1HB       GLN   1   6.617 -17.479   2.381
    5   1HG   GLN   1          2HG       GLN   1   8.444 -19.762   2.388
    6   2HG   GLN   1          1HG       GLN   1   9.027 -18.362   3.286
    7   1HE2  GLN   1          1HE2      GLN   1   7.378 -21.156   3.591
    8   2HE2  GLN   1          2HE2      GLN   1   6.398 -20.779   4.962
    9    H    SER   2           H        SER   2   4.771 -19.290   1.669
   10    HA   SER   2           HA       SER   2   3.201 -17.591  -0.162
   11   1HB   SER   2          2HB       SER   2   2.801 -20.376   0.790
   12   2HB   SER   2          1HB       SER   2   1.359 -19.367   0.672
   13    HG   SER   2           HG       SER   2   1.609 -20.287  -1.307
   14    H    ASP   3           H        ASP   3   1.176 -16.749   0.731
   15    HA   ASP   3           HA       ASP   3   0.008 -15.540   2.257
   16   1HB   ASP   3          2HB       ASP   3   1.068 -17.686   4.103
   17   2HB   ASP   3          1HB       ASP   3  -0.099 -16.467   4.600
   18    H    VAL   4           H        VAL   4   1.465 -13.777   1.856
   19    HA   VAL   4           HA       VAL   4   3.629 -13.330   3.737
   20    HB   VAL   4           HB       VAL   4   2.587 -11.440   1.620
   21   1HG1  VAL   4          1HG1      VAL   4   3.936 -10.090   2.861
   22   2HG1  VAL   4          2HG1      VAL   4   5.168 -10.828   1.840
   23   3HG1  VAL   4          3HG1      VAL   4   4.903 -11.431   3.475
   24   1HG2  VAL   4          1HG2      VAL   4   3.612 -13.895   1.092
   25   2HG2  VAL   4          2HG2      VAL   4   5.076 -12.915   1.114
   26   3HG2  VAL   4          3HG2      VAL   4   3.755 -12.503   0.020
   27    H    ARG   5           H        ARG   5   3.726 -11.708   5.290
   28    HA   ARG   5           HA       ARG   5   1.136 -10.758   6.252
   29   1HB   ARG   5          2HB       ARG   5   3.250 -11.835   7.582
   30   2HB   ARG   5          1HB       ARG   5   3.571 -10.121   7.798
   31   1HG   ARG   5          2HG       ARG   5   1.305  -9.841   8.726
   32   2HG   ARG   5          1HG       ARG   5   1.052 -11.580   8.569
   33   1HD   ARG   5          2HD       ARG   5   3.413 -11.491   9.928
   34   2HD   ARG   5          1HD       ARG   5   2.592 -10.061  10.553
   35    HE   ARG   5           HE       ARG   5   0.940 -12.410  10.539
   36   1HH1  ARG   5          1HH1      ARG   5   3.355 -10.644  12.359
   37   2HH1  ARG   5          2HH1      ARG   5   2.870 -11.306  13.882
   38   1HH2  ARG   5          1HH2      ARG   5   0.307 -13.285  12.551
   39   2HH2  ARG   5          2HH2      ARG   5   1.140 -12.805  13.991
   40    H    ILE   6           H        ILE   6   0.495  -8.897   5.336
   41    HA   ILE   6           HA       ILE   6   2.480  -6.770   4.913
   42    HB   ILE   6           HB       ILE   6  -0.331  -6.884   3.810
   43   1HG1  ILE   6          2HG1      ILE   6   2.193  -7.512   2.276
   44   2HG1  ILE   6          1HG1      ILE   6   1.233  -8.768   3.053
   45   1HG2  ILE   6          1HG2      ILE   6   2.047  -5.229   2.968
   46   2HG2  ILE   6          2HG2      ILE   6   0.708  -4.650   3.960
   47   3HG2  ILE   6          3HG2      ILE   6   0.419  -5.156   2.296
   48   1HD1  ILE   6          1HD1      ILE   6  -0.131  -6.877   1.212
   49   2HD1  ILE   6          2HD1      ILE   6  -0.480  -8.570   1.565
   50   3HD1  ILE   6          3HD1      ILE   6   0.887  -8.148   0.533
   51    H    LYS   7           H        LYS   7   2.487  -5.043   6.199
   52    HA   LYS   7           HA       LYS   7   0.206  -4.635   8.005
   53   1HB   LYS   7          2HB       LYS   7   3.134  -4.056   8.207
   54   2HB   LYS   7          1HB       LYS   7   2.006  -3.066   9.125
   55   1HG   LYS   7          2HG       LYS   7   1.155  -5.017  10.265
   56   2HG   LYS   7          1HG       LYS   7   2.175  -6.069   9.280
   57   1HD   LYS   7          2HD       LYS   7   4.086  -5.498  10.402
   58   2HD   LYS   7          1HD       LYS   7   3.494  -3.886  10.808
   59   1HE   LYS   7          2HE       LYS   7   2.198  -6.295  12.015
   60   2HE   LYS   7          1HE       LYS   7   3.728  -5.706  12.665
   61   1HZ   LYS   7          1HZ       LYS   7   2.330  -4.473  13.918
   62   2HZ   LYS   7          2HZ       LYS   7   1.075  -4.505  12.785
   63   3HZ   LYS   7          3HZ       LYS   7   2.370  -3.438  12.580
   64    H    PHE   8           H        PHE   8  -1.038  -2.882   7.834
   65    HA   PHE   8           HA       PHE   8  -0.194  -0.752   5.978
   66   1HB   PHE   8          2HB       PHE   8  -2.986  -1.647   6.738
   67   2HB   PHE   8          1HB       PHE   8  -2.612  -0.310   5.655
   68    HD1  PHE   8           HD2      PHE   8  -1.469  -0.783   3.482
   69    HD2  PHE   8           HD1      PHE   8  -3.007  -3.875   5.970
   70    HE1  PHE   8           HE2      PHE   8  -1.413  -2.338   1.577
   71    HE2  PHE   8           HE1      PHE   8  -2.952  -5.436   4.069
   72    HZ   PHE   8           HZ       PHE   8  -2.156  -4.669   1.870
   73    H    GLU   9           H        GLU   9  -0.027   1.294   6.713
   74    HA   GLU   9           HA       GLU   9  -1.059   1.861   9.416
   75   1HB   GLU   9          2HB       GLU   9   1.421   1.731   9.316
   76   2HB   GLU   9          1HB       GLU   9   1.418   3.041   8.144
   77   1HG   GLU   9          2HG       GLU   9   0.171   4.383   9.934
   78   2HG   GLU   9          1HG       GLU   9   0.695   3.126  11.050
   79    H    HIS  10           H        HIS  10  -2.389   3.535   9.640
   80    HA   HIS  10           HA       HIS  10  -2.423   5.660   7.629
   81   1HB   HIS  10          2HB       HIS  10  -4.141   3.851   7.092
   82   2HB   HIS  10          1HB       HIS  10  -4.973   4.348   8.560
   83    HD1  HIS  10           HD1      HIS  10  -7.016   5.409   7.606
   84    HD2  HIS  10           HD2      HIS  10  -3.528   6.842   5.859
   85    HE1  HIS  10           HE1      HIS  10  -7.741   7.295   6.110
   86    HE2  HIS  10           HE2      HIS  10  -5.629   8.069   4.973
   87    H    ASN  11           H        ASN  11  -2.324   7.554   8.643
   88    HA   ASN  11           HA       ASN  11  -2.510   9.188  10.210
   89   1HB   ASN  11          2HB       ASN  11  -5.004   8.356   9.886
   90   2HB   ASN  11          1HB       ASN  11  -4.800   7.806  11.544
   91   1HD2  ASN  11          1HD2      ASN  11  -5.097  10.536   9.446
   92   2HD2  ASN  11          2HD2      ASN  11  -5.225  11.736  10.681
   93    H    GLY  12           H        GLY  12  -0.943   6.705  10.795
   94   1HA   GLY  12          2HA       GLY  12   0.569   6.572  12.642
   95   2HA   GLY  12          1HA       GLY  12  -0.716   7.145  13.693
   96    H    GLU  13           H        GLU  13  -2.793   5.426  13.068
   97    HA   GLU  13           HA       GLU  13  -2.075   3.135  14.566
   98   1HB   GLU  13          2HB       GLU  13  -4.345   2.360  14.179
   99   2HB   GLU  13          1HB       GLU  13  -4.348   4.074  14.575
  100   1HG   GLU  13          2HG       GLU  13  -4.179   3.776  11.742
  101   2HG   GLU  13          1HG       GLU  13  -5.505   2.787  12.350
  102    H    ARG  14           H        ARG  14  -1.653   1.052  13.999
  103    HA   ARG  14           HA       ARG  14  -1.166   0.563  11.140
  104   1HB   ARG  14          2HB       ARG  14   0.229  -0.294  13.630
  105   2HB   ARG  14          1HB       ARG  14   0.254  -1.386  12.253
  106   1HG   ARG  14          2HG       ARG  14   1.452   0.101  10.929
  107   2HG   ARG  14          1HG       ARG  14   1.028   1.485  11.938
  108   1HD   ARG  14          2HD       ARG  14   2.345  -0.083  13.723
  109   2HD   ARG  14          1HD       ARG  14   3.195  -0.478  12.230
  110    HE   ARG  14           HE       ARG  14   4.110   1.619  12.232
  111   1HH1  ARG  14          1HH1      ARG  14   1.430   1.569  14.484
  112   2HH1  ARG  14          2HH1      ARG  14   1.775   3.139  15.124
  113   1HH2  ARG  14          1HH2      ARG  14   4.565   3.690  13.078
  114   2HH2  ARG  14          2HH2      ARG  14   3.559   4.345  14.326
  115    H    ARG  15           H        ARG  15  -1.589  -1.548  10.279
  116    HA   ARG  15           HA       ARG  15  -3.501  -3.181  11.802
  117   1HB   ARG  15          2HB       ARG  15  -4.421  -1.488   9.953
  118   2HB   ARG  15          1HB       ARG  15  -3.980  -2.812   8.886
  119   1HG   ARG  15          2HG       ARG  15  -5.814  -3.927   9.423
  120   2HG   ARG  15          1HG       ARG  15  -5.434  -3.821  11.142
  121   1HD   ARG  15          2HD       ARG  15  -6.703  -1.580   9.581
  122   2HD   ARG  15          1HD       ARG  15  -7.632  -2.806  10.444
  123    HE   ARG  15           HE       ARG  15  -6.300  -0.555  11.576
  124   1HH1  ARG  15          1HH1      ARG  15  -7.212  -3.872  12.227
  125   2HH1  ARG  15          2HH1      ARG  15  -7.270  -3.652  13.942
  126   1HH2  ARG  15          1HH2      ARG  15  -6.377  -0.267  13.841
  127   2HH2  ARG  15          2HH2      ARG  15  -6.798  -1.603  14.861
  128    H    ILE  16           H        ILE  16  -3.555  -5.393  11.239
  129    HA   ILE  16           HA       ILE  16  -1.276  -6.281   9.588
  130    HB   ILE  16           HB       ILE  16  -2.541  -7.839  11.847
  131   1HG1  ILE  16          2HG1      ILE  16   0.033  -6.244  11.881
  132   2HG1  ILE  16          1HG1      ILE  16  -1.462  -5.762  12.676
  133   1HG2  ILE  16          1HG2      ILE  16  -0.554  -9.237  11.680
  134   2HG2  ILE  16          2HG2      ILE  16   0.059  -8.234  10.365
  135   3HG2  ILE  16          3HG2      ILE  16  -1.410  -9.185  10.139
  136   1HD1  ILE  16          1HD1      ILE  16  -0.638  -8.429  13.443
  137   2HD1  ILE  16          2HD1      ILE  16  -1.030  -7.031  14.443
  138   3HD1  ILE  16          3HD1      ILE  16   0.596  -7.216  13.788
  139    H    ILE  17           H        ILE  17  -1.857  -7.186   7.724
  140    HA   ILE  17           HA       ILE  17  -4.297  -8.836   7.646
  141    HB   ILE  17           HB       ILE  17  -3.449  -7.019   5.389
  142   1HG1  ILE  17          2HG1      ILE  17  -4.171  -5.709   7.377
  143   2HG1  ILE  17          1HG1      ILE  17  -5.264  -5.533   6.008
  144   1HG2  ILE  17          1HG2      ILE  17  -6.115  -8.340   5.796
  145   2HG2  ILE  17          2HG2      ILE  17  -4.794  -9.130   4.937
  146   3HG2  ILE  17          3HG2      ILE  17  -5.457  -7.613   4.332
  147   1HD1  ILE  17          1HD1      ILE  17  -6.175  -5.899   8.433
  148   2HD1  ILE  17          2HD1      ILE  17  -5.869  -7.595   8.062
  149   3HD1  ILE  17          3HD1      ILE  17  -6.963  -6.656   7.048
  150    H    ALA  18           H        ALA  18  -4.127 -10.740   6.577
  151    HA   ALA  18           HA       ALA  18  -1.487 -11.462   5.550
  152   1HB   ALA  18          1HB       ALA  18  -3.108 -12.812   7.216
  153   2HB   ALA  18          2HB       ALA  18  -1.926 -13.591   6.165
  154   3HB   ALA  18          3HB       ALA  18  -3.617 -13.502   5.676
  155    H    PHE  19           H        PHE  19  -1.100 -12.149   3.476
  156    HA   PHE  19           HA       PHE  19  -3.360 -12.077   1.584
  157   1HB   PHE  19          2HB       PHE  19  -0.794 -10.570   1.519
  158   2HB   PHE  19          1HB       PHE  19  -1.382 -11.215  -0.010
  159    HD1  PHE  19           HD1      PHE  19  -2.698  -9.341   2.943
  160    HD2  PHE  19           HD2      PHE  19  -2.709  -9.849  -1.283
  161    HE1  PHE  19           HE1      PHE  19  -4.215  -7.418   2.719
  162    HE2  PHE  19           HE2      PHE  19  -4.227  -7.927  -1.514
  163    HZ   PHE  19           HZ       PHE  19  -4.982  -6.707   0.488
  164    H    SER  20           H        SER  20  -3.586 -13.997   0.648
  165    HA   SER  20           HA       SER  20  -1.382 -15.886   0.591
  166   1HB   SER  20          2HB       SER  20  -3.630 -16.652   1.243
  167   2HB   SER  20          1HB       SER  20  -4.252 -16.182  -0.339
  168    HG   SER  20           HG       SER  20  -3.454 -18.499   0.180
  169    H    ARG  21           H        ARG  21  -0.367 -16.663  -1.225
  170    HA   ARG  21           HA       ARG  21  -0.540 -15.005  -3.593
  171   1HB   ARG  21          2HB       ARG  21   1.333 -17.139  -2.629
  172   2HB   ARG  21          1HB       ARG  21   1.342 -16.674  -4.325
  173   1HG   ARG  21          2HG       ARG  21   1.879 -14.399  -3.749
  174   2HG   ARG  21          1HG       ARG  21   1.731 -14.767  -2.029
  175   1HD   ARG  21          2HD       ARG  21   3.562 -16.516  -2.448
  176   2HD   ARG  21          1HD       ARG  21   3.831 -15.669  -3.972
  177    HE   ARG  21           HE       ARG  21   3.837 -13.936  -1.681
  178   1HH1  ARG  21          1HH1      ARG  21   5.800 -16.059  -3.652
  179   2HH1  ARG  21          2HH1      ARG  21   7.288 -15.286  -3.220
  180   1HH2  ARG  21          1HH2      ARG  21   5.798 -12.924  -1.111
  181   2HH2  ARG  21          2HH2      ARG  21   7.288 -13.505  -1.775
  182    HA   PRO  22           HA       PRO  22   0.485 -15.499  -5.753
  183   1HB   PRO  22          2HB       PRO  22  -0.652 -15.010  -8.147
  184   2HB   PRO  22          1HB       PRO  22   0.309 -16.460  -7.840
  185   1HG   PRO  22          2HG       PRO  22  -2.666 -16.131  -7.874
  186   2HG   PRO  22          1HG       PRO  22  -1.676 -17.433  -8.560
  187   1HD   PRO  22          2HD       PRO  22  -2.981 -17.644  -6.175
  188   2HD   PRO  22          1HD       PRO  22  -1.479 -18.514  -6.544
  189    H    VAL  23           H        VAL  23   0.436 -13.236  -6.165
  190    HA   VAL  23           HA       VAL  23  -2.139 -11.887  -5.815
  191    HB   VAL  23           HB       VAL  23  -1.136 -12.051  -3.576
  192   1HG1  VAL  23          1HG1      VAL  23   1.237 -12.087  -4.390
  193   2HG1  VAL  23          2HG1      VAL  23   0.940 -11.041  -3.003
  194   3HG1  VAL  23          3HG1      VAL  23   1.117 -10.342  -4.612
  195   1HG2  VAL  23          1HG2      VAL  23  -2.445 -10.015  -4.447
  196   2HG2  VAL  23          2HG2      VAL  23  -0.888  -9.190  -4.434
  197   3HG2  VAL  23          3HG2      VAL  23  -1.548  -9.850  -2.938
  198    H    LYS  24           H        LYS  24  -2.345  -9.987  -6.903
  199    HA   LYS  24           HA       LYS  24   0.006  -9.050  -8.417
  200   1HB   LYS  24          2HB       LYS  24  -2.727  -9.724  -9.272
  201   2HB   LYS  24          1HB       LYS  24  -2.148  -8.178  -9.875
  202   1HG   LYS  24          2HG       LYS  24  -1.449  -9.559 -11.547
  203   2HG   LYS  24          1HG       LYS  24  -0.022  -9.581 -10.510
  204   1HD   LYS  24          2HD       LYS  24  -0.732 -11.676  -9.521
  205   2HD   LYS  24          1HD       LYS  24  -2.227 -11.640 -10.456
  206   1HE   LYS  24          2HE       LYS  24  -1.163 -12.157 -12.432
  207   2HE   LYS  24          1HE       LYS  24   0.385 -11.513 -11.889
  208   1HZ   LYS  24          1HZ       LYS  24  -0.777 -14.153 -11.476
  209   2HZ   LYS  24          2HZ       LYS  24   0.114 -13.515 -10.188
  210   3HZ   LYS  24          3HZ       LYS  24   0.837 -13.707 -11.705
  211    H    TYR  25           H        TYR  25   0.101  -6.766  -8.876
  212    HA   TYR  25           HA       TYR  25  -0.409  -5.113  -6.702
  213   1HB   TYR  25          2HB       TYR  25   1.230  -4.527  -8.418
  214   2HB   TYR  25          1HB       TYR  25  -0.053  -4.333  -9.608
  215    HD1  TYR  25           HD2      TYR  25   0.274  -3.104  -6.084
  216    HD2  TYR  25           HD1      TYR  25  -0.155  -2.090 -10.197
  217    HE1  TYR  25           HE2      TYR  25   0.057  -0.737  -5.472
  218    HE2  TYR  25           HE1      TYR  25  -0.375   0.284  -9.589
  219    HH   TYR  25           HH       TYR  25  -0.969   1.336  -6.464
  220    H    GLU  26           H        GLU  26  -2.308  -5.528  -9.682
  221    HA   GLU  26           HA       GLU  26  -4.263  -3.585  -9.130
  222   1HB   GLU  26          2HB       GLU  26  -3.761  -5.439 -11.181
  223   2HB   GLU  26          1HB       GLU  26  -5.363  -5.839 -10.573
  224   1HG   GLU  26          2HG       GLU  26  -4.825  -2.979 -11.039
  225   2HG   GLU  26          1HG       GLU  26  -4.912  -4.002 -12.470
  226    H    ASP  27           H        ASP  27  -4.094  -7.027  -8.361
  227    HA   ASP  27           HA       ASP  27  -6.680  -7.309  -7.303
  228   1HB   ASP  27          2HB       ASP  27  -4.111  -8.826  -6.994
  229   2HB   ASP  27          1HB       ASP  27  -5.493  -9.241  -5.987
  230    H    VAL  28           H        VAL  28  -3.593  -6.505  -5.758
  231    HA   VAL  28           HA       VAL  28  -4.634  -6.395  -3.122
  232    HB   VAL  28           HB       VAL  28  -2.218  -4.884  -4.131
  233   1HG1  VAL  28          1HG1      VAL  28  -1.743  -4.433  -1.989
  234   2HG1  VAL  28          2HG1      VAL  28  -2.188  -6.051  -1.449
  235   3HG1  VAL  28          3HG1      VAL  28  -3.434  -4.825  -1.675
  236   1HG2  VAL  28          1HG2      VAL  28  -1.247  -7.151  -2.944
  237   2HG2  VAL  28          2HG2      VAL  28  -1.395  -6.895  -4.682
  238   3HG2  VAL  28          3HG2      VAL  28  -2.660  -7.758  -3.809
  239    H    GLU  29           H        GLU  29  -4.081  -3.928  -5.617
  240    HA   GLU  29           HA       GLU  29  -4.724  -1.675  -4.110
  241   1HB   GLU  29          2HB       GLU  29  -3.964  -2.125  -6.693
  242   2HB   GLU  29          1HB       GLU  29  -5.629  -1.604  -6.910
  243   1HG   GLU  29          2HG       GLU  29  -4.260   0.096  -5.037
  244   2HG   GLU  29          1HG       GLU  29  -3.385   0.001  -6.562
  245    H    HIS  30           H        HIS  30  -6.846  -3.781  -6.030
  246    HA   HIS  30           HA       HIS  30  -9.222  -2.328  -5.650
  247   1HB   HIS  30          2HB       HIS  30  -8.468  -4.972  -6.649
  248   2HB   HIS  30          1HB       HIS  30 -10.043  -4.960  -5.868
  249    HD1  HIS  30           HD1      HIS  30  -9.486  -5.322  -8.981
  250    HD2  HIS  30           HD2      HIS  30 -10.747  -1.841  -7.096
  251    HE1  HIS  30           HE1      HIS  30 -10.642  -3.976 -10.761
  252    HE2  HIS  30           HE2      HIS  30 -11.260  -1.811  -9.631
  253    H    LYS  31           H        LYS  31  -7.771  -4.961  -3.765
  254    HA   LYS  31           HA       LYS  31  -9.927  -5.185  -1.926
  255   1HB   LYS  31          2HB       LYS  31  -7.997  -6.859  -2.454
  256   2HB   LYS  31          1HB       LYS  31  -7.109  -5.953  -1.234
  257   1HG   LYS  31          2HG       LYS  31  -9.803  -6.771  -0.416
  258   2HG   LYS  31          1HG       LYS  31  -8.691  -8.102  -0.736
  259   1HD   LYS  31          2HD       LYS  31  -7.034  -6.799   0.738
  260   2HD   LYS  31          1HD       LYS  31  -8.447  -5.886   1.272
  261   1HE   LYS  31          2HE       LYS  31  -9.453  -7.780   2.217
  262   2HE   LYS  31          1HE       LYS  31  -8.401  -8.885   1.335
  263   1HZ   LYS  31          1HZ       LYS  31  -6.730  -8.628   2.818
  264   2HZ   LYS  31          2HZ       LYS  31  -8.013  -8.285   3.866
  265   3HZ   LYS  31          3HZ       LYS  31  -7.121  -7.022   3.182
  266    H    VAL  32           H        VAL  32  -6.734  -3.601  -1.700
  267    HA   VAL  32           HA       VAL  32  -7.059  -2.609   0.910
  268    HB   VAL  32           HB       VAL  32  -5.411  -1.369  -1.300
  269   1HG1  VAL  32          1HG1      VAL  32  -5.682   0.145   0.562
  270   2HG1  VAL  32          2HG1      VAL  32  -4.041  -0.497   0.565
  271   3HG1  VAL  32          3HG1      VAL  32  -5.236  -1.125   1.702
  272   1HG2  VAL  32          1HG2      VAL  32  -5.146  -3.910  -0.360
  273   2HG2  VAL  32          2HG2      VAL  32  -4.074  -3.020   0.719
  274   3HG2  VAL  32          3HG2      VAL  32  -3.833  -2.938  -1.024
  275    H    THR  33           H        THR  33  -7.882  -1.182  -2.234
  276    HA   THR  33           HA       THR  33  -8.565   1.375  -1.342
  277    HB   THR  33           HB       THR  33  -9.565  -0.247  -3.685
  278    HG1  THR  33           HG1      THR  33  -7.855   0.540  -4.591
  279   1HG2  THR  33          1HG2      THR  33  -9.948   2.390  -4.340
  280   2HG2  THR  33          2HG2      THR  33 -10.584   2.283  -2.700
  281   3HG2  THR  33          3HG2      THR  33 -11.208   1.217  -3.957
  282    H    THR  34           H        THR  34 -10.532  -1.586  -1.514
  283    HA   THR  34           HA       THR  34 -12.933  -0.286  -0.667
  284    HB   THR  34           HB       THR  34 -12.248  -3.229  -0.557
  285    HG1  THR  34           HG1      THR  34 -12.154  -2.811  -2.656
  286   1HG2  THR  34          1HG2      THR  34 -14.247  -2.624   0.746
  287   2HG2  THR  34          2HG2      THR  34 -14.610  -3.645  -0.646
  288   3HG2  THR  34          3HG2      THR  34 -14.947  -1.914  -0.708
  289    H    VAL  35           H        VAL  35 -10.354  -2.022   1.008
  290    HA   VAL  35           HA       VAL  35 -11.599  -2.293   3.507
  291    HB   VAL  35           HB       VAL  35  -8.643  -1.913   2.997
  292   1HG1  VAL  35          1HG1      VAL  35  -9.491  -3.649   5.190
  293   2HG1  VAL  35          2HG1      VAL  35  -9.939  -1.958   5.408
  294   3HG1  VAL  35          3HG1      VAL  35  -8.252  -2.397   5.147
  295   1HG2  VAL  35          1HG2      VAL  35  -8.550  -3.953   2.122
  296   2HG2  VAL  35          2HG2      VAL  35 -10.312  -3.959   2.077
  297   3HG2  VAL  35          3HG2      VAL  35  -9.465  -4.631   3.469
  298    H    PHE  36           H        PHE  36  -9.342   0.259   2.395
  299    HA   PHE  36           HA       PHE  36 -10.055   1.852   4.747
  300   1HB   PHE  36          2HB       PHE  36  -7.905   2.320   2.678
  301   2HB   PHE  36          1HB       PHE  36  -8.143   3.260   4.145
  302    HD1  PHE  36           HD2      PHE  36  -7.114  -0.015   2.810
  303    HD2  PHE  36           HD1      PHE  36  -7.369   2.477   6.252
  304    HE1  PHE  36           HE2      PHE  36  -5.633  -1.554   4.031
  305    HE2  PHE  36           HE1      PHE  36  -5.886   0.943   7.476
  306    HZ   PHE  36           HZ       PHE  36  -5.019  -1.074   6.365
  307    H    GLY  37           H        GLY  37 -10.841   1.711   1.396
  308   1HA   GLY  37          2HA       GLY  37 -12.568   3.012   0.457
  309   2HA   GLY  37          1HA       GLY  37 -12.264   4.250   1.668
  310    H    GLN  38           H        GLN  38 -12.278   5.794  -0.045
  311    HA   GLN  38           HA       GLN  38  -9.654   6.092  -1.293
  312   1HB   GLN  38          2HB       GLN  38 -12.106   5.478  -2.736
  313   2HB   GLN  38          1HB       GLN  38 -11.390   6.989  -3.282
  314   1HG   GLN  38          2HG       GLN  38  -9.199   5.435  -3.238
  315   2HG   GLN  38          1HG       GLN  38 -10.431   4.218  -3.564
  316   1HE2  GLN  38          1HE2      GLN  38 -11.865   4.616  -5.397
  317   2HE2  GLN  38          2HE2      GLN  38 -11.243   5.453  -6.774
  318    HA   PRO  39           HA       PRO  39  -9.062   7.464  -2.973
  319   1HB   PRO  39          2HB       PRO  39  -7.544   9.607  -3.429
  320   2HB   PRO  39          1HB       PRO  39  -9.195   9.509  -4.052
  321   1HG   PRO  39          2HG       PRO  39  -8.131  11.054  -1.742
  322   2HG   PRO  39          1HG       PRO  39  -9.430  11.471  -2.870
  323   1HD   PRO  39          2HD       PRO  39  -9.725  10.384  -0.282
  324   2HD   PRO  39          1HD       PRO  39 -10.992  10.543  -1.513
  325    H    LEU  40           H        LEU  40  -7.297   6.273  -2.519
  326    HA   LEU  40           HA       LEU  40  -5.350   7.267  -0.567
  327   1HB   LEU  40          2HB       LEU  40  -6.643   4.540  -0.508
  328   2HB   LEU  40          1HB       LEU  40  -5.210   4.964   0.410
  329    HG   LEU  40           HG       LEU  40  -7.760   6.517   0.739
  330   1HD1  LEU  40          1HD1      LEU  40  -8.509   5.067   2.439
  331   2HD1  LEU  40          2HD1      LEU  40  -7.010   4.140   2.415
  332   3HD1  LEU  40          3HD1      LEU  40  -8.131   4.035   1.060
  333   1HD2  LEU  40          1HD2      LEU  40  -6.047   7.646   1.799
  334   2HD2  LEU  40          2HD2      LEU  40  -5.210   6.164   2.256
  335   3HD2  LEU  40          3HD2      LEU  40  -6.684   6.641   3.099
  336    H    ASP  41           H        ASP  41  -3.262   6.863  -1.093
  337    HA   ASP  41           HA       ASP  41  -2.777   5.165  -3.457
  338   1HB   ASP  41          2HB       ASP  41  -2.345   7.759  -3.488
  339   2HB   ASP  41          1HB       ASP  41  -0.875   7.325  -2.621
  340    H    LEU  42           H        LEU  42  -1.172   3.646  -3.395
  341    HA   LEU  42           HA       LEU  42  -0.206   2.881  -0.783
  342   1HB   LEU  42          2HB       LEU  42  -0.045   1.680  -3.527
  343   2HB   LEU  42          1HB       LEU  42   0.968   1.067  -2.237
  344    HG   LEU  42           HG       LEU  42  -1.951   1.283  -1.701
  345   1HD1  LEU  42          1HD1      LEU  42  -0.785  -0.989  -3.298
  346   2HD1  LEU  42          2HD1      LEU  42  -1.749   0.313  -3.991
  347   3HD1  LEU  42          3HD1      LEU  42  -2.464  -0.774  -2.801
  348   1HD2  LEU  42          1HD2      LEU  42   0.360  -0.397  -0.840
  349   2HD2  LEU  42          2HD2      LEU  42  -1.277  -1.036  -0.691
  350   3HD2  LEU  42          3HD2      LEU  42  -0.836   0.460   0.134
  351    H    HIS  43           H        HIS  43   1.479   3.943   0.053
  352    HA   HIS  43           HA       HIS  43   3.743   4.603  -1.718
  353   1HB   HIS  43          2HB       HIS  43   2.441   6.062   0.513
  354   2HB   HIS  43          1HB       HIS  43   4.198   6.164   0.435
  355    HD1  HIS  43           HD1      HIS  43   1.321   6.565  -2.046
  356    HD2  HIS  43           HD2      HIS  43   4.984   8.266  -1.054
  357    HE1  HIS  43           HE1      HIS  43   1.607   8.511  -3.612
  358    HE2  HIS  43           HE2      HIS  43   3.795   9.567  -2.945
  359    H    TYR  44           H        TYR  44   5.512   3.425  -1.430
  360    HA   TYR  44           HA       TYR  44   5.812   1.820   0.974
  361   1HB   TYR  44          2HB       TYR  44   6.356   1.308  -1.656
  362   2HB   TYR  44          1HB       TYR  44   7.953   1.729  -1.048
  363    HD1  TYR  44           HD1      TYR  44   8.875   0.434   0.922
  364    HD2  TYR  44           HD2      TYR  44   5.401  -0.791  -1.203
  365    HE1  TYR  44           HE1      TYR  44   9.122  -1.835   1.840
  366    HE2  TYR  44           HE2      TYR  44   5.636  -3.064  -0.292
  367    HH   TYR  44           HH       TYR  44   8.165  -4.351   0.811
  368    H    MET  45           H        MET  45   7.164   2.268   2.604
  369    HA   MET  45           HA       MET  45   9.213   4.348   2.195
  370   1HB   MET  45          2HB       MET  45   7.057   4.162   4.200
  371   2HB   MET  45          1HB       MET  45   8.639   4.575   4.847
  372   1HG   MET  45          2HG       MET  45   8.756   6.412   3.157
  373   2HG   MET  45          1HG       MET  45   7.080   6.053   2.743
  374   1HE   MET  45          1HE       MET  45   9.549   6.729   5.439
  375   2HE   MET  45          2HE       MET  45   8.473   6.202   6.733
  376   3HE   MET  45          3HE       MET  45   8.795   7.919   6.498
  377    H    ASN  46           H        ASN  46  11.183   3.529   2.462
  378    HA   ASN  46           HA       ASN  46  11.583   1.003   3.795
  379   1HB   ASN  46          2HB       ASN  46  13.240   2.861   2.169
  380   2HB   ASN  46          1HB       ASN  46  14.096   1.818   3.300
  381   1HD2  ASN  46          1HD2      ASN  46  14.753   1.389   0.830
  382   2HD2  ASN  46          2HD2      ASN  46  14.005  -0.023   0.175
  383    H    ASN  47           H        ASN  47  12.815   4.303   4.294
  384    HA   ASN  47           HA       ASN  47  12.510   4.240   7.095
  385   1HB   ASN  47          2HB       ASN  47  15.013   3.149   6.048
  386   2HB   ASN  47          1HB       ASN  47  15.274   4.493   7.153
  387   1HD2  ASN  47          1HD2      ASN  47  16.220   2.134   7.935
  388   2HD2  ASN  47          2HD2      ASN  47  15.245   1.451   9.186
  389    H    GLU  48           H        GLU  48  14.903   5.511   4.785
  390    HA   GLU  48           HA       GLU  48  14.257   8.228   5.709
  391   1HB   GLU  48          2HB       GLU  48  16.735   6.872   4.945
  392   2HB   GLU  48          1HB       GLU  48  16.534   8.436   4.165
  393   1HG   GLU  48          2HG       GLU  48  15.913   9.150   6.650
  394   2HG   GLU  48          1HG       GLU  48  16.943   7.770   7.020
  395    H    LEU  49           H        LEU  49  14.220   6.118   2.927
  396    HA   LEU  49           HA       LEU  49  13.481   8.385   1.207
  397   1HB   LEU  49          2HB       LEU  49  15.399   6.517   0.764
  398   2HB   LEU  49          1HB       LEU  49  14.028   5.767  -0.031
  399    HG   LEU  49           HG       LEU  49  14.490   8.609  -0.695
  400   1HD1  LEU  49          1HD1      LEU  49  16.228   7.893  -2.395
  401   2HD1  LEU  49          2HD1      LEU  49  16.430   6.435  -1.422
  402   3HD1  LEU  49          3HD1      LEU  49  16.764   8.018  -0.719
  403   1HD2  LEU  49          1HD2      LEU  49  13.954   7.773  -2.946
  404   2HD2  LEU  49          2HD2      LEU  49  12.719   7.350  -1.763
  405   3HD2  LEU  49          3HD2      LEU  49  13.876   6.134  -2.302
  406    H    SER  50           H        SER  50  11.682   8.221  -0.160
  407    HA   SER  50           HA       SER  50   9.718   6.176   0.640
  408   1HB   SER  50          2HB       SER  50   9.414   8.818   1.050
  409   2HB   SER  50          1HB       SER  50   8.760   8.709  -0.582
  410    HG   SER  50           HG       SER  50   7.203   8.380   1.138
  411    H    ILE  51           H        ILE  51   9.143   4.787  -0.885
  412    HA   ILE  51           HA       ILE  51   9.509   5.550  -3.716
  413    HB   ILE  51           HB       ILE  51   9.476   2.741  -2.623
  414   1HG1  ILE  51          2HG1      ILE  51  11.419   3.953  -1.724
  415   2HG1  ILE  51          1HG1      ILE  51  11.913   2.727  -2.888
  416   1HG2  ILE  51          1HG2      ILE  51   9.830   1.994  -4.725
  417   2HG2  ILE  51          2HG2      ILE  51  10.763   3.415  -5.193
  418   3HG2  ILE  51          3HG2      ILE  51   9.003   3.495  -5.141
  419   1HD1  ILE  51          1HD1      ILE  51  11.934   4.637  -4.595
  420   2HD1  ILE  51          2HD1      ILE  51  13.229   4.572  -3.400
  421   3HD1  ILE  51          3HD1      ILE  51  11.893   5.705  -3.191
  422    H    LEU  52           H        LEU  52   7.762   5.497  -5.025
  423    HA   LEU  52           HA       LEU  52   5.213   4.657  -3.860
  424   1HB   LEU  52          2HB       LEU  52   5.653   6.922  -5.052
  425   2HB   LEU  52          1HB       LEU  52   5.511   5.992  -6.531
  426    HG   LEU  52           HG       LEU  52   3.353   6.034  -4.426
  427   1HD1  LEU  52          1HD1      LEU  52   3.466   7.717  -6.920
  428   2HD1  LEU  52          2HD1      LEU  52   3.806   8.317  -5.297
  429   3HD1  LEU  52          3HD1      LEU  52   2.200   7.703  -5.693
  430   1HD2  LEU  52          1HD2      LEU  52   3.691   4.834  -7.106
  431   2HD2  LEU  52          2HD2      LEU  52   2.117   5.546  -6.752
  432   3HD2  LEU  52          3HD2      LEU  52   2.761   4.274  -5.714
  433    H    LEU  53           H        LEU  53   4.125   2.897  -4.497
  434    HA   LEU  53           HA       LEU  53   5.345   1.123  -6.427
  435   1HB   LEU  53          2HB       LEU  53   2.698   0.687  -5.062
  436   2HB   LEU  53          1HB       LEU  53   3.792  -0.518  -5.714
  437    HG   LEU  53           HG       LEU  53   4.926   1.114  -3.540
  438   1HD1  LEU  53          1HD1      LEU  53   3.614  -0.629  -1.985
  439   2HD1  LEU  53          2HD1      LEU  53   2.384  -0.356  -3.219
  440   3HD1  LEU  53          3HD1      LEU  53   3.036   1.006  -2.306
  441   1HD2  LEU  53          1HD2      LEU  53   6.170  -0.727  -3.190
  442   2HD2  LEU  53          2HD2      LEU  53   5.629  -1.164  -4.811
  443   3HD2  LEU  53          3HD2      LEU  53   4.804  -1.823  -3.397
  444    H    LYS  54           H        LYS  54   5.101   2.000  -8.453
  445    HA   LYS  54           HA       LYS  54   2.506   2.922  -9.351
  446   1HB   LYS  54          2HB       LYS  54   5.161   3.439 -10.090
  447   2HB   LYS  54          1HB       LYS  54   4.447   2.619 -11.470
  448   1HG   LYS  54          2HG       LYS  54   3.286   4.418 -12.052
  449   2HG   LYS  54          1HG       LYS  54   2.681   4.650 -10.413
  450   1HD   LYS  54          2HD       LYS  54   4.906   5.668  -9.841
  451   2HD   LYS  54          1HD       LYS  54   5.295   5.615 -11.561
  452   1HE   LYS  54          2HE       LYS  54   4.491   7.785 -11.211
  453   2HE   LYS  54          1HE       LYS  54   3.125   6.918 -11.914
  454   1HZ   LYS  54          1HZ       LYS  54   2.657   6.521  -9.333
  455   2HZ   LYS  54          2HZ       LYS  54   2.057   7.855 -10.179
  456   3HZ   LYS  54          3HZ       LYS  54   3.451   8.012  -9.236
  457    H    ASN  55           H        ASN  55   4.600   0.132  -9.815
  458    HA   ASN  55           HA       ASN  55   2.347  -1.326 -10.963
  459   1HB   ASN  55          2HB       ASN  55   4.989  -0.890 -12.339
  460   2HB   ASN  55          1HB       ASN  55   4.039  -2.338 -12.654
  461   1HD2  ASN  55          1HD2      ASN  55   4.766   0.364 -14.064
  462   2HD2  ASN  55          2HD2      ASN  55   3.266   0.799 -14.802
  463    H    GLN  56           H        GLN  56   3.234  -3.726 -11.408
  464    HA   GLN  56           HA       GLN  56   3.743  -4.856  -8.901
  465   1HB   GLN  56          2HB       GLN  56   2.708  -6.066 -10.798
  466   2HB   GLN  56          1HB       GLN  56   4.260  -6.072 -11.624
  467   1HG   GLN  56          2HG       GLN  56   4.411  -8.118 -10.710
  468   2HG   GLN  56          1HG       GLN  56   4.988  -7.211  -9.313
  469   1HE2  GLN  56          1HE2      GLN  56   3.995  -7.549  -7.454
  470   2HE2  GLN  56          2HE2      GLN  56   2.438  -8.269  -7.254
  471    H    ASP  57           H        ASP  57   5.921  -3.835 -11.461
  472    HA   ASP  57           HA       ASP  57   8.265  -5.117 -10.745
  473   1HB   ASP  57          2HB       ASP  57   7.729  -3.475 -12.711
  474   2HB   ASP  57          1HB       ASP  57   8.324  -2.242 -11.604
  475    H    ASP  58           H        ASP  58   6.875  -2.138  -9.415
  476    HA   ASP  58           HA       ASP  58   9.046  -1.473  -7.734
  477   1HB   ASP  58          2HB       ASP  58   6.114  -0.769  -7.678
  478   2HB   ASP  58          1HB       ASP  58   7.227  -0.190  -6.444
  479    H    LEU  59           H        LEU  59   6.144  -3.434  -7.238
  480    HA   LEU  59           HA       LEU  59   6.512  -3.897  -4.471
  481   1HB   LEU  59          2HB       LEU  59   5.059  -5.486  -6.586
  482   2HB   LEU  59          1HB       LEU  59   5.011  -5.879  -4.878
  483    HG   LEU  59           HG       LEU  59   4.215  -3.130  -5.719
  484   1HD1  LEU  59          1HD1      LEU  59   1.826  -4.362  -5.725
  485   2HD1  LEU  59          2HD1      LEU  59   2.823  -5.626  -6.446
  486   3HD1  LEU  59          3HD1      LEU  59   2.756  -4.026  -7.185
  487   1HD2  LEU  59          1HD2      LEU  59   4.415  -3.846  -3.332
  488   2HD2  LEU  59          2HD2      LEU  59   3.107  -4.992  -3.624
  489   3HD2  LEU  59          3HD2      LEU  59   2.813  -3.260  -3.786
  490    H    ASP  60           H        ASP  60   7.542  -5.681  -7.360
  491    HA   ASP  60           HA       ASP  60   8.590  -7.937  -6.061
  492   1HB   ASP  60          2HB       ASP  60   9.198  -6.636  -8.712
  493   2HB   ASP  60          1HB       ASP  60  10.066  -8.070  -8.177
  494    H    LYS  61           H        LYS  61  10.056  -4.812  -6.840
  495    HA   LYS  61           HA       LYS  61  12.683  -5.497  -6.003
  496   1HB   LYS  61          2HB       LYS  61  11.230  -2.971  -6.637
  497   2HB   LYS  61          1HB       LYS  61  12.729  -2.849  -5.725
  498   1HG   LYS  61          2HG       LYS  61  14.000  -3.357  -7.500
  499   2HG   LYS  61          1HG       LYS  61  12.870  -4.575  -8.092
  500   1HD   LYS  61          2HD       LYS  61  12.520  -3.062  -9.730
  501   2HD   LYS  61          1HD       LYS  61  11.434  -2.340  -8.542
  502   1HE   LYS  61          2HE       LYS  61  13.771  -1.203  -7.816
  503   2HE   LYS  61          1HE       LYS  61  14.047  -1.408  -9.546
  504   1HZ   LYS  61          1HZ       LYS  61  11.826   0.073  -8.247
  505   2HZ   LYS  61          2HZ       LYS  61  11.884  -0.262  -9.904
  506   3HZ   LYS  61          3HZ       LYS  61  13.070   0.716  -9.197
  507    H    ALA  62           H        ALA  62   9.890  -4.059  -4.374
  508    HA   ALA  62           HA       ALA  62  11.197  -3.405  -1.953
  509   1HB   ALA  62          1HB       ALA  62   9.192  -2.311  -2.169
  510   2HB   ALA  62          2HB       ALA  62   8.743  -3.612  -1.066
  511   3HB   ALA  62          3HB       ALA  62   8.351  -3.737  -2.780
  512    H    ILE  63           H        ILE  63   9.391  -6.301  -2.965
  513    HA   ILE  63           HA       ILE  63   9.491  -7.635  -0.482
  514    HB   ILE  63           HB       ILE  63   9.405  -8.919  -3.219
  515   1HG1  ILE  63          2HG1      ILE  63   6.949  -8.572  -1.584
  516   2HG1  ILE  63          1HG1      ILE  63   7.592  -7.126  -2.352
  517   1HG2  ILE  63          1HG2      ILE  63   9.962 -10.482  -1.430
  518   2HG2  ILE  63          2HG2      ILE  63   8.342 -10.795  -2.055
  519   3HG2  ILE  63          3HG2      ILE  63   8.547  -9.956  -0.517
  520   1HD1  ILE  63          1HD1      ILE  63   7.645  -8.776  -4.449
  521   2HD1  ILE  63          2HD1      ILE  63   6.242  -7.797  -4.021
  522   3HD1  ILE  63          3HD1      ILE  63   6.310  -9.494  -3.545
  523    H    ASP  64           H        ASP  64  11.704  -7.618  -3.247
  524    HA   ASP  64           HA       ASP  64  13.431  -9.652  -2.523
  525   1HB   ASP  64          2HB       ASP  64  13.428  -8.168  -4.631
  526   2HB   ASP  64          1HB       ASP  64  14.426  -7.061  -3.693
  527    H    ILE  65           H        ILE  65  13.242  -6.360  -1.280
  528    HA   ILE  65           HA       ILE  65  15.696  -6.375   0.135
  529    HB   ILE  65           HB       ILE  65  13.235  -4.787   0.874
  530   1HG1  ILE  65          2HG1      ILE  65  13.682  -4.418  -1.486
  531   2HG1  ILE  65          1HG1      ILE  65  14.176  -2.998  -0.572
  532   1HG2  ILE  65          1HG2      ILE  65  14.853  -3.187   1.776
  533   2HG2  ILE  65          2HG2      ILE  65  16.172  -4.264   1.317
  534   3HG2  ILE  65          3HG2      ILE  65  15.009  -4.769   2.542
  535   1HD1  ILE  65          1HD1      ILE  65  15.746  -3.671  -2.378
  536   2HD1  ILE  65          2HD1      ILE  65  16.070  -5.152  -1.477
  537   3HD1  ILE  65          3HD1      ILE  65  16.479  -3.586  -0.777
  538    H    LEU  66           H        LEU  66  12.364  -7.124   1.106
  539    HA   LEU  66           HA       LEU  66  12.962  -7.665   3.822
  540   1HB   LEU  66          2HB       LEU  66  10.675  -8.607   2.089
  541   2HB   LEU  66          1HB       LEU  66  10.755  -8.821   3.828
  542    HG   LEU  66           HG       LEU  66  11.084  -6.038   2.926
  543   1HD1  LEU  66          1HD1      LEU  66   8.504  -7.530   2.487
  544   2HD1  LEU  66          2HD1      LEU  66   9.454  -6.646   1.292
  545   3HD1  LEU  66          3HD1      LEU  66   8.626  -5.773   2.580
  546   1HD2  LEU  66          1HD2      LEU  66   9.498  -5.673   4.790
  547   2HD2  LEU  66          2HD2      LEU  66  10.928  -6.586   5.269
  548   3HD2  LEU  66          3HD2      LEU  66   9.396  -7.420   5.009
  549    H    ASP  67           H        ASP  67  12.622  -9.771   0.973
  550    HA   ASP  67           HA       ASP  67  12.998 -12.218   2.308
  551   1HB   ASP  67          2HB       ASP  67  12.388 -11.526  -0.252
  552   2HB   ASP  67          1HB       ASP  67  14.057 -12.051  -0.443
  553    H    ARG  68           H        ARG  68  15.302  -9.959   0.856
  554    HA   ARG  68           HA       ARG  68  17.608 -11.556   1.114
  555   1HB   ARG  68          2HB       ARG  68  17.050  -8.664   0.713
  556   2HB   ARG  68          1HB       ARG  68  18.661  -9.099   1.270
  557   1HG   ARG  68          2HG       ARG  68  19.078 -10.402  -0.661
  558   2HG   ARG  68          1HG       ARG  68  17.386 -10.331  -1.156
  559   1HD   ARG  68          2HD       ARG  68  17.731  -8.436  -2.259
  560   2HD   ARG  68          1HD       ARG  68  18.422  -7.674  -0.829
  561    HE   ARG  68           HE       ARG  68  20.442  -9.228  -1.778
  562   1HH1  ARG  68          1HH1      ARG  68  18.420  -6.752  -3.209
  563   2HH1  ARG  68          2HH1      ARG  68  19.640  -6.225  -4.319
  564   1HH2  ARG  68          1HH2      ARG  68  22.047  -8.526  -3.242
  565   2HH2  ARG  68          2HH2      ARG  68  21.698  -7.233  -4.338
  566    H    SER  69           H        SER  69  15.971  -9.398   3.362
  567    HA   SER  69           HA       SER  69  18.038  -9.365   5.316
  568   1HB   SER  69          2HB       SER  69  16.229  -7.654   5.179
  569   2HB   SER  69          1HB       SER  69  15.079  -8.876   5.720
  570    HG   SER  69           HG       SER  69  15.927  -8.833   7.696
  571    H    SER  70           H        SER  70  18.637 -10.948   6.650
  572    HA   SER  70           HA       SER  70  17.425 -13.474   6.730
  573   1HB   SER  70          2HB       SER  70  19.809 -12.445   7.607
  574   2HB   SER  70          1HB       SER  70  18.975 -12.755   9.130
  575    HG   SER  70           HG       SER  70  18.620 -14.914   8.354
  576    H    SER  71           H        SER  71  17.024 -10.648   8.802
  577    HA   SER  71           HA       SER  71  15.501 -11.966  10.816
  578   1HB   SER  71          2HB       SER  71  14.874  -9.614  11.493
  579   2HB   SER  71          1HB       SER  71  16.609  -9.918  11.405
  580    HG   SER  71           HG       SER  71  16.747  -8.451   9.911
  581    H    MET  72           H        MET  72  14.228  -9.259   8.889
  582    HA   MET  72           HA       MET  72  12.244  -8.915   7.835
  583   1HB   MET  72          2HB       MET  72  13.079 -11.082   6.679
  584   2HB   MET  72          1HB       MET  72  11.853 -11.889   7.645
  585   1HG   MET  72          2HG       MET  72  10.817  -9.563   6.258
  586   2HG   MET  72          1HG       MET  72  11.504 -10.759   5.163
  587   1HE   MET  72          1HE       MET  72   8.904 -12.987   4.494
  588   2HE   MET  72          2HE       MET  72  10.249 -13.694   5.388
  589   3HE   MET  72          3HE       MET  72  10.539 -12.369   4.260
  590    H    LYS  73           H        LYS  73   9.893  -9.106   8.071
  591    HA   LYS  73           HA       LYS  73   8.743 -10.611  10.188
  592   1HB   LYS  73          2HB       LYS  73   8.039  -8.473  11.489
  593   2HB   LYS  73          1HB       LYS  73   9.623  -9.171  11.777
  594   1HG   LYS  73          2HG       LYS  73  10.539  -7.213  11.336
  595   2HG   LYS  73          1HG       LYS  73   9.939  -7.320   9.681
  596   1HD   LYS  73          2HD       LYS  73   8.453  -5.701  10.054
  597   2HD   LYS  73          1HD       LYS  73   7.822  -6.542  11.472
  598   1HE   LYS  73          2HE       LYS  73  10.436  -5.218  11.814
  599   2HE   LYS  73          1HE       LYS  73   9.060  -4.144  11.562
  600   1HZ   LYS  73          1HZ       LYS  73   9.760  -5.047  13.944
  601   2HZ   LYS  73          2HZ       LYS  73   8.703  -6.292  13.504
  602   3HZ   LYS  73          3HZ       LYS  73   8.155  -4.691  13.544
  603    H    SER  74           H        SER  74   8.248  -7.426   8.627
  604    HA   SER  74           HA       SER  74   5.905  -8.401   7.254
  605   1HB   SER  74          2HB       SER  74   5.495  -6.021   9.058
  606   2HB   SER  74          1HB       SER  74   4.281  -7.016   8.257
  607    HG   SER  74           HG       SER  74   4.278  -7.691  10.335
  608    H    LEU  75           H        LEU  75   4.841  -6.427   6.056
  609    HA   LEU  75           HA       LEU  75   7.031  -5.028   4.730
  610   1HB   LEU  75          2HB       LEU  75   4.133  -5.468   4.042
  611   2HB   LEU  75          1HB       LEU  75   5.127  -4.327   3.159
  612    HG   LEU  75           HG       LEU  75   6.719  -6.385   2.842
  613   1HD1  LEU  75          1HD1      LEU  75   4.237  -7.986   2.809
  614   2HD1  LEU  75          2HD1      LEU  75   4.949  -7.661   4.388
  615   3HD1  LEU  75          3HD1      LEU  75   5.899  -8.468   3.144
  616   1HD2  LEU  75          1HD2      LEU  75   5.950  -5.573   0.864
  617   2HD2  LEU  75          2HD2      LEU  75   4.266  -5.577   1.387
  618   3HD2  LEU  75          3HD2      LEU  75   5.042  -7.083   0.898
  619    H    ARG  76           H        ARG  76   7.408  -2.896   4.913
  620    HA   ARG  76           HA       ARG  76   5.681  -1.378   6.719
  621   1HB   ARG  76          2HB       ARG  76   7.592   0.293   6.658
  622   2HB   ARG  76          1HB       ARG  76   7.931  -1.260   7.405
  623   1HG   ARG  76          2HG       ARG  76   9.125  -1.997   5.451
  624   2HG   ARG  76          1HG       ARG  76   8.678  -0.527   4.581
  625   1HD   ARG  76          2HD       ARG  76  10.946  -0.328   5.376
  626   2HD   ARG  76          1HD       ARG  76   9.917   0.798   6.256
  627    HE   ARG  76           HE       ARG  76  11.197  -1.599   7.315
  628   1HH1  ARG  76          1HH1      ARG  76   9.059   1.125   7.877
  629   2HH1  ARG  76          2HH1      ARG  76   9.154   0.999   9.600
  630   1HH2  ARG  76          1HH2      ARG  76  11.313  -1.755   9.588
  631   2HH2  ARG  76          2HH2      ARG  76  10.432  -0.636  10.572
  632    H    ILE  77           H        ILE  77   4.027  -1.241   5.034
  633    HA   ILE  77           HA       ILE  77   4.615   0.756   2.958
  634    HB   ILE  77           HB       ILE  77   2.131  -0.944   3.174
  635   1HG1  ILE  77          2HG1      ILE  77   4.590  -1.475   1.490
  636   2HG1  ILE  77          1HG1      ILE  77   4.176  -2.355   2.957
  637   1HG2  ILE  77          1HG2      ILE  77   1.505   0.625   1.676
  638   2HG2  ILE  77          2HG2      ILE  77   2.426  -0.384   0.560
  639   3HG2  ILE  77          3HG2      ILE  77   3.166   1.054   1.266
  640   1HD1  ILE  77          1HD1      ILE  77   2.712  -2.336   0.337
  641   2HD1  ILE  77          2HD1      ILE  77   2.028  -3.003   1.821
  642   3HD1  ILE  77          3HD1      ILE  77   3.500  -3.694   1.140
  643    H    LEU  78           H        LEU  78   3.804   2.758   3.093
  644    HA   LEU  78           HA       LEU  78   1.793   3.302   5.181
  645   1HB   LEU  78          2HB       LEU  78   4.182   4.283   5.317
  646   2HB   LEU  78          1HB       LEU  78   3.660   5.359   4.036
  647    HG   LEU  78           HG       LEU  78   1.906   5.211   6.417
  648   1HD1  LEU  78          1HD1      LEU  78   4.194   7.044   6.716
  649   2HD1  LEU  78          2HD1      LEU  78   4.528   5.336   6.997
  650   3HD1  LEU  78          3HD1      LEU  78   3.279   6.155   7.934
  651   1HD2  LEU  78          1HD2      LEU  78   1.254   7.265   5.752
  652   2HD2  LEU  78          2HD2      LEU  78   1.935   6.746   4.211
  653   3HD2  LEU  78          3HD2      LEU  78   2.886   7.757   5.297
  654    H    LEU  79           H        LEU  79  -0.164   3.798   4.428
  655    HA   LEU  79           HA       LEU  79  -0.391   4.932   1.723
  656   1HB   LEU  79          2HB       LEU  79  -2.732   4.192   1.781
  657   2HB   LEU  79          1HB       LEU  79  -1.608   2.865   1.998
  658    HG   LEU  79           HG       LEU  79  -2.162   3.559   4.593
  659   1HD1  LEU  79          1HD1      LEU  79  -4.796   3.465   4.395
  660   2HD1  LEU  79          2HD1      LEU  79  -4.468   4.299   2.876
  661   3HD1  LEU  79          3HD1      LEU  79  -3.918   4.995   4.398
  662   1HD2  LEU  79          1HD2      LEU  79  -3.993   1.612   3.331
  663   2HD2  LEU  79          2HD2      LEU  79  -2.940   1.440   4.734
  664   3HD2  LEU  79          3HD2      LEU  79  -2.265   1.335   3.108
  665    H    LEU  80           H        LEU  80  -1.160   6.938   1.406
  666    HA   LEU  80           HA       LEU  80  -2.263   8.357   3.745
  667   1HB   LEU  80          2HB       LEU  80  -1.264  10.407   2.910
  668   2HB   LEU  80          1HB       LEU  80  -0.041   9.180   3.175
  669    HG   LEU  80           HG       LEU  80  -0.428   8.745   0.579
  670   1HD1  LEU  80          1HD1      LEU  80  -0.564  11.261  -0.300
  671   2HD1  LEU  80          2HD1      LEU  80  -1.618  11.401   1.107
  672   3HD1  LEU  80          3HD1      LEU  80  -1.981  10.222  -0.153
  673   1HD2  LEU  80          1HD2      LEU  80   1.182  11.167   1.095
  674   2HD2  LEU  80          2HD2      LEU  80   1.626   9.654   0.306
  675   3HD2  LEU  80          3HD2      LEU  80   1.568   9.746   2.066
  676    H    SER  81           H        SER  81  -3.721  10.133   3.266
  677    HA   SER  81           HA       SER  81  -5.555   9.410   1.123
  678   1HB   SER  81          2HB       SER  81  -6.099  11.653   3.032
  679   2HB   SER  81          1HB       SER  81  -7.216  10.482   2.330
  680    HG   SER  81           HG       SER  81  -5.827  10.366   4.663
  681    H    GLN  82           H        GLN  82  -6.279  10.855  -0.466
  682    HA   GLN  82           HA       GLN  82  -4.316  12.765  -1.304
  683   1HB   GLN  82          2HB       GLN  82  -5.799  11.176  -2.758
  684   2HB   GLN  82          1HB       GLN  82  -6.969  12.484  -2.654
  685   1HG   GLN  82          2HG       GLN  82  -5.901  13.017  -4.597
  686   2HG   GLN  82          1HG       GLN  82  -4.958  13.954  -3.441
  687   1HE2  GLN  82          1HE2      GLN  82  -2.882  13.229  -2.862
  688   2HE2  GLN  82          2HE2      GLN  82  -2.008  12.115  -3.853
  689    H    ASP  83           H        ASP  83  -6.476  13.109   0.993
  690    HA   ASP  83           HA       ASP  83  -7.619  15.662   0.268
  691   1HB   ASP  83          2HB       ASP  83  -8.436  13.676   1.958
  692   2HB   ASP  83          1HB       ASP  83  -7.733  14.817   3.097
  693    H    ARG  84           H        ARG  84  -7.444  17.101   2.647
  694    HA   ARG  84           HA       ARG  84  -4.552  17.533   2.993
  695   1HB   ARG  84          2HB       ARG  84  -6.696  19.527   2.333
  696   2HB   ARG  84          1HB       ARG  84  -5.262  20.029   3.217
  697   1HG   ARG  84          2HG       ARG  84  -4.039  20.082   1.365
  698   2HG   ARG  84          1HG       ARG  84  -4.564  18.464   0.893
  699   1HD   ARG  84          2HD       ARG  84  -6.439  19.284  -0.248
  700   2HD   ARG  84          1HD       ARG  84  -6.346  20.855   0.545
  701    HE   ARG  84           HE       ARG  84  -4.820  21.529  -1.024
  702   1HH1  ARG  84          1HH1      ARG  84  -5.164  18.045  -1.212
  703   2HH1  ARG  84          2HH1      ARG  84  -4.234  17.908  -2.663
  704   1HH2  ARG  84          1HH2      ARG  84  -3.589  21.340  -2.936
  705   2HH2  ARG  84          2HH2      ARG  84  -3.337  19.780  -3.645
  706    H    ASN  85           H        ASN  85  -4.226  16.847   5.027
  707    HA   ASN  85           HA       ASN  85  -6.011  17.872   7.140
  708   1HB   ASN  85          2HB       ASN  85  -5.307  15.917   8.490
  709   2HB   ASN  85          1HB       ASN  85  -6.113  15.445   6.998
  710   1HD2  ASN  85          1HD2      ASN  85  -3.670  14.644   8.960
  711   2HD2  ASN  85          2HD2      ASN  85  -2.590  13.913   7.827
  712    H    LEU  86           H        LEU  86  -3.790  19.344   6.032
  713    HA   LEU  86           HA       LEU  86  -1.672  19.181   8.017
  714   1HB   LEU  86          2HB       LEU  86  -1.437  19.653   5.466
  715   2HB   LEU  86          1HB       LEU  86  -1.872  21.294   5.898
  716    HG   LEU  86           HG       LEU  86   0.280  20.252   7.569
  717   1HD1  LEU  86          1HD1      LEU  86   1.099  20.735   4.744
  718   2HD1  LEU  86          2HD1      LEU  86   0.548  19.130   5.220
  719   3HD1  LEU  86          3HD1      LEU  86   1.935  19.860   6.027
  720   1HD2  LEU  86          1HD2      LEU  86  -0.293  22.676   5.911
  721   2HD2  LEU  86          2HD2      LEU  86   1.322  22.399   6.562
  722   3HD2  LEU  86          3HD2      LEU  86  -0.057  22.544   7.652
  723    H    GLU  87           H        GLU  87  -0.954  21.121   9.183
  724    HA   GLU  87           HA       GLU  87  -2.988  23.176   9.604
  725   1HB   GLU  87          2HB       GLU  87  -2.338  21.044  11.499
  726   2HB   GLU  87          1HB       GLU  87  -2.168  22.650  12.192
  727   1HG   GLU  87          2HG       GLU  87  -4.360  22.893  12.377
  728   2HG   GLU  87          1HG       GLU  87  -4.615  22.450  10.690
  729    H    HIS  88           H        HIS  88  -2.172  24.989  10.968
  730    HA   HIS  88           HA       HIS  88   0.752  25.211  11.041
  731   1HB   HIS  88          2HB       HIS  88  -1.089  27.217   9.719
  732   2HB   HIS  88          1HB       HIS  88   0.610  27.505  10.070
  733    HD1  HIS  88           HD1      HIS  88  -1.645  25.954   7.617
  734    HD2  HIS  88           HD2      HIS  88   2.412  25.901   8.505
  735    HE1  HIS  88           HE1      HIS  88  -0.527  24.975   5.590
  736    HE2  HIS  88           HE2      HIS  88   1.918  24.855   6.193
  737    H    HIS  89           H        HIS  89   1.306  25.776  13.044
  738    HA   HIS  89           HA       HIS  89  -0.228  27.860  14.416
  739   1HB   HIS  89          2HB       HIS  89   0.502  25.224  15.716
  740   2HB   HIS  89          1HB       HIS  89  -0.257  26.592  16.518
  741    HD1  HIS  89           HD1      HIS  89  -1.069  23.489  14.938
  742    HD2  HIS  89           HD2      HIS  89  -2.901  27.206  15.240
  743    HE1  HIS  89           HE1      HIS  89  -3.490  23.090  14.391
  744    HE2  HIS  89           HE2      HIS  89  -4.579  25.354  14.573
  745    H    HIS  90           H        HIS  90   2.338  27.941  13.114
  746    HA   HIS  90           HA       HIS  90   3.965  28.779  15.397
  747   1HB   HIS  90          2HB       HIS  90   4.961  26.988  13.167
  748   2HB   HIS  90          1HB       HIS  90   5.995  27.775  14.353
  749    HD1  HIS  90           HD1      HIS  90   4.896  27.155  16.979
  750    HD2  HIS  90           HD2      HIS  90   4.655  24.413  13.865
  751    HE1  HIS  90           HE1      HIS  90   4.582  24.915  18.078
  752    HE2  HIS  90           HE2      HIS  90   4.513  23.262  16.177
  753    H    HIS  91           H        HIS  91   5.816  30.166  14.715
  754    HA   HIS  91           HA       HIS  91   4.974  31.886  12.497
  755   1HB   HIS  91          2HB       HIS  91   6.545  32.312  14.998
  756   2HB   HIS  91          1HB       HIS  91   6.897  33.346  13.618
  757    HD1  HIS  91           HD1      HIS  91   4.741  33.133  16.480
  758    HD2  HIS  91           HD2      HIS  91   4.397  34.663  12.630
  759    HE1  HIS  91           HE1      HIS  91   2.808  34.741  16.566
  760    HE2  HIS  91           HE2      HIS  91   2.665  35.707  14.243
  761    H    HIS  92           H        HIS  92   6.309  29.361  11.971
  762    HA   HIS  92           HA       HIS  92   8.406  30.364  10.256
  763   1HB   HIS  92          2HB       HIS  92   9.273  29.590  12.683
  764   2HB   HIS  92          1HB       HIS  92   9.273  28.026  11.875
  765    HD1  HIS  92           HD1      HIS  92  11.092  31.247  12.047
  766    HD2  HIS  92           HD2      HIS  92  11.116  27.809   9.712
  767    HE1  HIS  92           HE1      HIS  92  13.253  31.321  10.763
  768    HE2  HIS  92           HE2      HIS  92  13.278  29.197   9.408
  769    H    HIS  93           H        HIS  93   5.810  29.164   9.842
  770    HA   HIS  93           HA       HIS  93   6.615  27.008   8.077
  771   1HB   HIS  93          2HB       HIS  93   5.991  25.979  10.321
  772   2HB   HIS  93          1HB       HIS  93   4.351  26.543  10.023
  773    HD1  HIS  93           HD1      HIS  93   5.911  25.431   6.930
  774    HD2  HIS  93           HD2      HIS  93   3.854  23.650  10.072
  775    HE1  HIS  93           HE1      HIS  93   5.194  23.182   6.073
  776    HE2  HIS  93           HE2      HIS  93   3.907  22.140   7.973
  Start of MODEL    7
    1    H    GLN   1           H        GLN   1   5.982 -20.978   0.836
    2    HA   GLN   1           HA       GLN   1   4.483 -21.963   2.554
    3   1HB   GLN   1          2HB       GLN   1   4.015 -20.649   4.493
    4   2HB   GLN   1          1HB       GLN   1   5.754 -20.883   4.431
    5   1HG   GLN   1          2HG       GLN   1   5.501 -18.527   3.109
    6   2HG   GLN   1          1HG       GLN   1   4.163 -18.425   4.251
    7   1HE2  GLN   1          1HE2      GLN   1   4.668 -18.735   6.526
    8   2HE2  GLN   1          2HE2      GLN   1   6.216 -18.247   7.116
    9    H    SER   2           H        SER   2   5.141 -18.884   1.047
   10    HA   SER   2           HA       SER   2   3.907 -17.501  -0.240
   11   1HB   SER   2          2HB       SER   2   2.470 -20.088  -0.483
   12   2HB   SER   2          1HB       SER   2   1.605 -18.647  -1.014
   13    HG   SER   2           HG       SER   2   3.759 -19.923  -2.141
   14    H    ASP   3           H        ASP   3   3.721 -16.333   1.835
   15    HA   ASP   3           HA       ASP   3   1.048 -15.456   2.248
   16   1HB   ASP   3          2HB       ASP   3   2.007 -17.564   3.968
   17   2HB   ASP   3          1HB       ASP   3   1.745 -16.102   4.913
   18    H    VAL   4           H        VAL   4   2.180 -13.552   1.594
   19    HA   VAL   4           HA       VAL   4   4.266 -12.489   3.272
   20    HB   VAL   4           HB       VAL   4   2.720 -11.051   1.109
   21   1HG1  VAL   4          1HG1      VAL   4   5.459 -10.491   2.238
   22   2HG1  VAL   4          2HG1      VAL   4   3.988  -9.641   2.711
   23   3HG1  VAL   4          3HG1      VAL   4   4.578  -9.529   1.053
   24   1HG2  VAL   4          1HG2      VAL   4   4.212 -13.281   0.679
   25   2HG2  VAL   4          2HG2      VAL   4   5.433 -12.020   0.517
   26   3HG2  VAL   4          3HG2      VAL   4   3.992 -11.985  -0.496
   27    H    ARG   5           H        ARG   5   4.006 -11.312   5.044
   28    HA   ARG   5           HA       ARG   5   1.328 -10.396   5.765
   29   1HB   ARG   5          2HB       ARG   5   3.881 -10.579   7.374
   30   2HB   ARG   5          1HB       ARG   5   2.340 -10.023   8.009
   31   1HG   ARG   5          2HG       ARG   5   1.367 -12.156   7.817
   32   2HG   ARG   5          1HG       ARG   5   2.669 -12.741   6.778
   33   1HD   ARG   5          2HD       ARG   5   3.244 -11.819   9.568
   34   2HD   ARG   5          1HD       ARG   5   2.625 -13.440   9.274
   35    HE   ARG   5           HE       ARG   5   4.626 -14.006   8.224
   36   1HH1  ARG   5          1HH1      ARG   5   4.663 -10.647   9.239
   37   2HH1  ARG   5          2HH1      ARG   5   6.370 -10.476   9.017
   38   1HH2  ARG   5          1HH2      ARG   5   6.876 -13.767   7.944
   39   2HH2  ARG   5          2HH2      ARG   5   7.626 -12.243   8.287
   40    H    ILE   6           H        ILE   6   0.853  -8.436   4.962
   41    HA   ILE   6           HA       ILE   6   2.928  -6.354   4.952
   42    HB   ILE   6           HB       ILE   6   0.215  -6.164   3.648
   43   1HG1  ILE   6          2HG1      ILE   6   1.957  -6.591   1.581
   44   2HG1  ILE   6          1HG1      ILE   6   2.601  -7.679   2.808
   45   1HG2  ILE   6          1HG2      ILE   6   1.809  -4.152   4.120
   46   2HG2  ILE   6          2HG2      ILE   6   1.001  -4.297   2.560
   47   3HG2  ILE   6          3HG2      ILE   6   2.691  -4.778   2.724
   48   1HD1  ILE   6          1HD1      ILE   6   0.867  -8.579   1.155
   49   2HD1  ILE   6          2HD1      ILE   6  -0.309  -7.680   2.113
   50   3HD1  ILE   6          3HD1      ILE   6   0.657  -8.949   2.866
   51    H    LYS   7           H        LYS   7   2.790  -4.568   6.197
   52    HA   LYS   7           HA       LYS   7   0.534  -4.400   8.065
   53   1HB   LYS   7          2HB       LYS   7   3.359  -3.360   8.144
   54   2HB   LYS   7          1HB       LYS   7   2.126  -2.745   9.238
   55   1HG   LYS   7          2HG       LYS   7   1.826  -4.889  10.233
   56   2HG   LYS   7          1HG       LYS   7   2.837  -5.660   9.007
   57   1HD   LYS   7          2HD       LYS   7   4.751  -4.278   9.816
   58   2HD   LYS   7          1HD       LYS   7   3.716  -3.701  11.124
   59   1HE   LYS   7          2HE       LYS   7   3.767  -6.613  10.853
   60   2HE   LYS   7          1HE       LYS   7   5.339  -5.911  11.225
   61   1HZ   LYS   7          1HZ       LYS   7   4.511  -6.165  13.312
   62   2HZ   LYS   7          2HZ       LYS   7   2.899  -5.968  12.840
   63   3HZ   LYS   7          3HZ       LYS   7   3.906  -4.618  12.992
   64    H    PHE   8           H        PHE   8  -1.016  -2.985   7.647
   65    HA   PHE   8           HA       PHE   8  -0.401  -0.631   5.986
   66   1HB   PHE   8          2HB       PHE   8  -3.001  -2.090   6.486
   67   2HB   PHE   8          1HB       PHE   8  -2.889  -0.569   5.609
   68    HD1  PHE   8           HD2      PHE   8  -2.062  -4.147   5.540
   69    HD2  PHE   8           HD1      PHE   8  -2.051  -0.485   3.369
   70    HE1  PHE   8           HE2      PHE   8  -1.616  -5.383   3.461
   71    HE2  PHE   8           HE1      PHE   8  -1.605  -1.716   1.288
   72    HZ   PHE   8           HZ       PHE   8  -1.384  -4.168   1.332
   73    H    GLU   9           H        GLU   9  -0.619   1.373   6.781
   74    HA   GLU   9           HA       GLU   9  -1.978   1.704   9.374
   75   1HB   GLU   9          2HB       GLU   9   0.719   1.870   9.073
   76   2HB   GLU   9          1HB       GLU   9   0.261   3.543   8.791
   77   1HG   GLU   9          2HG       GLU   9  -0.614   3.796  10.933
   78   2HG   GLU   9          1HG       GLU   9  -0.748   2.056  11.185
   79    H    HIS  10           H        HIS  10  -3.423   3.310   9.498
   80    HA   HIS  10           HA       HIS  10  -3.360   5.481   7.531
   81   1HB   HIS  10          2HB       HIS  10  -4.921   3.594   6.804
   82   2HB   HIS  10          1HB       HIS  10  -5.921   4.023   8.187
   83    HD1  HIS  10           HD1      HIS  10  -7.894   4.792   6.763
   84    HD2  HIS  10           HD2      HIS  10  -4.369   6.834   5.939
   85    HE1  HIS  10           HE1      HIS  10  -8.564   6.730   5.308
   86    HE2  HIS  10           HE2      HIS  10  -6.407   7.910   4.761
   87    H    ASN  11           H        ASN  11  -3.465   7.362   8.573
   88    HA   ASN  11           HA       ASN  11  -3.829   8.943  10.168
   89   1HB   ASN  11          2HB       ASN  11  -6.334   7.305  10.281
   90   2HB   ASN  11          1HB       ASN  11  -6.084   8.574  11.473
   91   1HD2  ASN  11          1HD2      ASN  11  -8.138   9.220  10.286
   92   2HD2  ASN  11          2HD2      ASN  11  -7.934  10.297   8.951
   93    H    GLY  12           H        GLY  12  -2.234   6.600  10.890
   94   1HA   GLY  12          2HA       GLY  12  -1.020   6.283  12.891
   95   2HA   GLY  12          1HA       GLY  12  -2.386   6.914  13.796
   96    H    GLU  13           H        GLU  13  -4.310   5.155  12.377
   97    HA   GLU  13           HA       GLU  13  -4.254   2.965  14.160
   98   1HB   GLU  13          2HB       GLU  13  -5.849   3.274  11.609
   99   2HB   GLU  13          1HB       GLU  13  -6.177   2.123  12.896
  100   1HG   GLU  13          2HG       GLU  13  -6.161   4.490  14.252
  101   2HG   GLU  13          1HG       GLU  13  -6.835   4.961  12.693
  102    H    ARG  14           H        ARG  14  -3.679   0.847  13.911
  103    HA   ARG  14           HA       ARG  14  -2.033   0.230  11.557
  104   1HB   ARG  14          2HB       ARG  14  -1.361   0.032  14.165
  105   2HB   ARG  14          1HB       ARG  14  -2.001  -1.584  13.902
  106   1HG   ARG  14          2HG       ARG  14  -0.439  -1.621  11.846
  107   2HG   ARG  14          1HG       ARG  14   0.364  -0.263  12.634
  108   1HD   ARG  14          2HD       ARG  14   0.130  -2.032  14.696
  109   2HD   ARG  14          1HD       ARG  14   0.359  -3.118  13.325
  110    HE   ARG  14           HE       ARG  14   2.540  -2.473  13.258
  111   1HH1  ARG  14          1HH1      ARG  14   0.741   0.007  14.948
  112   2HH1  ARG  14          2HH1      ARG  14   2.151   0.916  15.376
  113   1HH2  ARG  14          1HH2      ARG  14   4.401  -1.273  13.827
  114   2HH2  ARG  14          2HH2      ARG  14   4.231   0.188  14.740
  115    H    ARG  15           H        ARG  15  -2.152  -1.878  10.591
  116    HA   ARG  15           HA       ARG  15  -4.430  -3.563  11.208
  117   1HB   ARG  15          2HB       ARG  15  -5.018  -1.624   9.500
  118   2HB   ARG  15          1HB       ARG  15  -4.234  -2.702   8.355
  119   1HG   ARG  15          2HG       ARG  15  -6.362  -3.446   8.137
  120   2HG   ARG  15          1HG       ARG  15  -5.858  -4.470   9.483
  121   1HD   ARG  15          2HD       ARG  15  -7.833  -3.661  10.312
  122   2HD   ARG  15          1HD       ARG  15  -6.714  -2.442  10.921
  123    HE   ARG  15           HE       ARG  15  -7.837  -1.799   8.352
  124   1HH1  ARG  15          1HH1      ARG  15  -8.329  -1.613  11.813
  125   2HH1  ARG  15          2HH1      ARG  15  -9.392  -0.250  11.714
  126   1HH2  ARG  15          1HH2      ARG  15  -9.241  -0.000   8.229
  127   2HH2  ARG  15          2HH2      ARG  15  -9.910   0.664   9.682
  128    H    ILE  16           H        ILE  16  -4.208  -5.670  10.474
  129    HA   ILE  16           HA       ILE  16  -1.629  -6.296   9.185
  130    HB   ILE  16           HB       ILE  16  -3.234  -8.144  10.953
  131   1HG1  ILE  16          2HG1      ILE  16  -0.708  -6.704  11.756
  132   2HG1  ILE  16          1HG1      ILE  16  -2.306  -6.047  12.097
  133   1HG2  ILE  16          1HG2      ILE  16  -0.708  -8.360   9.438
  134   2HG2  ILE  16          2HG2      ILE  16  -1.898  -9.595   9.850
  135   3HG2  ILE  16          3HG2      ILE  16  -0.721  -9.070  11.053
  136   1HD1  ILE  16          1HD1      ILE  16  -2.333  -7.230  13.960
  137   2HD1  ILE  16          2HD1      ILE  16  -0.818  -8.021  13.525
  138   3HD1  ILE  16          3HD1      ILE  16  -2.353  -8.702  12.988
  139    H    ILE  17           H        ILE  17  -1.681  -7.284   7.250
  140    HA   ILE  17           HA       ILE  17  -4.059  -8.830   6.503
  141    HB   ILE  17           HB       ILE  17  -2.798  -6.859   4.597
  142   1HG1  ILE  17          2HG1      ILE  17  -5.346  -6.562   6.209
  143   2HG1  ILE  17          1HG1      ILE  17  -3.866  -5.638   6.447
  144   1HG2  ILE  17          1HG2      ILE  17  -5.457  -8.264   4.426
  145   2HG2  ILE  17          2HG2      ILE  17  -3.979  -8.879   3.689
  146   3HG2  ILE  17          3HG2      ILE  17  -4.643  -7.331   3.170
  147   1HD1  ILE  17          1HD1      ILE  17  -4.339  -4.233   4.778
  148   2HD1  ILE  17          2HD1      ILE  17  -5.985  -4.833   4.964
  149   3HD1  ILE  17          3HD1      ILE  17  -4.933  -5.515   3.726
  150    H    ALA  18           H        ALA  18  -3.533 -10.751   5.699
  151    HA   ALA  18           HA       ALA  18  -0.804 -11.141   4.652
  152   1HB   ALA  18          1HB       ALA  18  -2.361 -13.506   5.491
  153   2HB   ALA  18          2HB       ALA  18  -1.871 -12.403   6.776
  154   3HB   ALA  18          3HB       ALA  18  -0.655 -13.125   5.722
  155    H    PHE  19           H        PHE  19  -0.552 -11.828   2.610
  156    HA   PHE  19           HA       PHE  19  -2.896 -12.910   1.189
  157   1HB   PHE  19          2HB       PHE  19  -0.941 -10.811   0.243
  158   2HB   PHE  19          1HB       PHE  19  -1.967 -11.717  -0.864
  159    HD1  PHE  19           HD2      PHE  19  -4.550 -11.797   0.166
  160    HD2  PHE  19           HD1      PHE  19  -1.682  -8.683   0.615
  161    HE1  PHE  19           HE2      PHE  19  -6.367 -10.178   0.524
  162    HE2  PHE  19           HE1      PHE  19  -3.495  -7.060   0.974
  163    HZ   PHE  19           HZ       PHE  19  -5.840  -7.807   0.928
  164    H    SER  20           H        SER  20  -2.541 -14.807   0.232
  165    HA   SER  20           HA       SER  20  -0.023 -16.108   0.394
  166   1HB   SER  20          2HB       SER  20  -2.253 -17.262   0.432
  167   2HB   SER  20          1HB       SER  20  -2.405 -16.919  -1.291
  168    HG   SER  20           HG       SER  20  -0.680 -18.243  -1.706
  169    H    ARG  21           H        ARG  21   1.635 -16.139  -0.990
  170    HA   ARG  21           HA       ARG  21   1.624 -14.486  -3.307
  171   1HB   ARG  21          2HB       ARG  21   3.608 -16.239  -1.943
  172   2HB   ARG  21          1HB       ARG  21   3.911 -15.827  -3.624
  173   1HG   ARG  21          2HG       ARG  21   3.511 -13.393  -2.861
  174   2HG   ARG  21          1HG       ARG  21   3.776 -14.032  -1.239
  175   1HD   ARG  21          2HD       ARG  21   5.765 -14.882  -3.218
  176   2HD   ARG  21          1HD       ARG  21   5.734 -13.144  -2.921
  177    HE   ARG  21           HE       ARG  21   5.721 -14.423  -0.445
  178   1HH1  ARG  21          1HH1      ARG  21   7.867 -14.085  -3.190
  179   2HH1  ARG  21          2HH1      ARG  21   9.307 -14.229  -2.238
  180   1HH2  ARG  21          1HH2      ARG  21   7.620 -14.615   0.802
  181   2HH2  ARG  21          2HH2      ARG  21   9.169 -14.528   0.028
  182    HA   PRO  22           HA       PRO  22   2.952 -14.398  -5.222
  183   1HB   PRO  22          2HB       PRO  22   1.600 -14.201  -7.790
  184   2HB   PRO  22          1HB       PRO  22   3.319 -14.413  -7.456
  185   1HG   PRO  22          2HG       PRO  22   1.777 -16.354  -8.571
  186   2HG   PRO  22          1HG       PRO  22   3.192 -16.700  -7.561
  187   1HD   PRO  22          2HD       PRO  22   0.284 -16.751  -6.833
  188   2HD   PRO  22          1HD       PRO  22   1.578 -17.886  -6.388
  189    H    VAL  23           H        VAL  23   2.229 -12.554  -4.372
  190    HA   VAL  23           HA       VAL  23  -0.562 -12.009  -4.088
  191    HB   VAL  23           HB       VAL  23   1.076 -11.356  -2.365
  192   1HG1  VAL  23          1HG1      VAL  23   1.950  -8.959  -3.846
  193   2HG1  VAL  23          2HG1      VAL  23   2.661 -10.490  -4.353
  194   3HG1  VAL  23          3HG1      VAL  23   2.818  -9.957  -2.679
  195   1HG2  VAL  23          1HG2      VAL  23  -0.884  -9.524  -3.558
  196   2HG2  VAL  23          2HG2      VAL  23   0.279  -8.764  -2.473
  197   3HG2  VAL  23          3HG2      VAL  23  -0.724 -10.095  -1.897
  198    H    LYS  24           H        LYS  24  -1.872 -10.761  -5.285
  199    HA   LYS  24           HA       LYS  24  -0.753  -9.545  -7.700
  200   1HB   LYS  24          2HB       LYS  24  -3.197 -10.920  -7.060
  201   2HB   LYS  24          1HB       LYS  24  -3.571  -9.327  -7.700
  202   1HG   LYS  24          2HG       LYS  24  -2.813  -9.824  -9.772
  203   2HG   LYS  24          1HG       LYS  24  -1.546 -10.896  -9.172
  204   1HD   LYS  24          2HD       LYS  24  -2.897 -12.720  -9.174
  205   2HD   LYS  24          1HD       LYS  24  -4.334 -11.788  -8.751
  206   1HE   LYS  24          2HE       LYS  24  -3.045 -11.604 -11.461
  207   2HE   LYS  24          1HE       LYS  24  -4.249 -12.832 -11.081
  208   1HZ   LYS  24          1HZ       LYS  24  -5.538 -10.683 -10.250
  209   2HZ   LYS  24          2HZ       LYS  24  -5.621 -11.226 -11.850
  210   3HZ   LYS  24          3HZ       LYS  24  -4.580  -9.957 -11.441
  211    H    TYR  25           H        TYR  25  -0.559  -7.417  -7.939
  212    HA   TYR  25           HA       TYR  25  -0.918  -5.564  -5.904
  213   1HB   TYR  25          2HB       TYR  25   0.532  -5.185  -7.851
  214   2HB   TYR  25          1HB       TYR  25  -0.880  -5.070  -8.892
  215    HD1  TYR  25           HD1      TYR  25   1.078  -3.379  -6.277
  216    HD2  TYR  25           HD2      TYR  25  -2.216  -3.061  -8.953
  217    HE1  TYR  25           HE1      TYR  25   1.000  -0.953  -5.886
  218    HE2  TYR  25           HE2      TYR  25  -2.303  -0.636  -8.568
  219    HH   TYR  25           HH       TYR  25   0.174   1.084  -7.087
  220    H    GLU  26           H        GLU  26  -3.078  -6.352  -8.610
  221    HA   GLU  26           HA       GLU  26  -5.030  -4.393  -8.136
  222   1HB   GLU  26          2HB       GLU  26  -5.403  -7.151  -9.319
  223   2HB   GLU  26          1HB       GLU  26  -6.530  -5.812  -9.463
  224   1HG   GLU  26          2HG       GLU  26  -3.969  -4.945 -10.356
  225   2HG   GLU  26          1HG       GLU  26  -4.365  -6.473 -11.143
  226    H    ASP  27           H        ASP  27  -4.627  -7.648  -6.814
  227    HA   ASP  27           HA       ASP  27  -7.120  -7.724  -5.458
  228   1HB   ASP  27          2HB       ASP  27  -5.434  -9.655  -6.055
  229   2HB   ASP  27          1HB       ASP  27  -4.750  -9.273  -4.477
  230    H    VAL  28           H        VAL  28  -3.826  -6.859  -4.429
  231    HA   VAL  28           HA       VAL  28  -4.447  -6.428  -1.711
  232    HB   VAL  28           HB       VAL  28  -2.273  -5.016  -3.267
  233   1HG1  VAL  28          1HG1      VAL  28  -2.023  -5.856  -0.421
  234   2HG1  VAL  28          2HG1      VAL  28  -2.985  -4.426  -0.798
  235   3HG1  VAL  28          3HG1      VAL  28  -1.287  -4.496  -1.267
  236   1HG2  VAL  28          1HG2      VAL  28  -2.573  -7.830  -2.555
  237   2HG2  VAL  28          2HG2      VAL  28  -1.072  -7.116  -1.966
  238   3HG2  VAL  28          3HG2      VAL  28  -1.462  -7.057  -3.684
  239    H    GLU  29           H        GLU  29  -4.274  -4.170  -4.463
  240    HA   GLU  29           HA       GLU  29  -4.918  -1.856  -2.988
  241   1HB   GLU  29          2HB       GLU  29  -5.276  -0.773  -5.106
  242   2HB   GLU  29          1HB       GLU  29  -3.897  -1.851  -5.261
  243   1HG   GLU  29          2HG       GLU  29  -5.189  -3.449  -6.465
  244   2HG   GLU  29          1HG       GLU  29  -6.681  -2.567  -6.147
  245    H    HIS  30           H        HIS  30  -6.936  -4.269  -4.594
  246    HA   HIS  30           HA       HIS  30  -9.378  -2.929  -4.542
  247   1HB   HIS  30          2HB       HIS  30  -8.491  -5.556  -5.107
  248   2HB   HIS  30          1HB       HIS  30  -9.797  -5.708  -3.937
  249    HD1  HIS  30           HD1      HIS  30 -12.137  -4.698  -4.666
  250    HD2  HIS  30           HD2      HIS  30  -9.267  -4.902  -7.665
  251    HE1  HIS  30           HE1      HIS  30 -13.397  -4.412  -6.823
  252    HE2  HIS  30           HE2      HIS  30 -11.651  -4.614  -8.628
  253    H    LYS  31           H        LYS  31  -7.866  -4.953  -2.038
  254    HA   LYS  31           HA       LYS  31 -10.016  -4.731  -0.199
  255   1HB   LYS  31          2HB       LYS  31  -7.991  -6.407  -0.290
  256   2HB   LYS  31          1HB       LYS  31  -7.203  -5.199   0.715
  257   1HG   LYS  31          2HG       LYS  31  -9.611  -5.485   1.966
  258   2HG   LYS  31          1HG       LYS  31  -9.303  -7.119   1.375
  259   1HD   LYS  31          2HD       LYS  31  -7.777  -7.466   2.957
  260   2HD   LYS  31          1HD       LYS  31  -6.906  -5.996   2.508
  261   1HE   LYS  31          2HE       LYS  31  -7.852  -4.776   4.157
  262   2HE   LYS  31          1HE       LYS  31  -9.412  -5.581   3.999
  263   1HZ   LYS  31          1HZ       LYS  31  -8.775  -7.278   5.402
  264   2HZ   LYS  31          2HZ       LYS  31  -8.022  -5.943   6.117
  265   3HZ   LYS  31          3HZ       LYS  31  -7.119  -7.014   5.171
  266    H    VAL  32           H        VAL  32  -6.876  -3.046  -0.428
  267    HA   VAL  32           HA       VAL  32  -7.253  -1.410   1.831
  268    HB   VAL  32           HB       VAL  32  -5.585  -0.783  -0.612
  269   1HG1  VAL  32          1HG1      VAL  32  -4.299   0.650   0.897
  270   2HG1  VAL  32          2HG1      VAL  32  -5.412   0.273   2.213
  271   3HG1  VAL  32          3HG1      VAL  32  -5.982   1.171   0.806
  272   1HG2  VAL  32          1HG2      VAL  32  -5.045  -2.963   0.426
  273   2HG2  VAL  32          2HG2      VAL  32  -4.767  -2.137   1.959
  274   3HG2  VAL  32          3HG2      VAL  32  -3.736  -1.792   0.571
  275    H    THR  33           H        THR  33  -8.090  -0.895  -1.582
  276    HA   THR  33           HA       THR  33  -8.850   1.797  -1.364
  277    HB   THR  33           HB       THR  33  -9.831  -0.350  -3.258
  278    HG1  THR  33           HG1      THR  33  -7.887  -0.056  -3.977
  279   1HG2  THR  33          1HG2      THR  33 -11.143   1.970  -2.968
  280   2HG2  THR  33          2HG2      THR  33 -10.963   1.131  -4.508
  281   3HG2  THR  33          3HG2      THR  33  -9.883   2.465  -4.101
  282    H    THR  34           H        THR  34 -10.828  -1.171  -1.046
  283    HA   THR  34           HA       THR  34 -13.219   0.293  -0.487
  284    HB   THR  34           HB       THR  34 -12.674  -2.608   0.156
  285    HG1  THR  34           HG1      THR  34 -13.546  -1.414  -2.263
  286   1HG2  THR  34          1HG2      THR  34 -14.763  -2.616   0.888
  287   2HG2  THR  34          2HG2      THR  34 -15.270  -2.309  -0.772
  288   3HG2  THR  34          3HG2      THR  34 -15.033  -0.963   0.339
  289    H    VAL  35           H        VAL  35 -10.877  -1.425   1.568
  290    HA   VAL  35           HA       VAL  35 -12.283  -1.001   3.986
  291    HB   VAL  35           HB       VAL  35  -9.327  -1.493   3.597
  292   1HG1  VAL  35          1HG1      VAL  35  -9.808  -2.519   6.002
  293   2HG1  VAL  35          2HG1      VAL  35 -11.039  -1.256   6.008
  294   3HG1  VAL  35          3HG1      VAL  35  -9.344  -0.833   5.774
  295   1HG2  VAL  35          1HG2      VAL  35  -9.739  -3.696   3.415
  296   2HG2  VAL  35          2HG2      VAL  35 -11.339  -3.171   2.896
  297   3HG2  VAL  35          3HG2      VAL  35 -11.069  -3.652   4.571
  298    H    PHE  36           H        PHE  36  -9.612   0.808   2.459
  299    HA   PHE  36           HA       PHE  36  -9.846   2.844   4.555
  300   1HB   PHE  36          2HB       PHE  36  -7.744   2.517   2.408
  301   2HB   PHE  36          1HB       PHE  36  -7.712   3.702   3.708
  302    HD1  PHE  36           HD2      PHE  36  -7.880   0.016   3.151
  303    HD2  PHE  36           HD1      PHE  36  -6.606   3.203   5.666
  304    HE1  PHE  36           HE2      PHE  36  -6.723  -1.596   4.599
  305    HE2  PHE  36           HE1      PHE  36  -5.444   1.596   7.119
  306    HZ   PHE  36           HZ       PHE  36  -5.507  -0.806   6.586
  307    H    GLY  37           H        GLY  37 -11.451   2.374   1.778
  308   1HA   GLY  37          2HA       GLY  37 -12.724   3.828   0.522
  309   2HA   GLY  37          1HA       GLY  37 -12.098   5.145   1.500
  310    H    GLN  38           H        GLN  38 -12.457   5.714  -1.076
  311    HA   GLN  38           HA       GLN  38  -9.712   5.853  -2.104
  312   1HB   GLN  38          2HB       GLN  38 -10.584   5.565  -4.424
  313   2HB   GLN  38          1HB       GLN  38 -10.729   4.127  -3.427
  314   1HG   GLN  38          2HG       GLN  38 -13.013   4.233  -3.356
  315   2HG   GLN  38          1HG       GLN  38 -13.051   5.977  -3.611
  316   1HE2  GLN  38          1HE2      GLN  38 -13.374   2.946  -5.048
  317   2HE2  GLN  38          2HE2      GLN  38 -13.416   3.455  -6.698
  318    HA   PRO  39           HA       PRO  39  -8.964   6.589  -4.055
  319   1HB   PRO  39          2HB       PRO  39  -7.432   8.549  -5.008
  320   2HB   PRO  39          1HB       PRO  39  -8.975   8.145  -5.770
  321   1HG   PRO  39          2HG       PRO  39  -8.287  10.420  -3.971
  322   2HG   PRO  39          1HG       PRO  39  -9.381  10.379  -5.364
  323   1HD   PRO  39          2HD       PRO  39 -10.129  10.202  -2.666
  324   2HD   PRO  39          1HD       PRO  39 -11.150   9.807  -4.061
  325    H    LEU  40           H        LEU  40  -6.832   6.068  -3.504
  326    HA   LEU  40           HA       LEU  40  -5.706   7.477  -1.168
  327   1HB   LEU  40          2HB       LEU  40  -6.013   4.540  -1.694
  328   2HB   LEU  40          1HB       LEU  40  -4.722   5.120  -0.663
  329    HG   LEU  40           HG       LEU  40  -7.568   5.891  -0.110
  330   1HD1  LEU  40          1HD1      LEU  40  -7.335   3.389  -0.353
  331   2HD1  LEU  40          2HD1      LEU  40  -7.909   3.963   1.211
  332   3HD1  LEU  40          3HD1      LEU  40  -6.234   3.446   1.022
  333   1HD2  LEU  40          1HD2      LEU  40  -5.457   6.906   1.001
  334   2HD2  LEU  40          2HD2      LEU  40  -5.390   5.377   1.874
  335   3HD2  LEU  40          3HD2      LEU  40  -6.810   6.410   2.019
  336    H    ASP  41           H        ASP  41  -3.357   7.225  -0.912
  337    HA   ASP  41           HA       ASP  41  -2.010   6.984  -3.523
  338   1HB   ASP  41          2HB       ASP  41  -2.057   9.192  -1.966
  339   2HB   ASP  41          1HB       ASP  41  -0.634   8.391  -1.303
  340    H    LEU  42           H        LEU  42  -0.568   5.395  -3.768
  341    HA   LEU  42           HA       LEU  42   0.134   3.763  -1.458
  342   1HB   LEU  42          2HB       LEU  42   0.694   3.347  -4.400
  343   2HB   LEU  42          1HB       LEU  42   1.052   2.195  -3.128
  344    HG   LEU  42           HG       LEU  42  -1.543   2.406  -2.658
  345   1HD1  LEU  42          1HD1      LEU  42  -2.286   3.990  -4.158
  346   2HD1  LEU  42          2HD1      LEU  42  -2.608   2.491  -5.031
  347   3HD1  LEU  42          3HD1      LEU  42  -1.189   3.457  -5.431
  348   1HD2  LEU  42          1HD2      LEU  42   0.015   0.733  -4.541
  349   2HD2  LEU  42          2HD2      LEU  42  -1.742   0.624  -4.634
  350   3HD2  LEU  42          3HD2      LEU  42  -0.916   0.274  -3.116
  351    H    HIS  43           H        HIS  43   1.696   4.845  -0.320
  352    HA   HIS  43           HA       HIS  43   4.186   5.481  -1.764
  353   1HB   HIS  43          2HB       HIS  43   2.913   7.394  -0.663
  354   2HB   HIS  43          1HB       HIS  43   3.348   6.670   0.880
  355    HD1  HIS  43           HD1      HIS  43   5.954   6.477  -1.730
  356    HD2  HIS  43           HD2      HIS  43   4.867   9.057   1.342
  357    HE1  HIS  43           HE1      HIS  43   7.933   7.985  -1.386
  358    HE2  HIS  43           HE2      HIS  43   7.262   9.529   0.488
  359    H    TYR  44           H        TYR  44   5.890   4.237  -1.320
  360    HA   TYR  44           HA       TYR  44   5.846   2.622   1.134
  361   1HB   TYR  44          2HB       TYR  44   5.950   1.226  -0.791
  362   2HB   TYR  44          1HB       TYR  44   7.188   2.225  -1.539
  363    HD1  TYR  44           HD1      TYR  44   9.504   2.233  -0.547
  364    HD2  TYR  44           HD2      TYR  44   6.533  -0.581   0.617
  365    HE1  TYR  44           HE1      TYR  44  11.257   0.769   0.369
  366    HE2  TYR  44           HE2      TYR  44   8.274  -2.049   1.539
  367    HH   TYR  44           HH       TYR  44  10.624  -1.795   2.425
  368    H    MET  45           H        MET  45   7.313   2.954   2.680
  369    HA   MET  45           HA       MET  45   9.739   4.485   2.035
  370   1HB   MET  45          2HB       MET  45   9.515   5.666   4.217
  371   2HB   MET  45          1HB       MET  45   8.247   6.067   3.069
  372   1HG   MET  45          2HG       MET  45   6.814   5.668   4.711
  373   2HG   MET  45          1HG       MET  45   7.177   3.959   4.481
  374   1HE   MET  45          1HE       MET  45   6.448   4.485   7.905
  375   2HE   MET  45          2HE       MET  45   7.476   3.058   7.777
  376   3HE   MET  45          3HE       MET  45   6.337   3.443   6.487
  377    H    ASN  46           H        ASN  46  11.500   3.383   2.563
  378    HA   ASN  46           HA       ASN  46  11.300   1.079   4.310
  379   1HB   ASN  46          2HB       ASN  46  12.649   1.292   2.084
  380   2HB   ASN  46          1HB       ASN  46  13.876   2.037   3.104
  381   1HD2  ASN  46          1HD2      ASN  46  13.313  -0.696   1.649
  382   2HD2  ASN  46          2HD2      ASN  46  13.891  -1.840   2.807
  383    H    ASN  47           H        ASN  47  13.713   3.718   4.159
  384    HA   ASN  47           HA       ASN  47  13.423   4.180   7.011
  385   1HB   ASN  47          2HB       ASN  47  15.677   2.705   5.849
  386   2HB   ASN  47          1HB       ASN  47  16.174   4.082   6.823
  387   1HD2  ASN  47          1HD2      ASN  47  17.065   2.013   7.925
  388   2HD2  ASN  47          2HD2      ASN  47  16.089   1.397   9.209
  389    H    GLU  48           H        GLU  48  16.010   4.911   4.679
  390    HA   GLU  48           HA       GLU  48  15.454   7.775   5.082
  391   1HB   GLU  48          2HB       GLU  48  18.010   6.312   4.424
  392   2HB   GLU  48          1HB       GLU  48  17.850   8.055   4.273
  393   1HG   GLU  48          2HG       GLU  48  18.281   8.313   6.425
  394   2HG   GLU  48          1HG       GLU  48  16.917   7.282   6.849
  395    H    LEU  49           H        LEU  49  14.734   5.467   2.908
  396    HA   LEU  49           HA       LEU  49  14.925   7.349   0.659
  397   1HB   LEU  49          2HB       LEU  49  15.360   5.518  -0.871
  398   2HB   LEU  49          1HB       LEU  49  16.603   5.599   0.360
  399    HG   LEU  49           HG       LEU  49  14.376   3.751   0.947
  400   1HD1  LEU  49          1HD1      LEU  49  14.894   3.589  -1.574
  401   2HD1  LEU  49          2HD1      LEU  49  14.879   2.111  -0.613
  402   3HD1  LEU  49          3HD1      LEU  49  16.414   2.858  -1.055
  403   1HD2  LEU  49          1HD2      LEU  49  17.361   3.347   1.000
  404   2HD2  LEU  49          2HD2      LEU  49  16.129   2.403   1.836
  405   3HD2  LEU  49          3HD2      LEU  49  16.447   4.068   2.324
  406    H    SER  50           H        SER  50  13.157   7.524  -0.643
  407    HA   SER  50           HA       SER  50  10.799   5.931   0.126
  408   1HB   SER  50          2HB       SER  50  10.407   8.538  -1.248
  409   2HB   SER  50          1HB       SER  50   9.472   7.794   0.048
  410    HG   SER  50           HG       SER  50  10.480   9.257   1.199
  411    H    ILE  51           H        ILE  51   9.866   4.718  -1.403
  412    HA   ILE  51           HA       ILE  51  10.450   5.316  -4.228
  413    HB   ILE  51           HB       ILE  51  10.266   2.519  -3.101
  414   1HG1  ILE  51          2HG1      ILE  51  12.805   3.825  -4.061
  415   2HG1  ILE  51          1HG1      ILE  51  12.303   3.953  -2.381
  416   1HG2  ILE  51          1HG2      ILE  51  11.418   2.060  -5.360
  417   2HG2  ILE  51          2HG2      ILE  51  10.833   3.660  -5.811
  418   3HG2  ILE  51          3HG2      ILE  51   9.689   2.401  -5.350
  419   1HD1  ILE  51          1HD1      ILE  51  12.760   1.779  -1.936
  420   2HD1  ILE  51          2HD1      ILE  51  13.921   2.048  -3.236
  421   3HD1  ILE  51          3HD1      ILE  51  12.388   1.246  -3.576
  422    H    LEU  52           H        LEU  52   8.747   5.271  -5.582
  423    HA   LEU  52           HA       LEU  52   6.114   4.752  -4.424
  424   1HB   LEU  52          2HB       LEU  52   6.929   6.032  -7.035
  425   2HB   LEU  52          1HB       LEU  52   5.273   5.853  -6.486
  426    HG   LEU  52           HG       LEU  52   7.323   7.384  -4.899
  427   1HD1  LEU  52          1HD1      LEU  52   7.382   8.740  -6.716
  428   2HD1  LEU  52          2HD1      LEU  52   5.891   9.345  -5.996
  429   3HD1  LEU  52          3HD1      LEU  52   5.822   8.186  -7.323
  430   1HD2  LEU  52          1HD2      LEU  52   5.185   6.585  -3.839
  431   2HD2  LEU  52          2HD2      LEU  52   4.325   7.638  -4.961
  432   3HD2  LEU  52          3HD2      LEU  52   5.449   8.329  -3.791
  433    H    LEU  53           H        LEU  53   4.832   3.080  -4.997
  434    HA   LEU  53           HA       LEU  53   5.697   1.413  -7.266
  435   1HB   LEU  53          2HB       LEU  53   4.795  -0.554  -5.990
  436   2HB   LEU  53          1HB       LEU  53   6.261   0.160  -5.347
  437    HG   LEU  53           HG       LEU  53   4.177   1.442  -3.983
  438   1HD1  LEU  53          1HD1      LEU  53   3.650  -1.386  -3.429
  439   2HD1  LEU  53          2HD1      LEU  53   3.039  -0.818  -4.982
  440   3HD1  LEU  53          3HD1      LEU  53   2.546  -0.014  -3.493
  441   1HD2  LEU  53          1HD2      LEU  53   6.239   0.989  -2.934
  442   2HD2  LEU  53          2HD2      LEU  53   6.116  -0.739  -3.263
  443   3HD2  LEU  53          3HD2      LEU  53   5.046   0.011  -2.079
  444    H    LYS  54           H        LYS  54   4.241   2.397  -8.675
  445    HA   LYS  54           HA       LYS  54   1.395   2.241  -8.047
  446   1HB   LYS  54          2HB       LYS  54   1.040   3.540 -10.076
  447   2HB   LYS  54          1HB       LYS  54   2.232   4.318  -9.046
  448   1HG   LYS  54          2HG       LYS  54   3.843   2.844 -10.646
  449   2HG   LYS  54          1HG       LYS  54   2.505   3.186 -11.744
  450   1HD   LYS  54          2HD       LYS  54   4.083   4.942 -12.017
  451   2HD   LYS  54          1HD       LYS  54   2.735   5.609 -11.094
  452   1HE   LYS  54          2HE       LYS  54   3.987   5.927  -9.245
  453   2HE   LYS  54          1HE       LYS  54   4.894   4.434  -9.478
  454   1HZ   LYS  54          1HZ       LYS  54   6.330   6.343  -9.712
  455   2HZ   LYS  54          2HZ       LYS  54   5.342   6.993 -10.919
  456   3HZ   LYS  54          3HZ       LYS  54   6.188   5.556 -11.205
  457    H    ASN  55           H        ASN  55   3.796   0.764 -10.132
  458    HA   ASN  55           HA       ASN  55   1.736  -0.882 -11.417
  459   1HB   ASN  55          2HB       ASN  55   4.524  -0.092 -12.134
  460   2HB   ASN  55          1HB       ASN  55   3.941  -1.649 -12.707
  461   1HD2  ASN  55          1HD2      ASN  55   4.343  -0.534 -14.796
  462   2HD2  ASN  55          2HD2      ASN  55   3.051   0.397 -15.470
  463    H    GLN  56           H        GLN  56   2.349  -3.216 -11.785
  464    HA   GLN  56           HA       GLN  56   2.752  -4.500  -9.297
  465   1HB   GLN  56          2HB       GLN  56   1.822  -5.256 -11.816
  466   2HB   GLN  56          1HB       GLN  56   3.271  -6.223 -11.581
  467   1HG   GLN  56          2HG       GLN  56   1.725  -6.258  -9.181
  468   2HG   GLN  56          1HG       GLN  56   0.690  -6.663 -10.550
  469   1HE2  GLN  56          1HE2      GLN  56   2.531  -7.981  -8.236
  470   2HE2  GLN  56          2HE2      GLN  56   3.019  -9.443  -9.020
  471    H    ASP  57           H        ASP  57   4.920  -3.685 -11.932
  472    HA   ASP  57           HA       ASP  57   7.061  -5.371 -11.362
  473   1HB   ASP  57          2HB       ASP  57   6.625  -3.505 -13.251
  474   2HB   ASP  57          1HB       ASP  57   7.709  -2.594 -12.205
  475    H    ASP  58           H        ASP  58   6.441  -2.073 -10.146
  476    HA   ASP  58           HA       ASP  58   8.722  -1.925  -8.498
  477   1HB   ASP  58          2HB       ASP  58   6.186  -0.408  -8.766
  478   2HB   ASP  58          1HB       ASP  58   7.015  -0.268  -7.220
  479    H    LEU  59           H        LEU  59   5.388  -2.916  -7.817
  480    HA   LEU  59           HA       LEU  59   5.636  -3.334  -5.067
  481   1HB   LEU  59          2HB       LEU  59   3.488  -3.292  -6.218
  482   2HB   LEU  59          1HB       LEU  59   3.897  -4.764  -7.077
  483    HG   LEU  59           HG       LEU  59   4.143  -5.672  -4.567
  484   1HD1  LEU  59          1HD1      LEU  59   2.728  -4.698  -3.027
  485   2HD1  LEU  59          2HD1      LEU  59   1.804  -3.838  -4.260
  486   3HD1  LEU  59          3HD1      LEU  59   3.426  -3.293  -3.830
  487   1HD2  LEU  59          1HD2      LEU  59   1.525  -6.119  -4.880
  488   2HD2  LEU  59          2HD2      LEU  59   2.761  -6.951  -5.824
  489   3HD2  LEU  59          3HD2      LEU  59   1.914  -5.564  -6.508
  490    H    ASP  60           H        ASP  60   6.161  -5.579  -7.778
  491    HA   ASP  60           HA       ASP  60   6.762  -7.841  -6.201
  492   1HB   ASP  60          2HB       ASP  60   6.388  -7.435  -8.864
  493   2HB   ASP  60          1HB       ASP  60   8.136  -7.638  -8.810
  494    H    LYS  61           H        LYS  61   8.819  -5.313  -7.597
  495    HA   LYS  61           HA       LYS  61  11.303  -6.430  -6.889
  496   1HB   LYS  61          2HB       LYS  61  10.514  -4.221  -8.282
  497   2HB   LYS  61          1HB       LYS  61  11.108  -3.486  -6.799
  498   1HG   LYS  61          2HG       LYS  61  12.714  -5.445  -8.417
  499   2HG   LYS  61          1HG       LYS  61  12.774  -3.697  -8.662
  500   1HD   LYS  61          2HD       LYS  61  13.293  -3.564  -6.150
  501   2HD   LYS  61          1HD       LYS  61  13.630  -5.293  -6.265
  502   1HE   LYS  61          2HE       LYS  61  15.475  -4.983  -7.607
  503   2HE   LYS  61          1HE       LYS  61  14.903  -3.431  -8.214
  504   1HZ   LYS  61          1HZ       LYS  61  16.827  -3.664  -6.407
  505   2HZ   LYS  61          2HZ       LYS  61  15.496  -3.553  -5.368
  506   3HZ   LYS  61          3HZ       LYS  61  15.800  -2.321  -6.488
  507    H    ALA  62           H        ALA  62   9.061  -4.339  -5.123
  508    HA   ALA  62           HA       ALA  62  10.725  -3.724  -2.941
  509   1HB   ALA  62          1HB       ALA  62   8.279  -2.908  -3.691
  510   2HB   ALA  62          2HB       ALA  62   8.928  -2.671  -2.067
  511   3HB   ALA  62          3HB       ALA  62   7.840  -4.018  -2.392
  512    H    ILE  63           H        ILE  63   8.534  -6.457  -3.506
  513    HA   ILE  63           HA       ILE  63   8.693  -7.570  -0.917
  514    HB   ILE  63           HB       ILE  63   8.248  -9.077  -3.500
  515   1HG1  ILE  63          2HG1      ILE  63   6.015  -8.175  -1.725
  516   2HG1  ILE  63          1HG1      ILE  63   6.732  -7.007  -2.826
  517   1HG2  ILE  63          1HG2      ILE  63   8.703 -10.584  -1.702
  518   2HG2  ILE  63          2HG2      ILE  63   6.965 -10.617  -2.002
  519   3HG2  ILE  63          3HG2      ILE  63   7.607  -9.719  -0.625
  520   1HD1  ILE  63          1HD1      ILE  63   6.332  -8.915  -4.586
  521   2HD1  ILE  63          2HD1      ILE  63   5.043  -7.806  -4.119
  522   3HD1  ILE  63          3HD1      ILE  63   5.115  -9.419  -3.414
  523    H    ASP  64           H        ASP  64  10.608  -8.128  -3.857
  524    HA   ASP  64           HA       ASP  64  12.186 -10.234  -2.952
  525   1HB   ASP  64          2HB       ASP  64  12.053  -8.832  -5.273
  526   2HB   ASP  64          1HB       ASP  64  13.568  -8.218  -4.621
  527    H    ILE  65           H        ILE  65  12.581  -6.749  -2.492
  528    HA   ILE  65           HA       ILE  65  15.149  -6.832  -1.324
  529    HB   ILE  65           HB       ILE  65  12.989  -4.788  -0.776
  530   1HG1  ILE  65          2HG1      ILE  65  15.164  -4.365  -2.784
  531   2HG1  ILE  65          1HG1      ILE  65  13.771  -5.333  -3.251
  532   1HG2  ILE  65          1HG2      ILE  65  15.876  -4.980  -0.149
  533   2HG2  ILE  65          2HG2      ILE  65  14.570  -4.200   0.742
  534   3HG2  ILE  65          3HG2      ILE  65  15.274  -3.405  -0.667
  535   1HD1  ILE  65          1HD1      ILE  65  12.776  -3.011  -2.007
  536   2HD1  ILE  65          2HD1      ILE  65  12.670  -3.477  -3.707
  537   3HD1  ILE  65          3HD1      ILE  65  14.030  -2.506  -3.141
  538    H    LEU  66           H        LEU  66  11.896  -6.901   0.124
  539    HA   LEU  66           HA       LEU  66  12.723  -6.901   2.814
  540   1HB   LEU  66          2HB       LEU  66  10.419  -6.449   2.156
  541   2HB   LEU  66          1HB       LEU  66  10.245  -8.087   1.556
  542    HG   LEU  66           HG       LEU  66  11.038  -7.911   4.385
  543   1HD1  LEU  66          1HD1      LEU  66   8.735  -6.411   3.382
  544   2HD1  LEU  66          2HD1      LEU  66   9.581  -6.304   4.925
  545   3HD1  LEU  66          3HD1      LEU  66   8.357  -7.548   4.677
  546   1HD2  LEU  66          1HD2      LEU  66   8.712  -9.354   3.145
  547   2HD2  LEU  66          2HD2      LEU  66   9.591  -9.748   4.622
  548   3HD2  LEU  66          3HD2      LEU  66  10.362  -9.967   3.051
  549    H    ASP  67           H        ASP  67  11.979  -9.596   0.607
  550    HA   ASP  67           HA       ASP  67  12.393 -11.696   2.409
  551   1HB   ASP  67          2HB       ASP  67  12.420 -11.432  -0.562
  552   2HB   ASP  67          1HB       ASP  67  13.119 -12.891   0.131
  553    H    ARG  68           H        ARG  68  14.686  -9.948   0.347
  554    HA   ARG  68           HA       ARG  68  16.926 -11.598   0.902
  555   1HB   ARG  68          2HB       ARG  68  16.372  -9.264  -0.649
  556   2HB   ARG  68          1HB       ARG  68  17.795  -8.948   0.334
  557   1HG   ARG  68          2HG       ARG  68  18.602 -11.251  -0.540
  558   2HG   ARG  68          1HG       ARG  68  17.385 -11.003  -1.794
  559   1HD   ARG  68          2HD       ARG  68  18.612  -9.442  -2.833
  560   2HD   ARG  68          1HD       ARG  68  19.064  -8.660  -1.320
  561    HE   ARG  68           HE       ARG  68  20.616 -10.522  -2.817
  562   1HH1  ARG  68          1HH1      ARG  68  19.942  -9.459   0.451
  563   2HH1  ARG  68          2HH1      ARG  68  21.495  -9.923   1.055
  564   1HH2  ARG  68          1HH2      ARG  68  22.665 -11.130  -2.015
  565   2HH2  ARG  68          2HH2      ARG  68  23.044 -10.870  -0.346
  566    H    SER  69           H        SER  69  15.538  -8.800   2.515
  567    HA   SER  69           HA       SER  69  17.801  -8.475   4.285
  568   1HB   SER  69          2HB       SER  69  16.466  -6.522   3.575
  569   2HB   SER  69          1HB       SER  69  15.056  -7.196   4.393
  570    HG   SER  69           HG       SER  69  16.926  -5.664   5.430
  571    H    SER  70           H        SER  70  18.134  -9.664   6.051
  572    HA   SER  70           HA       SER  70  16.232 -11.535   7.029
  573   1HB   SER  70          2HB       SER  70  17.977 -11.527   9.034
  574   2HB   SER  70          1HB       SER  70  18.369 -12.268   7.483
  575    HG   SER  70           HG       SER  70  19.848 -10.587   8.582
  576    H    SER  71           H        SER  71  17.190  -8.294   8.019
  577    HA   SER  71           HA       SER  71  15.774  -8.326  10.500
  578   1HB   SER  71          2HB       SER  71  16.024  -5.698  10.060
  579   2HB   SER  71          1HB       SER  71  17.377  -6.692  10.599
  580    HG   SER  71           HG       SER  71  18.325  -6.399   8.739
  581    H    MET  72           H        MET  72  14.983  -7.283   7.214
  582    HA   MET  72           HA       MET  72  12.461  -6.131   8.014
  583   1HB   MET  72          2HB       MET  72  14.105  -5.808   5.827
  584   2HB   MET  72          1HB       MET  72  12.774  -6.752   5.168
  585   1HG   MET  72          2HG       MET  72  11.382  -4.911   6.528
  586   2HG   MET  72          1HG       MET  72  12.831  -3.977   6.163
  587   1HE   MET  72          1HE       MET  72   9.331  -3.902   3.933
  588   2HE   MET  72          2HE       MET  72  10.348  -2.514   4.323
  589   3HE   MET  72          3HE       MET  72   9.892  -3.656   5.588
  590    H    LYS  73           H        LYS  73  10.878  -7.426   8.675
  591    HA   LYS  73           HA       LYS  73  10.450  -9.971   7.258
  592   1HB   LYS  73          2HB       LYS  73   9.166 -10.661   9.294
  593   2HB   LYS  73          1HB       LYS  73  10.880 -10.392   9.565
  594   1HG   LYS  73          2HG       LYS  73  10.428  -8.941  11.171
  595   2HG   LYS  73          1HG       LYS  73   9.478  -7.957  10.060
  596   1HD   LYS  73          2HD       LYS  73   7.809  -8.468  11.504
  597   2HD   LYS  73          1HD       LYS  73   7.719  -9.929  10.517
  598   1HE   LYS  73          2HE       LYS  73   8.650 -11.246  12.131
  599   2HE   LYS  73          1HE       LYS  73   9.610  -9.930  12.805
  600   1HZ   LYS  73          1HZ       LYS  73   6.713  -9.718  13.086
  601   2HZ   LYS  73          2HZ       LYS  73   7.940  -9.287  14.167
  602   3HZ   LYS  73          3HZ       LYS  73   7.479 -10.907  14.016
  603    H    SER  74           H        SER  74   8.885  -6.990   8.284
  604    HA   SER  74           HA       SER  74   6.497  -7.797   6.755
  605   1HB   SER  74          2HB       SER  74   6.636  -6.050   9.226
  606   2HB   SER  74          1HB       SER  74   5.187  -6.286   8.251
  607    HG   SER  74           HG       SER  74   6.632  -8.311   9.620
  608    H    LEU  75           H        LEU  75   5.394  -6.110   5.600
  609    HA   LEU  75           HA       LEU  75   7.243  -4.075   4.630
  610   1HB   LEU  75          2HB       LEU  75   4.766  -5.351   3.581
  611   2HB   LEU  75          1HB       LEU  75   5.140  -3.727   3.037
  612    HG   LEU  75           HG       LEU  75   7.535  -4.962   2.644
  613   1HD1  LEU  75          1HD1      LEU  75   6.556  -7.136   3.301
  614   2HD1  LEU  75          2HD1      LEU  75   7.153  -7.118   1.641
  615   3HD1  LEU  75          3HD1      LEU  75   5.422  -7.000   1.957
  616   1HD2  LEU  75          1HD2      LEU  75   7.159  -4.480   0.465
  617   2HD2  LEU  75          2HD2      LEU  75   5.766  -3.632   1.135
  618   3HD2  LEU  75          3HD2      LEU  75   5.571  -5.247   0.453
  619    H    ARG  76           H        ARG  76   7.213  -2.103   5.458
  620    HA   ARG  76           HA       ARG  76   4.805  -1.146   6.824
  621   1HB   ARG  76          2HB       ARG  76   7.577   0.065   6.772
  622   2HB   ARG  76          1HB       ARG  76   6.240   0.566   7.796
  623   1HG   ARG  76          2HG       ARG  76   7.165  -0.753   9.336
  624   2HG   ARG  76          1HG       ARG  76   6.467  -2.088   8.415
  625   1HD   ARG  76          2HD       ARG  76   8.481  -2.821   7.784
  626   2HD   ARG  76          1HD       ARG  76   8.995  -1.207   7.298
  627    HE   ARG  76           HE       ARG  76   9.676  -2.559   9.702
  628   1HH1  ARG  76          1HH1      ARG  76   8.981   0.629   8.430
  629   2HH1  ARG  76          2HH1      ARG  76   9.949   1.447   9.610
  630   1HH2  ARG  76          1HH2      ARG  76  10.951  -1.476  11.257
  631   2HH2  ARG  76          2HH2      ARG  76  11.069   0.251  11.215
  632    H    ILE  77           H        ILE  77   3.567  -0.668   4.965
  633    HA   ILE  77           HA       ILE  77   4.580   1.474   3.228
  634    HB   ILE  77           HB       ILE  77   2.069  -0.163   2.840
  635   1HG1  ILE  77          2HG1      ILE  77   4.705  -0.612   1.439
  636   2HG1  ILE  77          1HG1      ILE  77   4.247  -1.502   2.887
  637   1HG2  ILE  77          1HG2      ILE  77   1.802   0.861   0.838
  638   2HG2  ILE  77          2HG2      ILE  77   3.534   1.067   0.582
  639   3HG2  ILE  77          3HG2      ILE  77   2.666   2.160   1.660
  640   1HD1  ILE  77          1HD1      ILE  77   2.438  -2.542   1.785
  641   2HD1  ILE  77          2HD1      ILE  77   3.822  -2.654   0.697
  642   3HD1  ILE  77          3HD1      ILE  77   2.564  -1.454   0.402
  643    H    LEU  78           H        LEU  78   3.753   3.493   3.303
  644    HA   LEU  78           HA       LEU  78   1.566   3.988   5.200
  645   1HB   LEU  78          2HB       LEU  78   3.691   5.162   5.599
  646   2HB   LEU  78          1HB       LEU  78   3.584   5.897   4.011
  647    HG   LEU  78           HG       LEU  78   1.445   6.998   4.771
  648   1HD1  LEU  78          1HD1      LEU  78   2.358   6.333   7.548
  649   2HD1  LEU  78          2HD1      LEU  78   1.172   5.346   6.696
  650   3HD1  LEU  78          3HD1      LEU  78   0.832   7.044   7.025
  651   1HD2  LEU  78          1HD2      LEU  78   3.941   7.677   6.323
  652   2HD2  LEU  78          2HD2      LEU  78   2.587   8.758   5.995
  653   3HD2  LEU  78          3HD2      LEU  78   3.595   8.180   4.668
  654    H    LEU  79           H        LEU  79  -0.394   4.276   4.380
  655    HA   LEU  79           HA       LEU  79  -0.645   5.271   1.626
  656   1HB   LEU  79          2HB       LEU  79  -2.926   4.333   1.678
  657   2HB   LEU  79          1HB       LEU  79  -1.682   3.126   1.926
  658    HG   LEU  79           HG       LEU  79  -2.300   3.765   4.505
  659   1HD1  LEU  79          1HD1      LEU  79  -4.200   5.173   3.383
  660   2HD1  LEU  79          2HD1      LEU  79  -4.526   4.212   4.823
  661   3HD1  LEU  79          3HD1      LEU  79  -4.993   3.604   3.236
  662   1HD2  LEU  79          1HD2      LEU  79  -3.472   1.674   2.683
  663   2HD2  LEU  79          2HD2      LEU  79  -3.701   1.681   4.432
  664   3HD2  LEU  79          3HD2      LEU  79  -2.081   1.522   3.757
  665    H    LEU  80           H        LEU  80  -1.437   7.231   1.248
  666    HA   LEU  80           HA       LEU  80  -2.856   8.611   3.435
  667   1HB   LEU  80          2HB       LEU  80  -0.792   9.590   1.492
  668   2HB   LEU  80          1HB       LEU  80  -1.939  10.711   2.204
  669    HG   LEU  80           HG       LEU  80  -1.077   9.580   4.458
  670   1HD1  LEU  80          1HD1      LEU  80   0.400   7.994   3.351
  671   2HD1  LEU  80          2HD1      LEU  80   1.321   9.132   4.332
  672   3HD1  LEU  80          3HD1      LEU  80   1.268   9.322   2.581
  673   1HD2  LEU  80          1HD2      LEU  80   0.837  11.540   3.348
  674   2HD2  LEU  80          2HD2      LEU  80  -0.069  11.565   4.860
  675   3HD2  LEU  80          3HD2      LEU  80  -0.862  12.009   3.349
  676    H    SER  81           H        SER  81  -4.886   9.134   3.003
  677    HA   SER  81           HA       SER  81  -6.005   8.756   0.397
  678   1HB   SER  81          2HB       SER  81  -8.008   9.961   1.761
  679   2HB   SER  81          1HB       SER  81  -7.633   8.243   1.904
  680    HG   SER  81           HG       SER  81  -7.126  10.339   3.686
  681    H    GLN  82           H        GLN  82  -6.790  10.255  -1.040
  682    HA   GLN  82           HA       GLN  82  -5.627  12.895  -0.851
  683   1HB   GLN  82          2HB       GLN  82  -5.650  11.438  -2.955
  684   2HB   GLN  82          1HB       GLN  82  -7.344  11.882  -3.105
  685   1HG   GLN  82          2HG       GLN  82  -6.616  13.594  -4.319
  686   2HG   GLN  82          1HG       GLN  82  -6.135  14.315  -2.784
  687   1HE2  GLN  82          1HE2      GLN  82  -3.934  14.005  -2.083
  688   2HE2  GLN  82          2HE2      GLN  82  -2.685  13.785  -3.256
  689    H    ASP  83           H        ASP  83  -8.261  11.731   0.479
  690    HA   ASP  83           HA       ASP  83  -9.682  14.283   0.314
  691   1HB   ASP  83          2HB       ASP  83 -10.638  11.779  -0.747
  692   2HB   ASP  83          1HB       ASP  83 -11.680  12.297   0.574
  693    H    ARG  84           H        ARG  84 -11.374  14.451   2.077
  694    HA   ARG  84           HA       ARG  84 -10.290  13.261   4.538
  695   1HB   ARG  84          2HB       ARG  84 -11.932  15.775   4.182
  696   2HB   ARG  84          1HB       ARG  84 -11.340  15.159   5.718
  697   1HG   ARG  84          2HG       ARG  84  -9.005  15.323   4.606
  698   2HG   ARG  84          1HG       ARG  84  -9.815  16.395   3.463
  699   1HD   ARG  84          2HD       ARG  84  -9.981  18.066   4.959
  700   2HD   ARG  84          1HD       ARG  84 -10.398  16.975   6.277
  701    HE   ARG  84           HE       ARG  84  -7.790  17.975   5.612
  702   1HH1  ARG  84          1HH1      ARG  84  -9.531  15.376   7.179
  703   2HH1  ARG  84          2HH1      ARG  84  -8.209  14.943   8.210
  704   1HH2  ARG  84          1HH2      ARG  84  -6.046  17.404   6.973
  705   2HH2  ARG  84          2HH2      ARG  84  -6.230  16.096   8.093
  706    H    ASN  85           H        ASN  85 -13.261  13.794   2.721
  707    HA   ASN  85           HA       ASN  85 -14.805  12.339   4.739
  708   1HB   ASN  85          2HB       ASN  85 -15.480  14.564   3.382
  709   2HB   ASN  85          1HB       ASN  85 -16.133  13.353   2.283
  710   1HD2  ASN  85          1HD2      ASN  85 -15.969  13.769   5.820
  711   2HD2  ASN  85          2HD2      ASN  85 -17.649  13.476   6.093
  712    H    LEU  86           H        LEU  86 -15.833  10.400   4.340
  713    HA   LEU  86           HA       LEU  86 -14.905   8.952   1.957
  714   1HB   LEU  86          2HB       LEU  86 -16.065   7.870   4.530
  715   2HB   LEU  86          1HB       LEU  86 -15.450   6.908   3.201
  716    HG   LEU  86           HG       LEU  86 -13.594   8.866   4.461
  717   1HD1  LEU  86          1HD1      LEU  86 -12.977   7.089   6.128
  718   2HD1  LEU  86          2HD1      LEU  86 -14.504   6.300   5.740
  719   3HD1  LEU  86          3HD1      LEU  86 -14.502   7.921   6.435
  720   1HD2  LEU  86          1HD2      LEU  86 -12.462   7.779   2.821
  721   2HD2  LEU  86          2HD2      LEU  86 -13.467   6.333   2.929
  722   3HD2  LEU  86          3HD2      LEU  86 -12.198   6.618   4.122
  723    H    GLU  87           H        GLU  87 -16.288   8.028   0.515
  724    HA   GLU  87           HA       GLU  87 -19.173   8.445   0.967
  725   1HB   GLU  87          2HB       GLU  87 -17.643   9.628  -0.986
  726   2HB   GLU  87          1HB       GLU  87 -18.309   8.237  -1.830
  727   1HG   GLU  87          2HG       GLU  87 -20.567   9.048  -0.824
  728   2HG   GLU  87          1HG       GLU  87 -19.715  10.579  -0.634
  729    H    HIS  88           H        HIS  88 -20.567   6.978  -0.378
  730    HA   HIS  88           HA       HIS  88 -21.315   4.915  -0.936
  731   1HB   HIS  88          2HB       HIS  88 -19.433   5.115  -2.622
  732   2HB   HIS  88          1HB       HIS  88 -18.447   4.169  -1.514
  733    HD1  HIS  88           HD1      HIS  88 -21.190   3.871  -3.999
  734    HD2  HIS  88           HD2      HIS  88 -19.210   1.443  -1.268
  735    HE1  HIS  88           HE1      HIS  88 -21.836   1.516  -4.599
  736    HE2  HIS  88           HE2      HIS  88 -20.684   0.069  -2.889
  737    H    HIS  89           H        HIS  89 -21.950   4.430   1.198
  738    HA   HIS  89           HA       HIS  89 -20.281   2.376   2.480
  739   1HB   HIS  89          2HB       HIS  89 -21.328   4.891   3.661
  740   2HB   HIS  89          1HB       HIS  89 -21.453   3.444   4.657
  741    HD1  HIS  89           HD1      HIS  89 -19.676   5.425   5.840
  742    HD2  HIS  89           HD2      HIS  89 -18.297   2.801   2.927
  743    HE1  HIS  89           HE1      HIS  89 -17.181   5.345   6.134
  744    HE2  HIS  89           HE2      HIS  89 -16.359   3.836   4.291
  745    H    HIS  90           H        HIS  90 -21.381   0.525   2.452
  746    HA   HIS  90           HA       HIS  90 -24.315   0.610   2.553
  747   1HB   HIS  90          2HB       HIS  90 -22.339  -1.347   1.450
  748   2HB   HIS  90          1HB       HIS  90 -23.920  -1.931   1.950
  749    HD1  HIS  90           HD1      HIS  90 -24.579  -2.498  -0.471
  750    HD2  HIS  90           HD2      HIS  90 -23.696   1.519   0.127
  751    HE1  HIS  90           HE1      HIS  90 -25.380  -1.318  -2.542
  752    HE2  HIS  90           HE2      HIS  90 -24.952   1.125  -2.100
  753    H    HIS  91           H        HIS  91 -21.800  -1.653   3.739
  754    HA   HIS  91           HA       HIS  91 -23.073  -1.595   6.375
  755   1HB   HIS  91          2HB       HIS  91 -23.559  -3.668   4.642
  756   2HB   HIS  91          1HB       HIS  91 -22.195  -4.282   5.572
  757    HD1  HIS  91           HD1      HIS  91 -24.933  -2.108   7.000
  758    HD2  HIS  91           HD2      HIS  91 -23.613  -6.048   7.151
  759    HE1  HIS  91           HE1      HIS  91 -26.248  -3.187   8.852
  760    HE2  HIS  91           HE2      HIS  91 -25.506  -5.594   8.855
  761    H    HIS  92           H        HIS  92 -21.720  -2.046   8.112
  762    HA   HIS  92           HA       HIS  92 -18.900  -2.565   7.534
  763   1HB   HIS  92          2HB       HIS  92 -18.297  -0.746   9.199
  764   2HB   HIS  92          1HB       HIS  92 -18.881  -0.200   7.632
  765    HD1  HIS  92           HD1      HIS  92 -21.377  -1.352  10.169
  766    HD2  HIS  92           HD2      HIS  92 -19.768   2.218   8.772
  767    HE1  HIS  92           HE1      HIS  92 -22.866   0.454  11.073
  768    HE2  HIS  92           HE2      HIS  92 -21.815   2.610  10.304
  769    H    HIS  93           H        HIS  93 -17.634  -2.889   9.631
  770    HA   HIS  93           HA       HIS  93 -17.309  -3.917  11.637
  771   1HB   HIS  93          2HB       HIS  93 -19.251  -2.440  12.368
  772   2HB   HIS  93          1HB       HIS  93 -20.295  -3.826  12.085
  773    HD1  HIS  93           HD1      HIS  93 -20.944  -3.938  14.582
  774    HD2  HIS  93           HD2      HIS  93 -16.878  -4.424  13.869
  775    HE1  HIS  93           HE1      HIS  93 -19.982  -4.802  16.739
  776    HE2  HIS  93           HE2      HIS  93 -17.557  -5.250  16.225
  Start of MODEL    8
    1    H    GLN   1           H        GLN   1   5.824 -20.758   3.555
    2    HA   GLN   1           HA       GLN   1   4.686 -21.563   1.609
    3   1HB   GLN   1          2HB       GLN   1   3.887 -21.605   4.332
    4   2HB   GLN   1          1HB       GLN   1   2.415 -21.526   3.378
    5   1HG   GLN   1          2HG       GLN   1   4.138 -23.439   2.178
    6   2HG   GLN   1          1HG       GLN   1   4.072 -23.763   3.909
    7   1HE2  GLN   1          1HE2      GLN   1   3.054 -25.543   2.048
    8   2HE2  GLN   1          2HE2      GLN   1   1.333 -25.599   2.199
    9    H    SER   2           H        SER   2   4.692 -19.260   0.473
   10    HA   SER   2           HA       SER   2   3.577 -17.762  -0.813
   11   1HB   SER   2          2HB       SER   2   1.134 -19.505  -0.498
   12   2HB   SER   2          1HB       SER   2   1.588 -18.508  -1.877
   13    HG   SER   2           HG       SER   2   2.936 -20.019  -2.548
   14    H    ASP   3           H        ASP   3   3.786 -16.345   1.124
   15    HA   ASP   3           HA       ASP   3   1.246 -15.126   1.710
   16   1HB   ASP   3          2HB       ASP   3   1.821 -15.164   4.245
   17   2HB   ASP   3          1HB       ASP   3   1.051 -16.571   3.524
   18    H    VAL   4           H        VAL   4   1.440 -13.044   2.730
   19    HA   VAL   4           HA       VAL   4   4.104 -11.929   3.079
   20    HB   VAL   4           HB       VAL   4   2.199 -10.602   1.140
   21   1HG1  VAL   4          1HG1      VAL   4   3.519  -8.877   1.742
   22   2HG1  VAL   4          2HG1      VAL   4   4.650  -9.616   0.607
   23   3HG1  VAL   4          3HG1      VAL   4   4.804  -9.929   2.336
   24   1HG2  VAL   4          1HG2      VAL   4   4.621 -12.297   0.543
   25   2HG2  VAL   4          2HG2      VAL   4   3.780 -11.287  -0.633
   26   3HG2  VAL   4          3HG2      VAL   4   2.949 -12.653   0.110
   27    H    ARG   5           H        ARG   5   4.104 -10.535   4.757
   28    HA   ARG   5           HA       ARG   5   1.514  -9.646   5.804
   29   1HB   ARG   5          2HB       ARG   5   4.018 -10.442   7.007
   30   2HB   ARG   5          1HB       ARG   5   3.559  -8.840   7.565
   31   1HG   ARG   5          2HG       ARG   5   1.844  -9.612   8.782
   32   2HG   ARG   5          1HG       ARG   5   1.381 -10.805   7.566
   33   1HD   ARG   5          2HD       ARG   5   3.527 -12.041   8.300
   34   2HD   ARG   5          1HD       ARG   5   3.444 -11.015   9.731
   35    HE   ARG   5           HE       ARG   5   0.947 -12.114   9.507
   36   1HH1  ARG   5          1HH1      ARG   5   4.199 -13.384   9.784
   37   2HH1  ARG   5          2HH1      ARG   5   3.697 -14.829  10.595
   38   1HH2  ARG   5          1HH2      ARG   5   0.293 -14.020  10.576
   39   2HH2  ARG   5          2HH2      ARG   5   1.480 -15.190  11.045
   40    H    ILE   6           H        ILE   6   0.821  -7.687   5.271
   41    HA   ILE   6           HA       ILE   6   2.803  -5.603   4.632
   42    HB   ILE   6           HB       ILE   6  -0.127  -5.562   3.902
   43   1HG1  ILE   6          2HG1      ILE   6   2.153  -6.300   2.061
   44   2HG1  ILE   6          1HG1      ILE   6   1.182  -7.504   2.899
   45   1HG2  ILE   6          1HG2      ILE   6   0.857  -3.967   2.127
   46   2HG2  ILE   6          2HG2      ILE   6   2.256  -3.884   3.197
   47   3HG2  ILE   6          3HG2      ILE   6   0.669  -3.381   3.780
   48   1HD1  ILE   6          1HD1      ILE   6  -0.397  -5.532   1.440
   49   2HD1  ILE   6          2HD1      ILE   6  -0.512  -7.292   1.470
   50   3HD1  ILE   6          3HD1      ILE   6   0.668  -6.505   0.422
   51    H    LYS   7           H        LYS   7   3.132  -4.115   6.135
   52    HA   LYS   7           HA       LYS   7   1.118  -3.662   8.207
   53   1HB   LYS   7          2HB       LYS   7   4.056  -3.193   7.977
   54   2HB   LYS   7          1HB       LYS   7   3.136  -2.148   9.050
   55   1HG   LYS   7          2HG       LYS   7   3.682  -3.766  10.531
   56   2HG   LYS   7          1HG       LYS   7   2.201  -4.482   9.898
   57   1HD   LYS   7          2HD       LYS   7   4.007  -5.426   8.121
   58   2HD   LYS   7          1HD       LYS   7   5.005  -5.324   9.573
   59   1HE   LYS   7          2HE       LYS   7   2.304  -6.556   9.793
   60   2HE   LYS   7          1HE       LYS   7   3.581  -7.482   9.008
   61   1HZ   LYS   7          1HZ       LYS   7   4.874  -6.710  11.173
   62   2HZ   LYS   7          2HZ       LYS   7   3.937  -8.117  11.136
   63   3HZ   LYS   7          3HZ       LYS   7   3.305  -6.700  11.805
   64    H    PHE   8           H        PHE   8  -0.357  -2.168   7.728
   65    HA   PHE   8           HA       PHE   8   0.453   0.207   6.198
   66   1HB   PHE   8          2HB       PHE   8  -2.120  -1.268   6.525
   67   2HB   PHE   8          1HB       PHE   8  -2.188   0.461   6.205
   68    HD1  PHE   8           HD2      PHE   8  -0.910   1.327   4.159
   69    HD2  PHE   8           HD1      PHE   8  -1.850  -2.778   4.780
   70    HE1  PHE   8           HE2      PHE   8  -0.607   0.897   1.756
   71    HE2  PHE   8           HE1      PHE   8  -1.546  -3.214   2.379
   72    HZ   PHE   8           HZ       PHE   8  -0.925  -1.375   0.863
   73    H    GLU   9           H        GLU   9   0.123   2.267   6.961
   74    HA   GLU   9           HA       GLU   9  -0.998   2.557   9.658
   75   1HB   GLU   9          2HB       GLU   9   1.614   2.493   9.490
   76   2HB   GLU   9          1HB       GLU   9   1.432   4.132   8.880
   77   1HG   GLU   9          2HG       GLU   9  -0.067   3.592  11.334
   78   2HG   GLU   9          1HG       GLU   9   1.681   3.445  11.499
   79    H    HIS  10           H        HIS  10  -2.499   4.082   9.736
   80    HA   HIS  10           HA       HIS  10  -2.290   6.438   8.015
   81   1HB   HIS  10          2HB       HIS  10  -3.708   4.782   6.817
   82   2HB   HIS  10          1HB       HIS  10  -4.797   4.754   8.199
   83    HD1  HIS  10           HD1      HIS  10  -6.844   5.820   7.255
   84    HD2  HIS  10           HD2      HIS  10  -3.414   8.030   6.468
   85    HE1  HIS  10           HE1      HIS  10  -7.649   7.966   6.222
   86    HE2  HIS  10           HE2      HIS  10  -5.564   9.326   5.845
   87    H    ASN  11           H        ASN  11  -2.537   8.189   9.236
   88    HA   ASN  11           HA       ASN  11  -3.110   9.574  10.947
   89   1HB   ASN  11          2HB       ASN  11  -5.372   9.076   9.914
   90   2HB   ASN  11          1HB       ASN  11  -5.608   7.888  11.192
   91   1HD2  ASN  11          1HD2      ASN  11  -7.433   9.076  11.877
   92   2HD2  ASN  11          2HD2      ASN  11  -7.256  10.521  12.806
   93    H    GLY  12           H        GLY  12  -1.514   7.242  11.586
   94   1HA   GLY  12          2HA       GLY  12  -0.530   6.670  13.642
   95   2HA   GLY  12          1HA       GLY  12  -1.986   7.199  14.467
   96    H    GLU  13           H        GLU  13  -3.768   5.618  12.745
   97    HA   GLU  13           HA       GLU  13  -3.795   3.223  14.251
   98   1HB   GLU  13          2HB       GLU  13  -5.829   4.270  13.351
   99   2HB   GLU  13          1HB       GLU  13  -5.293   3.917  11.715
  100   1HG   GLU  13          2HG       GLU  13  -6.557   2.091  11.917
  101   2HG   GLU  13          1HG       GLU  13  -5.210   1.449  12.852
  102    H    ARG  14           H        ARG  14  -3.108   1.194  13.808
  103    HA   ARG  14           HA       ARG  14  -1.616   0.801  11.298
  104   1HB   ARG  14          2HB       ARG  14  -0.975   0.185  14.099
  105   2HB   ARG  14          1HB       ARG  14  -0.695  -1.155  12.996
  106   1HG   ARG  14          2HG       ARG  14   0.479   0.790  11.594
  107   2HG   ARG  14          1HG       ARG  14   0.695   1.440  13.220
  108   1HD   ARG  14          2HD       ARG  14   1.463  -1.055  13.701
  109   2HD   ARG  14          1HD       ARG  14   1.833  -1.005  11.977
  110    HE   ARG  14           HE       ARG  14   3.257   0.303  14.082
  111   1HH1  ARG  14          1HH1      ARG  14   2.419   0.519  10.689
  112   2HH1  ARG  14          2HH1      ARG  14   3.800   1.482  10.281
  113   1HH2  ARG  14          1HH2      ARG  14   5.076   1.572  13.541
  114   2HH2  ARG  14          2HH2      ARG  14   5.310   2.079  11.902
  115    H    ARG  15           H        ARG  15  -1.918  -1.067  10.121
  116    HA   ARG  15           HA       ARG  15  -3.909  -2.989  11.114
  117   1HB   ARG  15          2HB       ARG  15  -3.994  -1.392   8.588
  118   2HB   ARG  15          1HB       ARG  15  -4.634  -3.030   8.573
  119   1HG   ARG  15          2HG       ARG  15  -5.841  -2.071  10.782
  120   2HG   ARG  15          1HG       ARG  15  -5.695  -0.591   9.833
  121   1HD   ARG  15          2HD       ARG  15  -6.572  -2.706   8.128
  122   2HD   ARG  15          1HD       ARG  15  -7.592  -2.673   9.564
  123    HE   ARG  15           HE       ARG  15  -7.551  -0.765   7.443
  124   1HH1  ARG  15          1HH1      ARG  15  -8.114  -1.110  10.883
  125   2HH1  ARG  15          2HH1      ARG  15  -9.173   0.255  10.974
  126   1HH2  ARG  15          1HH2      ARG  15  -8.952   1.035   7.567
  127   2HH2  ARG  15          2HH2      ARG  15  -9.651   1.472   9.089
  128    H    ILE  16           H        ILE  16  -3.573  -5.101  10.561
  129    HA   ILE  16           HA       ILE  16  -1.123  -5.682   9.023
  130    HB   ILE  16           HB       ILE  16  -2.376  -7.474  11.107
  131   1HG1  ILE  16          2HG1      ILE  16  -1.673  -5.441  12.231
  132   2HG1  ILE  16          1HG1      ILE  16  -0.540  -6.733  12.610
  133   1HG2  ILE  16          1HG2      ILE  16  -0.016  -7.633   9.345
  134   2HG2  ILE  16          2HG2      ILE  16  -1.031  -8.912  10.011
  135   3HG2  ILE  16          3HG2      ILE  16   0.217  -8.169  11.009
  136   1HD1  ILE  16          1HD1      ILE  16  -0.124  -4.213  11.178
  137   2HD1  ILE  16          2HD1      ILE  16   0.664  -5.619  10.463
  138   3HD1  ILE  16          3HD1      ILE  16   0.997  -5.180  12.138
  139    H    ILE  17           H        ILE  17  -1.503  -6.549   7.080
  140    HA   ILE  17           HA       ILE  17  -3.807  -8.365   6.778
  141    HB   ILE  17           HB       ILE  17  -2.798  -6.511   4.618
  142   1HG1  ILE  17          2HG1      ILE  17  -5.490  -5.999   5.607
  143   2HG1  ILE  17          1HG1      ILE  17  -4.276  -5.775   6.862
  144   1HG2  ILE  17          1HG2      ILE  17  -3.819  -8.285   3.535
  145   2HG2  ILE  17          2HG2      ILE  17  -5.140  -7.130   3.704
  146   3HG2  ILE  17          3HG2      ILE  17  -5.024  -8.502   4.805
  147   1HD1  ILE  17          1HD1      ILE  17  -4.401  -4.405   4.191
  148   2HD1  ILE  17          2HD1      ILE  17  -3.052  -4.266   5.319
  149   3HD1  ILE  17          3HD1      ILE  17  -4.652  -3.687   5.782
  150    H    ALA  18           H        ALA  18  -3.463 -10.255   5.712
  151    HA   ALA  18           HA       ALA  18  -0.715 -10.774   4.786
  152   1HB   ALA  18          1HB       ALA  18  -1.942 -12.077   6.760
  153   2HB   ALA  18          2HB       ALA  18  -0.791 -12.861   5.678
  154   3HB   ALA  18          3HB       ALA  18  -2.525 -13.039   5.402
  155    H    PHE  19           H        PHE  19  -0.356 -11.449   2.744
  156    HA   PHE  19           HA       PHE  19  -2.698 -12.122   1.078
  157   1HB   PHE  19          2HB       PHE  19  -0.489 -10.176   0.594
  158   2HB   PHE  19          1HB       PHE  19  -1.115 -11.072  -0.786
  159    HD1  PHE  19           HD1      PHE  19  -1.940  -8.638   1.842
  160    HD2  PHE  19           HD2      PHE  19  -3.283 -10.619  -1.678
  161    HE1  PHE  19           HE1      PHE  19  -3.802  -7.043   1.659
  162    HE2  PHE  19           HE2      PHE  19  -5.149  -9.027  -1.866
  163    HZ   PHE  19           HZ       PHE  19  -5.409  -7.236  -0.196
  164    H    SER  20           H        SER  20  -2.583 -14.072   0.187
  165    HA   SER  20           HA       SER  20  -0.080 -15.551   0.227
  166   1HB   SER  20          2HB       SER  20  -2.590 -16.681  -0.949
  167   2HB   SER  20          1HB       SER  20  -1.353 -17.474   0.026
  168    HG   SER  20           HG       SER  20  -2.317 -16.817   1.814
  169    H    ARG  21           H        ARG  21   0.675 -16.742  -1.654
  170    HA   ARG  21           HA       ARG  21   0.483 -15.124  -4.075
  171   1HB   ARG  21          2HB       ARG  21   2.455 -17.072  -2.976
  172   2HB   ARG  21          1HB       ARG  21   2.370 -16.888  -4.723
  173   1HG   ARG  21          2HG       ARG  21   4.091 -15.464  -3.781
  174   2HG   ARG  21          1HG       ARG  21   2.802 -14.495  -4.494
  175   1HD   ARG  21          2HD       ARG  21   2.224 -13.590  -2.520
  176   2HD   ARG  21          1HD       ARG  21   2.409 -15.114  -1.657
  177    HE   ARG  21           HE       ARG  21   4.450 -14.388  -0.972
  178   1HH1  ARG  21          1HH1      ARG  21   3.649 -12.655  -3.908
  179   2HH1  ARG  21          2HH1      ARG  21   5.065 -11.661  -3.854
  180   1HH2  ARG  21          1HH2      ARG  21   6.313 -13.080  -0.906
  181   2HH2  ARG  21          2HH2      ARG  21   6.580 -11.904  -2.147
  182    HA   PRO  22           HA       PRO  22   1.355 -15.610  -6.223
  183   1HB   PRO  22          2HB       PRO  22   0.121 -15.318  -8.599
  184   2HB   PRO  22          1HB       PRO  22   1.182 -16.690  -8.254
  185   1HG   PRO  22          2HG       PRO  22  -1.806 -16.552  -8.237
  186   2HG   PRO  22          1HG       PRO  22  -0.746 -17.832  -8.854
  187   1HD   PRO  22          2HD       PRO  22  -2.009 -17.931  -6.423
  188   2HD   PRO  22          1HD       PRO  22  -0.499 -18.788  -6.788
  189    H    VAL  23           H        VAL  23   1.177 -13.529  -5.681
  190    HA   VAL  23           HA       VAL  23  -1.454 -12.342  -5.311
  191    HB   VAL  23           HB       VAL  23   0.285 -12.088  -3.558
  192   1HG1  VAL  23          1HG1      VAL  23   1.695 -10.030  -5.168
  193   2HG1  VAL  23          2HG1      VAL  23   2.085 -11.724  -5.466
  194   3HG1  VAL  23          3HG1      VAL  23   2.288 -11.043  -3.852
  195   1HG2  VAL  23          1HG2      VAL  23  -0.437 -10.018  -2.933
  196   2HG2  VAL  23          2HG2      VAL  23  -1.598 -10.352  -4.217
  197   3HG2  VAL  23          3HG2      VAL  23  -0.200  -9.325  -4.537
  198    H    LYS  24           H        LYS  24  -2.170 -10.449  -6.319
  199    HA   LYS  24           HA       LYS  24  -0.676  -9.659  -8.738
  200   1HB   LYS  24          2HB       LYS  24  -3.539 -10.341  -8.328
  201   2HB   LYS  24          1HB       LYS  24  -3.192  -9.010  -9.421
  202   1HG   LYS  24          2HG       LYS  24  -2.229 -10.356 -10.985
  203   2HG   LYS  24          1HG       LYS  24  -1.673 -11.532  -9.793
  204   1HD   LYS  24          2HD       LYS  24  -3.384 -12.806 -10.457
  205   2HD   LYS  24          1HD       LYS  24  -4.424 -11.673  -9.595
  206   1HE   LYS  24          2HE       LYS  24  -5.216 -10.754 -11.497
  207   2HE   LYS  24          1HE       LYS  24  -3.656 -10.845 -12.311
  208   1HZ   LYS  24          1HZ       LYS  24  -5.869 -12.692 -12.364
  209   2HZ   LYS  24          2HZ       LYS  24  -4.371 -13.440 -12.130
  210   3HZ   LYS  24          3HZ       LYS  24  -4.625 -12.463 -13.487
  211    H    TYR  25           H        TYR  25  -0.573  -7.489  -9.258
  212    HA   TYR  25           HA       TYR  25  -0.534  -5.603  -7.215
  213   1HB   TYR  25          2HB       TYR  25   0.694  -5.288  -9.295
  214   2HB   TYR  25          1HB       TYR  25  -0.808  -5.172 -10.199
  215    HD1  TYR  25           HD1      TYR  25  -2.331  -3.178  -9.750
  216    HD2  TYR  25           HD2      TYR  25   1.672  -3.386  -8.316
  217    HE1  TYR  25           HE1      TYR  25  -2.321  -0.740  -9.444
  218    HE2  TYR  25           HE2      TYR  25   1.691  -0.946  -8.004
  219    HH   TYR  25           HH       TYR  25  -1.053   0.933  -7.991
  220    H    GLU  26           H        GLU  26  -3.001  -5.990  -9.770
  221    HA   GLU  26           HA       GLU  26  -4.728  -3.982  -8.852
  222   1HB   GLU  26          2HB       GLU  26  -4.703  -5.424 -11.076
  223   2HB   GLU  26          1HB       GLU  26  -5.858  -6.403 -10.183
  224   1HG   GLU  26          2HG       GLU  26  -6.748  -3.810  -9.810
  225   2HG   GLU  26          1HG       GLU  26  -6.204  -3.843 -11.485
  226    H    ASP  27           H        ASP  27  -4.419  -7.374  -7.953
  227    HA   ASP  27           HA       ASP  27  -6.835  -7.537  -6.477
  228   1HB   ASP  27          2HB       ASP  27  -4.791  -9.316  -7.212
  229   2HB   ASP  27          1HB       ASP  27  -4.786  -9.310  -5.452
  230    H    VAL  28           H        VAL  28  -3.483  -6.816  -5.539
  231    HA   VAL  28           HA       VAL  28  -3.941  -6.673  -2.762
  232    HB   VAL  28           HB       VAL  28  -1.856  -5.135  -4.323
  233   1HG1  VAL  28          1HG1      VAL  28  -1.842  -4.226  -2.187
  234   2HG1  VAL  28          2HG1      VAL  28  -0.621  -5.494  -2.076
  235   3HG1  VAL  28          3HG1      VAL  28  -2.236  -5.765  -1.419
  236   1HG2  VAL  28          1HG2      VAL  28  -0.667  -7.005  -4.606
  237   2HG2  VAL  28          2HG2      VAL  28  -2.151  -7.878  -4.229
  238   3HG2  VAL  28          3HG2      VAL  28  -0.976  -7.549  -2.958
  239    H    GLU  29           H        GLU  29  -3.919  -4.116  -5.252
  240    HA   GLU  29           HA       GLU  29  -4.476  -1.991  -3.482
  241   1HB   GLU  29          2HB       GLU  29  -5.051  -0.697  -5.481
  242   2HB   GLU  29          1HB       GLU  29  -3.562  -1.600  -5.711
  243   1HG   GLU  29          2HG       GLU  29  -4.584  -3.138  -7.150
  244   2HG   GLU  29          1HG       GLU  29  -6.205  -2.640  -6.674
  245    H    HIS  30           H        HIS  30  -6.587  -4.171  -5.294
  246    HA   HIS  30           HA       HIS  30  -9.010  -2.845  -4.933
  247   1HB   HIS  30          2HB       HIS  30  -8.227  -5.229  -6.070
  248   2HB   HIS  30          1HB       HIS  30  -9.217  -5.762  -4.717
  249    HD1  HIS  30           HD1      HIS  30  -9.728  -5.576  -8.020
  250    HD2  HIS  30           HD2      HIS  30 -11.618  -3.562  -4.913
  251    HE1  HIS  30           HE1      HIS  30 -11.979  -4.910  -8.921
  252    HE2  HIS  30           HE2      HIS  30 -13.122  -3.728  -7.012
  253    H    LYS  31           H        LYS  31  -7.475  -5.305  -2.854
  254    HA   LYS  31           HA       LYS  31  -9.512  -5.264  -0.882
  255   1HB   LYS  31          2HB       LYS  31  -7.247  -6.799  -1.372
  256   2HB   LYS  31          1HB       LYS  31  -6.883  -5.987   0.145
  257   1HG   LYS  31          2HG       LYS  31  -9.325  -6.782   0.754
  258   2HG   LYS  31          1HG       LYS  31  -8.982  -7.992  -0.486
  259   1HD   LYS  31          2HD       LYS  31  -7.350  -8.998   0.754
  260   2HD   LYS  31          1HD       LYS  31  -6.908  -7.508   1.586
  261   1HE   LYS  31          2HE       LYS  31  -7.975  -8.476   3.325
  262   2HE   LYS  31          1HE       LYS  31  -9.411  -7.842   2.523
  263   1HZ   LYS  31          1HZ       LYS  31  -9.200 -10.360   3.230
  264   2HZ   LYS  31          2HZ       LYS  31  -8.479 -10.491   1.707
  265   3HZ   LYS  31          3HZ       LYS  31 -10.055  -9.894   1.847
  266    H    VAL  32           H        VAL  32  -6.298  -3.705  -1.014
  267    HA   VAL  32           HA       VAL  32  -6.432  -2.447   1.483
  268    HB   VAL  32           HB       VAL  32  -5.020  -1.374  -0.962
  269   1HG1  VAL  32          1HG1      VAL  32  -4.781   0.353   0.497
  270   2HG1  VAL  32          2HG1      VAL  32  -3.458  -0.656   1.079
  271   3HG1  VAL  32          3HG1      VAL  32  -5.009  -0.667   1.917
  272   1HG2  VAL  32          1HG2      VAL  32  -3.451  -2.950  -0.766
  273   2HG2  VAL  32          2HG2      VAL  32  -4.609  -3.828   0.234
  274   3HG2  VAL  32          3HG2      VAL  32  -3.396  -2.794   0.990
  275    H    THR  33           H        THR  33  -7.558  -1.326  -1.700
  276    HA   THR  33           HA       THR  33  -8.287   1.270  -0.863
  277    HB   THR  33           HB       THR  33  -9.339  -0.402  -3.156
  278    HG1  THR  33           HG1      THR  33  -7.329   1.595  -3.007
  279   1HG2  THR  33          1HG2      THR  33  -9.545   2.575  -2.780
  280   2HG2  THR  33          2HG2      THR  33 -10.884   1.435  -2.659
  281   3HG2  THR  33          3HG2      THR  33 -10.053   1.652  -4.198
  282    H    THR  34           H        THR  34 -10.119  -1.786  -0.987
  283    HA   THR  34           HA       THR  34 -12.572  -0.571  -0.157
  284    HB   THR  34           HB       THR  34 -11.769  -3.485  -0.035
  285    HG1  THR  34           HG1      THR  34 -13.084  -2.000  -2.062
  286   1HG2  THR  34          1HG2      THR  34 -14.061  -4.042   0.026
  287   2HG2  THR  34          2HG2      THR  34 -14.547  -2.366  -0.225
  288   3HG2  THR  34          3HG2      THR  34 -13.800  -2.849   1.297
  289    H    VAL  35           H        VAL  35 -10.031  -2.377   1.555
  290    HA   VAL  35           HA       VAL  35 -11.347  -2.403   4.060
  291    HB   VAL  35           HB       VAL  35  -8.369  -2.549   3.547
  292   1HG1  VAL  35          1HG1      VAL  35  -9.132  -2.063   5.904
  293   2HG1  VAL  35          2HG1      VAL  35  -8.157  -3.520   5.700
  294   3HG1  VAL  35          3HG1      VAL  35  -9.905  -3.648   5.891
  295   1HG2  VAL  35          1HG2      VAL  35  -9.837  -5.020   4.131
  296   2HG2  VAL  35          2HG2      VAL  35  -8.570  -4.703   2.946
  297   3HG2  VAL  35          3HG2      VAL  35 -10.242  -4.279   2.582
  298    H    PHE  36           H        PHE  36  -8.788  -0.253   2.787
  299    HA   PHE  36           HA       PHE  36  -9.015   1.454   5.123
  300   1HB   PHE  36          2HB       PHE  36  -7.239   1.635   2.686
  301   2HB   PHE  36          1HB       PHE  36  -7.175   2.744   4.050
  302    HD1  PHE  36           HD2      PHE  36  -6.939  -0.886   3.249
  303    HD2  PHE  36           HD1      PHE  36  -5.767   2.294   5.823
  304    HE1  PHE  36           HE2      PHE  36  -5.397  -2.402   4.411
  305    HE2  PHE  36           HE1      PHE  36  -4.221   0.781   6.991
  306    HZ   PHE  36           HZ       PHE  36  -4.039  -1.571   6.285
  307    H    GLY  37           H        GLY  37 -10.578   1.303   2.103
  308   1HA   GLY  37          2HA       GLY  37 -12.323   2.746   1.477
  309   2HA   GLY  37          1HA       GLY  37 -11.673   3.968   2.557
  310    H    GLN  38           H        GLN  38 -12.329   5.113   0.406
  311    HA   GLN  38           HA       GLN  38  -9.839   5.608  -1.031
  312   1HB   GLN  38          2HB       GLN  38 -11.187   5.697  -3.209
  313   2HB   GLN  38          1HB       GLN  38 -10.774   4.111  -2.579
  314   1HG   GLN  38          2HG       GLN  38 -12.920   3.564  -2.158
  315   2HG   GLN  38          1HG       GLN  38 -13.375   5.212  -1.730
  316   1HE2  GLN  38          1HE2      GLN  38 -14.369   6.450  -3.218
  317   2HE2  GLN  38          2HE2      GLN  38 -14.645   5.984  -4.860
  318    HA   PRO  39           HA       PRO  39  -9.457   6.701  -2.871
  319   1HB   PRO  39          2HB       PRO  39  -8.438   8.955  -3.873
  320   2HB   PRO  39          1HB       PRO  39 -10.024   8.365  -4.381
  321   1HG   PRO  39          2HG       PRO  39  -9.334  10.629  -2.594
  322   2HG   PRO  39          1HG       PRO  39 -10.738  10.417  -3.652
  323   1HD   PRO  39          2HD       PRO  39 -10.588   9.945  -0.841
  324   2HD   PRO  39          1HD       PRO  39 -11.960   9.628  -1.918
  325    H    LEU  40           H        LEU  40  -7.550   5.980  -2.115
  326    HA   LEU  40           HA       LEU  40  -5.832   7.803  -0.584
  327   1HB   LEU  40          2HB       LEU  40  -6.590   4.984   0.169
  328   2HB   LEU  40          1HB       LEU  40  -5.226   5.832   0.872
  329    HG   LEU  40           HG       LEU  40  -6.997   7.642   1.495
  330   1HD1  LEU  40          1HD1      LEU  40  -9.055   7.167   0.783
  331   2HD1  LEU  40          2HD1      LEU  40  -9.095   5.964   2.073
  332   3HD1  LEU  40          3HD1      LEU  40  -8.640   5.489   0.437
  333   1HD2  LEU  40          1HD2      LEU  40  -6.056   6.711   3.335
  334   2HD2  LEU  40          2HD2      LEU  40  -6.342   5.061   2.785
  335   3HD2  LEU  40          3HD2      LEU  40  -7.663   5.999   3.482
  336    H    ASP  41           H        ASP  41  -3.660   7.622  -0.974
  337    HA   ASP  41           HA       ASP  41  -2.888   5.788  -3.137
  338   1HB   ASP  41          2HB       ASP  41  -1.925   8.478  -2.252
  339   2HB   ASP  41          1HB       ASP  41  -0.795   7.407  -3.078
  340    H    LEU  42           H        LEU  42  -1.225   4.345  -2.936
  341    HA   LEU  42           HA       LEU  42  -0.319   3.789  -0.221
  342   1HB   LEU  42          2HB       LEU  42   0.310   2.165  -2.677
  343   2HB   LEU  42          1HB       LEU  42   0.325   1.644  -1.004
  344    HG   LEU  42           HG       LEU  42  -2.296   2.572  -1.974
  345   1HD1  LEU  42          1HD1      LEU  42  -2.061   1.497  -3.954
  346   2HD1  LEU  42          2HD1      LEU  42  -2.477   0.102  -2.961
  347   3HD1  LEU  42          3HD1      LEU  42  -0.790   0.431  -3.356
  348   1HD2  LEU  42          1HD2      LEU  42  -1.488   0.008  -0.620
  349   2HD2  LEU  42          2HD2      LEU  42  -3.088   0.746  -0.676
  350   3HD2  LEU  42          3HD2      LEU  42  -1.797   1.513   0.246
  351    H    HIS  43           H        HIS  43   1.419   4.939   0.408
  352    HA   HIS  43           HA       HIS  43   3.597   5.381  -1.513
  353   1HB   HIS  43          2HB       HIS  43   2.421   7.188   0.100
  354   2HB   HIS  43          1HB       HIS  43   3.706   6.640   1.172
  355    HD1  HIS  43           HD1      HIS  43   3.194   9.357  -0.822
  356    HD2  HIS  43           HD2      HIS  43   6.223   6.512  -0.797
  357    HE1  HIS  43           HE1      HIS  43   5.149  10.447  -1.969
  358    HE2  HIS  43           HE2      HIS  43   6.915   8.653  -2.071
  359    H    TYR  44           H        TYR  44   5.287   4.083  -1.451
  360    HA   TYR  44           HA       TYR  44   5.780   2.399   0.865
  361   1HB   TYR  44          2HB       TYR  44   5.909   1.846  -1.761
  362   2HB   TYR  44          1HB       TYR  44   7.582   2.326  -1.501
  363    HD1  TYR  44           HD1      TYR  44   4.973   0.119  -0.002
  364    HD2  TYR  44           HD2      TYR  44   9.096   0.707  -0.857
  365    HE1  TYR  44           HE1      TYR  44   5.467  -2.132   0.864
  366    HE2  TYR  44           HE2      TYR  44   9.604  -1.540   0.006
  367    HH   TYR  44           HH       TYR  44   8.393  -3.157   1.756
  368    H    MET  45           H        MET  45   7.117   3.028   2.438
  369    HA   MET  45           HA       MET  45   9.452   4.675   1.727
  370   1HB   MET  45          2HB       MET  45   7.560   5.080   4.045
  371   2HB   MET  45          1HB       MET  45   9.149   5.825   3.960
  372   1HG   MET  45          2HG       MET  45   7.919   6.415   1.522
  373   2HG   MET  45          1HG       MET  45   6.676   6.641   2.750
  374   1HE   MET  45          1HE       MET  45   6.548   9.443   3.660
  375   2HE   MET  45          2HE       MET  45   7.753   9.380   4.946
  376   3HE   MET  45          3HE       MET  45   6.730   7.979   4.626
  377    H    ASN  46           H        ASN  46  11.236   3.573   2.175
  378    HA   ASN  46           HA       ASN  46  11.206   1.357   4.025
  379   1HB   ASN  46          2HB       ASN  46  12.751   2.099   1.784
  380   2HB   ASN  46          1HB       ASN  46  13.860   2.062   3.152
  381   1HD2  ASN  46          1HD2      ASN  46  11.143   0.144   1.883
  382   2HD2  ASN  46          2HD2      ASN  46  11.905  -1.389   2.113
  383    H    ASN  47           H        ASN  47  12.937   4.457   3.796
  384    HA   ASN  47           HA       ASN  47  12.819   4.937   6.585
  385   1HB   ASN  47          2HB       ASN  47  14.874   3.202   5.901
  386   2HB   ASN  47          1HB       ASN  47  15.673   4.769   5.978
  387   1HD2  ASN  47          1HD2      ASN  47  13.501   2.644   7.781
  388   2HD2  ASN  47          2HD2      ASN  47  14.045   3.127   9.348
  389    H    GLU  48           H        GLU  48  15.173   5.577   3.979
  390    HA   GLU  48           HA       GLU  48  14.743   8.459   4.398
  391   1HB   GLU  48          2HB       GLU  48  17.102   7.169   3.027
  392   2HB   GLU  48          1HB       GLU  48  16.955   8.838   3.557
  393   1HG   GLU  48          2HG       GLU  48  18.095   8.171   5.352
  394   2HG   GLU  48          1HG       GLU  48  16.565   7.487   5.891
  395    H    LEU  49           H        LEU  49  14.515   5.891   2.050
  396    HA   LEU  49           HA       LEU  49  14.065   7.837  -0.100
  397   1HB   LEU  49          2HB       LEU  49  14.541   4.859  -0.181
  398   2HB   LEU  49          1HB       LEU  49  14.153   5.826  -1.589
  399    HG   LEU  49           HG       LEU  49  16.353   7.109  -0.425
  400   1HD1  LEU  49          1HD1      LEU  49  16.746   4.117  -0.479
  401   2HD1  LEU  49          2HD1      LEU  49  16.770   5.147   0.953
  402   3HD1  LEU  49          3HD1      LEU  49  18.022   5.319  -0.278
  403   1HD2  LEU  49          1HD2      LEU  49  17.318   6.774  -2.487
  404   2HD2  LEU  49          2HD2      LEU  49  15.611   6.551  -2.870
  405   3HD2  LEU  49          3HD2      LEU  49  16.658   5.148  -2.655
  406    H    SER  50           H        SER  50  12.147   8.021  -1.149
  407    HA   SER  50           HA       SER  50   9.916   6.400  -0.114
  408   1HB   SER  50          2HB       SER  50   8.442   8.286  -0.492
  409   2HB   SER  50          1HB       SER  50   9.810   8.822   0.481
  410    HG   SER  50           HG       SER  50   9.136  10.166  -1.398
  411    H    ILE  51           H        ILE  51   9.017   5.060  -1.506
  412    HA   ILE  51           HA       ILE  51   9.143   5.676  -4.391
  413    HB   ILE  51           HB       ILE  51   9.205   2.886  -3.238
  414   1HG1  ILE  51          2HG1      ILE  51  11.680   3.159  -4.258
  415   2HG1  ILE  51          1HG1      ILE  51  11.414   4.816  -3.729
  416   1HG2  ILE  51          1HG2      ILE  51   9.368   2.113  -5.361
  417   2HG2  ILE  51          2HG2      ILE  51  10.231   3.537  -5.937
  418   3HG2  ILE  51          3HG2      ILE  51   8.486   3.599  -5.703
  419   1HD1  ILE  51          1HD1      ILE  51  11.501   4.270  -1.540
  420   2HD1  ILE  51          2HD1      ILE  51  12.472   2.938  -2.168
  421   3HD1  ILE  51          3HD1      ILE  51  10.768   2.686  -1.789
  422    H    LEU  52           H        LEU  52   7.242   5.525  -5.501
  423    HA   LEU  52           HA       LEU  52   4.866   4.759  -3.962
  424   1HB   LEU  52          2HB       LEU  52   5.004   7.011  -5.066
  425   2HB   LEU  52          1HB       LEU  52   4.992   6.191  -6.615
  426    HG   LEU  52           HG       LEU  52   2.760   5.157  -5.824
  427   1HD1  LEU  52          1HD1      LEU  52   3.308   6.286  -3.462
  428   2HD1  LEU  52          2HD1      LEU  52   1.665   5.995  -4.032
  429   3HD1  LEU  52          3HD1      LEU  52   2.383   7.597  -4.198
  430   1HD2  LEU  52          1HD2      LEU  52   3.075   6.885  -7.602
  431   2HD2  LEU  52          2HD2      LEU  52   2.811   8.120  -6.368
  432   3HD2  LEU  52          3HD2      LEU  52   1.529   6.973  -6.758
  433    H    LEU  53           H        LEU  53   3.850   2.893  -4.344
  434    HA   LEU  53           HA       LEU  53   4.792   1.022  -6.241
  435   1HB   LEU  53          2HB       LEU  53   2.107   0.967  -4.863
  436   2HB   LEU  53          1HB       LEU  53   2.979  -0.396  -5.536
  437    HG   LEU  53           HG       LEU  53   4.433   1.073  -3.438
  438   1HD1  LEU  53          1HD1      LEU  53   3.077  -0.174  -1.673
  439   2HD1  LEU  53          2HD1      LEU  53   1.813  -0.288  -2.897
  440   3HD1  LEU  53          3HD1      LEU  53   2.374   1.293  -2.352
  441   1HD2  LEU  53          1HD2      LEU  53   4.726  -1.309  -4.692
  442   2HD2  LEU  53          2HD2      LEU  53   3.889  -1.809  -3.222
  443   3HD2  LEU  53          3HD2      LEU  53   5.411  -0.924  -3.112
  444    H    LYS  54           H        LYS  54   4.651   1.487  -8.358
  445    HA   LYS  54           HA       LYS  54   2.105   2.496  -9.421
  446   1HB   LYS  54          2HB       LYS  54   4.940   2.732 -10.260
  447   2HB   LYS  54          1HB       LYS  54   3.746   2.626 -11.549
  448   1HG   LYS  54          2HG       LYS  54   2.537   4.499 -10.183
  449   2HG   LYS  54          1HG       LYS  54   4.146   4.757  -9.506
  450   1HD   LYS  54          2HD       LYS  54   4.118   4.476 -12.420
  451   2HD   LYS  54          1HD       LYS  54   3.202   5.863 -11.831
  452   1HE   LYS  54          2HE       LYS  54   6.042   5.248 -11.022
  453   2HE   LYS  54          1HE       LYS  54   5.609   6.330 -12.344
  454   1HZ   LYS  54          1HZ       LYS  54   5.241   6.701  -9.449
  455   2HZ   LYS  54          2HZ       LYS  54   4.196   7.488 -10.522
  456   3HZ   LYS  54          3HZ       LYS  54   5.861   7.779 -10.597
  457    H    ASN  55           H        ASN  55   4.332  -0.215  -9.629
  458    HA   ASN  55           HA       ASN  55   2.301  -1.740 -11.053
  459   1HB   ASN  55          2HB       ASN  55   4.111  -0.585 -12.619
  460   2HB   ASN  55          1HB       ASN  55   5.077  -1.975 -12.130
  461   1HD2  ASN  55          1HD2      ASN  55   1.675  -1.436 -13.003
  462   2HD2  ASN  55          2HD2      ASN  55   1.599  -2.708 -14.169
  463    H    GLN  56           H        GLN  56   3.134  -4.102 -11.362
  464    HA   GLN  56           HA       GLN  56   3.576  -5.222  -8.846
  465   1HB   GLN  56          2HB       GLN  56   3.512  -6.222 -11.617
  466   2HB   GLN  56          1HB       GLN  56   4.465  -7.195 -10.507
  467   1HG   GLN  56          2HG       GLN  56   2.116  -6.658  -9.124
  468   2HG   GLN  56          1HG       GLN  56   1.602  -6.978 -10.779
  469   1HE2  GLN  56          1HE2      GLN  56   2.140  -8.381  -7.881
  470   2HE2  GLN  56          2HE2      GLN  56   2.458 -10.002  -8.386
  471    H    ASP  57           H        ASP  57   5.858  -4.123 -11.260
  472    HA   ASP  57           HA       ASP  57   8.164  -5.463 -10.520
  473   1HB   ASP  57          2HB       ASP  57   7.610  -3.499 -12.307
  474   2HB   ASP  57          1HB       ASP  57   8.509  -2.583 -11.101
  475    H    ASP  58           H        ASP  58   6.721  -2.554  -9.071
  476    HA   ASP  58           HA       ASP  58   8.843  -2.103  -7.229
  477   1HB   ASP  58          2HB       ASP  58   6.980  -0.468  -7.960
  478   2HB   ASP  58          1HB       ASP  58   5.997  -1.255  -6.728
  479    H    LEU  59           H        LEU  59   5.788  -3.877  -7.031
  480    HA   LEU  59           HA       LEU  59   5.906  -4.495  -4.282
  481   1HB   LEU  59          2HB       LEU  59   4.606  -6.032  -6.536
  482   2HB   LEU  59          1HB       LEU  59   4.321  -6.316  -4.830
  483    HG   LEU  59           HG       LEU  59   3.742  -3.655  -6.115
  484   1HD1  LEU  59          1HD1      LEU  59   2.517  -5.584  -7.217
  485   2HD1  LEU  59          2HD1      LEU  59   1.518  -4.299  -6.540
  486   3HD1  LEU  59          3HD1      LEU  59   1.705  -5.821  -5.670
  487   1HD2  LEU  59          1HD2      LEU  59   2.285  -4.783  -3.780
  488   2HD2  LEU  59          2HD2      LEU  59   2.676  -3.108  -4.170
  489   3HD2  LEU  59          3HD2      LEU  59   3.923  -4.180  -3.530
  490    H    ASP  60           H        ASP  60   7.169  -6.142  -7.152
  491    HA   ASP  60           HA       ASP  60   8.074  -8.475  -5.815
  492   1HB   ASP  60          2HB       ASP  60   7.826  -7.801  -8.423
  493   2HB   ASP  60          1HB       ASP  60   9.562  -7.589  -8.219
  494    H    LYS  61           H        LYS  61   9.582  -5.357  -6.517
  495    HA   LYS  61           HA       LYS  61  12.220  -6.026  -5.795
  496   1HB   LYS  61          2HB       LYS  61  11.560  -3.964  -7.022
  497   2HB   LYS  61          1HB       LYS  61  10.853  -3.338  -5.540
  498   1HG   LYS  61          2HG       LYS  61  13.534  -4.114  -4.993
  499   2HG   LYS  61          1HG       LYS  61  13.522  -3.125  -6.454
  500   1HD   LYS  61          2HD       LYS  61  11.820  -2.117  -4.282
  501   2HD   LYS  61          1HD       LYS  61  13.543  -2.154  -3.904
  502   1HE   LYS  61          2HE       LYS  61  12.434  -0.929  -6.423
  503   2HE   LYS  61          1HE       LYS  61  12.678  -0.015  -4.935
  504   1HZ   LYS  61          1HZ       LYS  61  14.639  -1.036  -6.830
  505   2HZ   LYS  61          2HZ       LYS  61  15.072  -1.120  -5.196
  506   3HZ   LYS  61          3HZ       LYS  61  14.671   0.369  -5.891
  507    H    ALA  62           H        ALA  62   9.446  -4.970  -3.889
  508    HA   ALA  62           HA       ALA  62  10.784  -4.467  -1.460
  509   1HB   ALA  62          1HB       ALA  62   8.519  -4.862  -0.436
  510   2HB   ALA  62          2HB       ALA  62   7.942  -5.272  -2.050
  511   3HB   ALA  62          3HB       ALA  62   8.566  -3.655  -1.720
  512    H    ILE  63           H        ILE  63   9.460  -7.422  -2.866
  513    HA   ILE  63           HA       ILE  63   9.697  -9.069  -0.589
  514    HB   ILE  63           HB       ILE  63   9.916  -9.960  -3.468
  515   1HG1  ILE  63          2HG1      ILE  63   7.350 -10.046  -1.935
  516   2HG1  ILE  63          1HG1      ILE  63   7.850  -8.515  -2.642
  517   1HG2  ILE  63          1HG2      ILE  63   8.918 -12.062  -2.544
  518   2HG2  ILE  63          2HG2      ILE  63   9.173 -11.400  -0.928
  519   3HG2  ILE  63          3HG2      ILE  63  10.552 -11.712  -1.981
  520   1HD1  ILE  63          1HD1      ILE  63   8.175 -10.082  -4.773
  521   2HD1  ILE  63          2HD1      ILE  63   6.646  -9.297  -4.377
  522   3HD1  ILE  63          3HD1      ILE  63   6.909 -10.985  -3.943
  523    H    ASP  64           H        ASP  64  11.930  -8.423  -3.281
  524    HA   ASP  64           HA       ASP  64  13.934 -10.238  -2.641
  525   1HB   ASP  64          2HB       ASP  64  13.719  -7.804  -4.251
  526   2HB   ASP  64          1HB       ASP  64  15.332  -8.046  -3.588
  527    H    ILE  65           H        ILE  65  13.336  -7.001  -1.351
  528    HA   ILE  65           HA       ILE  65  15.724  -6.806   0.160
  529    HB   ILE  65           HB       ILE  65  13.093  -5.448   0.764
  530   1HG1  ILE  65          2HG1      ILE  65  15.339  -4.297  -0.890
  531   2HG1  ILE  65          1HG1      ILE  65  14.006  -5.182  -1.624
  532   1HG2  ILE  65          1HG2      ILE  65  15.311  -5.486   2.300
  533   2HG2  ILE  65          2HG2      ILE  65  14.182  -4.134   2.234
  534   3HG2  ILE  65          3HG2      ILE  65  15.658  -4.096   1.272
  535   1HD1  ILE  65          1HD1      ILE  65  12.425  -3.566  -0.765
  536   2HD1  ILE  65          2HD1      ILE  65  13.683  -2.758  -1.701
  537   3HD1  ILE  65          3HD1      ILE  65  13.723  -2.706   0.062
  538    H    LEU  66           H        LEU  66  12.455  -7.935   0.958
  539    HA   LEU  66           HA       LEU  66  12.959  -8.402   3.708
  540   1HB   LEU  66          2HB       LEU  66  10.900  -9.693   1.915
  541   2HB   LEU  66          1HB       LEU  66  10.890  -9.715   3.667
  542    HG   LEU  66           HG       LEU  66  10.727  -7.165   2.067
  543   1HD1  LEU  66          1HD1      LEU  66   8.644  -9.151   2.742
  544   2HD1  LEU  66          2HD1      LEU  66   8.737  -8.006   1.403
  545   3HD1  LEU  66          3HD1      LEU  66   8.240  -7.454   3.003
  546   1HD2  LEU  66          1HD2      LEU  66   9.931  -7.757   4.913
  547   2HD2  LEU  66          2HD2      LEU  66   9.972  -6.185   4.117
  548   3HD2  LEU  66          3HD2      LEU  66  11.474  -7.046   4.443
  549    H    ASP  67           H        ASP  67  12.988 -10.557   0.871
  550    HA   ASP  67           HA       ASP  67  13.563 -12.942   2.238
  551   1HB   ASP  67          2HB       ASP  67  12.942 -12.422  -0.299
  552   2HB   ASP  67          1HB       ASP  67  14.688 -12.530  -0.493
  553    H    ARG  68           H        ARG  68  15.696 -10.436   0.947
  554    HA   ARG  68           HA       ARG  68  18.140 -11.804   1.339
  555   1HB   ARG  68          2HB       ARG  68  17.767  -9.757  -0.088
  556   2HB   ARG  68          1HB       ARG  68  17.718  -8.815   1.395
  557   1HG   ARG  68          2HG       ARG  68  20.075 -10.549   1.071
  558   2HG   ARG  68          1HG       ARG  68  19.937  -9.212  -0.074
  559   1HD   ARG  68          2HD       ARG  68  19.512  -7.733   1.959
  560   2HD   ARG  68          1HD       ARG  68  20.069  -9.096   2.930
  561    HE   ARG  68           HE       ARG  68  22.045  -8.728   1.088
  562   1HH1  ARG  68          1HH1      ARG  68  20.494  -6.660   3.451
  563   2HH1  ARG  68          2HH1      ARG  68  21.900  -5.681   3.699
  564   1HH2  ARG  68          1HH2      ARG  68  23.896  -7.436   1.422
  565   2HH2  ARG  68          2HH2      ARG  68  23.831  -6.121   2.547
  566    H    SER  69           H        SER  69  16.135  -9.852   3.465
  567    HA   SER  69           HA       SER  69  18.125 -10.159   5.612
  568   1HB   SER  69          2HB       SER  69  17.486  -7.827   5.093
  569   2HB   SER  69          1HB       SER  69  15.800  -8.222   5.430
  570    HG   SER  69           HG       SER  69  16.255  -8.423   7.549
  571    H    SER  70           H        SER  70  17.610 -12.206   6.339
  572    HA   SER  70           HA       SER  70  15.039 -13.237   6.742
  573   1HB   SER  70          2HB       SER  70  17.374 -14.004   8.479
  574   2HB   SER  70          1HB       SER  70  16.060 -15.021   7.889
  575    HG   SER  70           HG       SER  70  16.949 -14.761   5.773
  576    H    SER  71           H        SER  71  16.932 -11.060   8.717
  577    HA   SER  71           HA       SER  71  15.746 -11.453  11.205
  578   1HB   SER  71          2HB       SER  71  17.595 -10.075  11.326
  579   2HB   SER  71          1HB       SER  71  17.153  -9.175   9.879
  580    HG   SER  71           HG       SER  71  15.861  -7.911  11.031
  581    H    MET  72           H        MET  72  14.618  -9.615   8.415
  582    HA   MET  72           HA       MET  72  12.135  -9.006   9.883
  583   1HB   MET  72          2HB       MET  72  13.803  -7.170   8.822
  584   2HB   MET  72          1HB       MET  72  12.773  -7.472   7.429
  585   1HG   MET  72          2HG       MET  72  10.950  -6.536   8.394
  586   2HG   MET  72          1HG       MET  72  11.435  -6.999  10.024
  587   1HE   MET  72          1HE       MET  72  11.367  -3.245  10.691
  588   2HE   MET  72          2HE       MET  72  11.297  -4.826  11.470
  589   3HE   MET  72          3HE       MET  72  10.207  -4.453  10.136
  590    H    LYS  73           H        LYS  73  10.173  -8.874   8.502
  591    HA   LYS  73           HA       LYS  73  10.165 -10.168   5.948
  592   1HB   LYS  73          2HB       LYS  73   8.774 -12.099   6.605
  593   2HB   LYS  73          1HB       LYS  73  10.384 -12.159   7.309
  594   1HG   LYS  73          2HG       LYS  73   8.351 -10.866   8.985
  595   2HG   LYS  73          1HG       LYS  73   8.085 -12.583   8.672
  596   1HD   LYS  73          2HD       LYS  73  10.335 -13.086   9.480
  597   2HD   LYS  73          1HD       LYS  73  10.627 -11.369   9.763
  598   1HE   LYS  73          2HE       LYS  73  10.063 -12.439  11.849
  599   2HE   LYS  73          1HE       LYS  73   8.758 -11.351  11.378
  600   1HZ   LYS  73          1HZ       LYS  73   7.333 -13.058  11.051
  601   2HZ   LYS  73          2HZ       LYS  73   8.334 -13.833  12.171
  602   3HZ   LYS  73          3HZ       LYS  73   8.530 -14.131  10.518
  603    H    SER  74           H        SER  74   9.251  -7.669   6.969
  604    HA   SER  74           HA       SER  74   6.445  -7.859   6.186
  605   1HB   SER  74          2HB       SER  74   7.097  -6.050   8.483
  606   2HB   SER  74          1HB       SER  74   5.564  -6.801   8.051
  607    HG   SER  74           HG       SER  74   6.508  -8.820   8.719
  608    H    LEU  75           H        LEU  75   5.606  -5.957   5.250
  609    HA   LEU  75           HA       LEU  75   7.666  -3.984   4.513
  610   1HB   LEU  75          2HB       LEU  75   5.901  -3.530   2.606
  611   2HB   LEU  75          1HB       LEU  75   7.101  -4.797   2.464
  612    HG   LEU  75           HG       LEU  75   4.440  -5.511   3.600
  613   1HD1  LEU  75          1HD1      LEU  75   3.515  -4.450   1.797
  614   2HD1  LEU  75          2HD1      LEU  75   3.884  -6.017   1.079
  615   3HD1  LEU  75          3HD1      LEU  75   4.957  -4.643   0.799
  616   1HD2  LEU  75          1HD2      LEU  75   4.960  -7.556   2.178
  617   2HD2  LEU  75          2HD2      LEU  75   5.997  -7.270   3.573
  618   3HD2  LEU  75          3HD2      LEU  75   6.563  -6.857   1.955
  619    H    ARG  76           H        ARG  76   7.355  -1.881   4.946
  620    HA   ARG  76           HA       ARG  76   4.893  -1.159   6.360
  621   1HB   ARG  76          2HB       ARG  76   6.175   0.879   7.052
  622   2HB   ARG  76          1HB       ARG  76   6.861  -0.637   7.613
  623   1HG   ARG  76          2HG       ARG  76   7.915   0.364   5.052
  624   2HG   ARG  76          1HG       ARG  76   8.284   1.344   6.470
  625   1HD   ARG  76          2HD       ARG  76   8.686  -1.397   7.134
  626   2HD   ARG  76          1HD       ARG  76   9.513  -1.065   5.613
  627    HE   ARG  76           HE       ARG  76  10.953   0.370   6.718
  628   1HH1  ARG  76          1HH1      ARG  76   8.418  -0.685   8.900
  629   2HH1  ARG  76          2HH1      ARG  76   9.234  -0.118  10.318
  630   1HH2  ARG  76          1HH2      ARG  76  12.019   1.113   8.593
  631   2HH2  ARG  76          2HH2      ARG  76  11.278   0.904  10.144
  632    H    ILE  77           H        ILE  77   3.345  -0.116   5.325
  633    HA   ILE  77           HA       ILE  77   4.081   1.706   3.129
  634    HB   ILE  77           HB       ILE  77   1.563   0.050   3.119
  635   1HG1  ILE  77          2HG1      ILE  77   4.171  -0.534   1.692
  636   2HG1  ILE  77          1HG1      ILE  77   3.505  -1.465   3.029
  637   1HG2  ILE  77          1HG2      ILE  77   2.929   1.872   1.174
  638   2HG2  ILE  77          2HG2      ILE  77   1.252   1.876   1.721
  639   3HG2  ILE  77          3HG2      ILE  77   1.816   0.624   0.614
  640   1HD1  ILE  77          1HD1      ILE  77   1.577  -2.053   1.636
  641   2HD1  ILE  77          2HD1      ILE  77   3.102  -2.582   0.928
  642   3HD1  ILE  77          3HD1      ILE  77   2.285  -1.152   0.297
  643    H    LEU  78           H        LEU  78   3.501   3.716   3.603
  644    HA   LEU  78           HA       LEU  78   1.242   4.140   5.437
  645   1HB   LEU  78          2HB       LEU  78   2.222   6.427   5.734
  646   2HB   LEU  78          1HB       LEU  78   3.203   5.107   6.336
  647    HG   LEU  78           HG       LEU  78   3.868   5.861   3.587
  648   1HD1  LEU  78          1HD1      LEU  78   4.738   7.993   3.948
  649   2HD1  LEU  78          2HD1      LEU  78   4.597   7.858   5.702
  650   3HD1  LEU  78          3HD1      LEU  78   3.150   8.048   4.712
  651   1HD2  LEU  78          1HD2      LEU  78   5.208   5.111   6.117
  652   2HD2  LEU  78          2HD2      LEU  78   6.131   6.114   4.997
  653   3HD2  LEU  78          3HD2      LEU  78   5.497   4.556   4.468
  654    H    LEU  79           H        LEU  79  -0.598   4.881   4.633
  655    HA   LEU  79           HA       LEU  79  -0.526   6.310   2.058
  656   1HB   LEU  79          2HB       LEU  79  -2.916   5.543   1.810
  657   2HB   LEU  79          1HB       LEU  79  -1.684   4.307   1.665
  658    HG   LEU  79           HG       LEU  79  -2.209   3.902   4.210
  659   1HD1  LEU  79          1HD1      LEU  79  -4.911   4.238   4.123
  660   2HD1  LEU  79          2HD1      LEU  79  -4.337   5.715   3.351
  661   3HD1  LEU  79          3HD1      LEU  79  -3.784   5.295   4.971
  662   1HD2  LEU  79          1HD2      LEU  79  -4.329   2.557   3.220
  663   2HD2  LEU  79          2HD2      LEU  79  -2.654   2.047   3.021
  664   3HD2  LEU  79          3HD2      LEU  79  -3.462   2.936   1.732
  665    H    LEU  80           H        LEU  80  -1.476   8.268   1.897
  666    HA   LEU  80           HA       LEU  80  -2.760   9.332   4.329
  667   1HB   LEU  80          2HB       LEU  80  -1.338  10.912   2.190
  668   2HB   LEU  80          1HB       LEU  80  -1.926  11.510   3.731
  669    HG   LEU  80           HG       LEU  80  -0.253   9.757   4.732
  670   1HD1  LEU  80          1HD1      LEU  80   0.564   9.959   1.877
  671   2HD1  LEU  80          2HD1      LEU  80   0.612   8.578   2.973
  672   3HD1  LEU  80          3HD1      LEU  80   1.817   9.858   3.113
  673   1HD2  LEU  80          1HD2      LEU  80  -0.154  12.224   4.954
  674   2HD2  LEU  80          2HD2      LEU  80   0.764  12.288   3.449
  675   3HD2  LEU  80          3HD2      LEU  80   1.436  11.463   4.857
  676    H    SER  81           H        SER  81  -4.644  10.541   4.138
  677    HA   SER  81           HA       SER  81  -6.053  10.209   1.590
  678   1HB   SER  81          2HB       SER  81  -6.866  10.278   4.421
  679   2HB   SER  81          1HB       SER  81  -7.936  11.160   3.335
  680    HG   SER  81           HG       SER  81  -8.363   9.318   2.235
  681    H    GLN  82           H        GLN  82  -6.767  11.874   0.392
  682    HA   GLN  82           HA       GLN  82  -5.791  14.518   1.062
  683   1HB   GLN  82          2HB       GLN  82  -6.990  13.357  -1.445
  684   2HB   GLN  82          1HB       GLN  82  -6.603  15.064  -1.287
  685   1HG   GLN  82          2HG       GLN  82  -4.326  13.568  -0.488
  686   2HG   GLN  82          1HG       GLN  82  -4.902  12.919  -2.021
  687   1HE2  GLN  82          1HE2      GLN  82  -4.860  16.209  -0.691
  688   2HE2  GLN  82          2HE2      GLN  82  -3.962  16.905  -1.994
  689    H    ASP  83           H        ASP  83  -8.422  13.007   1.984
  690    HA   ASP  83           HA       ASP  83 -10.581  14.653   1.259
  691   1HB   ASP  83          2HB       ASP  83 -11.629  13.748   3.424
  692   2HB   ASP  83          1HB       ASP  83 -11.177  12.579   2.193
  693    H    ARG  84           H        ARG  84  -9.911  16.816   1.387
  694    HA   ARG  84           HA       ARG  84  -9.662  18.876   2.318
  695   1HB   ARG  84          2HB       ARG  84 -11.084  17.454   4.569
  696   2HB   ARG  84          1HB       ARG  84 -10.709  19.170   4.619
  697   1HG   ARG  84          2HG       ARG  84 -12.600  19.580   3.550
  698   2HG   ARG  84          1HG       ARG  84 -11.973  18.711   2.148
  699   1HD   ARG  84          2HD       ARG  84 -12.801  16.593   3.217
  700   2HD   ARG  84          1HD       ARG  84 -13.594  17.595   4.432
  701    HE   ARG  84           HE       ARG  84 -14.273  18.292   1.724
  702   1HH1  ARG  84          1HH1      ARG  84 -15.077  16.219   4.430
  703   2HH1  ARG  84          2HH1      ARG  84 -16.712  15.976   3.917
  704   1HH2  ARG  84          1HH2      ARG  84 -16.429  17.963   1.049
  705   2HH2  ARG  84          2HH2      ARG  84 -17.479  16.965   1.997
  706    H    ASN  85           H        ASN  85  -7.440  17.071   2.489
  707    HA   ASN  85           HA       ASN  85  -5.333  17.036   3.344
  708   1HB   ASN  85          2HB       ASN  85  -6.031  19.596   3.666
  709   2HB   ASN  85          1HB       ASN  85  -5.879  19.151   5.363
  710   1HD2  ASN  85          1HD2      ASN  85  -4.175  19.234   2.282
  711   2HD2  ASN  85          2HD2      ASN  85  -2.589  19.332   2.959
  712    H    LEU  86           H        LEU  86  -4.098  16.726   5.493
  713    HA   LEU  86           HA       LEU  86  -5.824  15.161   7.289
  714   1HB   LEU  86          2HB       LEU  86  -3.827  14.168   5.857
  715   2HB   LEU  86          1HB       LEU  86  -2.878  14.744   7.214
  716    HG   LEU  86           HG       LEU  86  -4.848  13.396   8.517
  717   1HD1  LEU  86          1HD1      LEU  86  -4.645  12.287   5.776
  718   2HD1  LEU  86          2HD1      LEU  86  -6.009  12.319   6.893
  719   3HD1  LEU  86          3HD1      LEU  86  -4.714  11.142   7.117
  720   1HD2  LEU  86          1HD2      LEU  86  -2.308  13.283   8.679
  721   2HD2  LEU  86          2HD2      LEU  86  -2.403  11.999   7.474
  722   3HD2  LEU  86          3HD2      LEU  86  -3.203  11.806   9.033
  723    H    GLU  87           H        GLU  87  -5.335  15.130   9.550
  724    HA   GLU  87           HA       GLU  87  -4.700  17.721  10.565
  725   1HB   GLU  87          2HB       GLU  87  -5.118  16.723  12.785
  726   2HB   GLU  87          1HB       GLU  87  -6.416  16.400  11.648
  727   1HG   GLU  87          2HG       GLU  87  -6.226  14.230  12.001
  728   2HG   GLU  87          1HG       GLU  87  -4.533  14.266  11.513
  729    H    HIS  88           H        HIS  88  -2.882  18.484  11.454
  730    HA   HIS  88           HA       HIS  88  -0.766  16.704  12.314
  731   1HB   HIS  88          2HB       HIS  88  -0.696  17.502   9.690
  732   2HB   HIS  88          1HB       HIS  88   0.288  18.737  10.468
  733    HD1  HIS  88           HD1      HIS  88   1.688  16.927  12.580
  734    HD2  HIS  88           HD2      HIS  88   1.278  16.001   8.549
  735    HE1  HIS  88           HE1      HIS  88   3.532  15.293  12.074
  736    HE2  HIS  88           HE2      HIS  88   3.196  14.666   9.656
  737    H    HIS  89           H        HIS  89  -1.402  20.118  11.468
  738    HA   HIS  89           HA       HIS  89  -1.186  22.048  12.642
  739   1HB   HIS  89          2HB       HIS  89  -1.578  20.031  14.737
  740   2HB   HIS  89          1HB       HIS  89  -0.708  21.457  15.291
  741    HD1  HIS  89           HD1      HIS  89  -3.400  21.750  12.692
  742    HD2  HIS  89           HD2      HIS  89  -2.884  22.381  16.768
  743    HE1  HIS  89           HE1      HIS  89  -5.438  23.018  13.439
  744    HE2  HIS  89           HE2      HIS  89  -5.075  23.446  15.895
  745    H    HIS  90           H        HIS  90   0.970  20.000  14.616
  746    HA   HIS  90           HA       HIS  90   3.329  21.161  13.413
  747   1HB   HIS  90          2HB       HIS  90   2.392  22.731  15.303
  748   2HB   HIS  90          1HB       HIS  90   3.101  21.537  16.382
  749    HD1  HIS  90           HD1      HIS  90   4.138  24.448  16.256
  750    HD2  HIS  90           HD2      HIS  90   5.778  21.278  14.129
  751    HE1  HIS  90           HE1      HIS  90   6.507  25.126  15.761
  752    HE2  HIS  90           HE2      HIS  90   7.439  23.245  14.367
  753    H    HIS  91           H        HIS  91   2.275  19.480  16.391
  754    HA   HIS  91           HA       HIS  91   4.009  17.234  15.668
  755   1HB   HIS  91          2HB       HIS  91   4.588  19.082  17.760
  756   2HB   HIS  91          1HB       HIS  91   4.155  17.544  18.498
  757    HD1  HIS  91           HD1      HIS  91   6.533  18.866  15.846
  758    HD2  HIS  91           HD2      HIS  91   6.191  15.749  18.573
  759    HE1  HIS  91           HE1      HIS  91   8.718  17.628  15.727
  760    HE2  HIS  91           HE2      HIS  91   8.459  15.700  17.330
  761    H    HIS  92           H        HIS  92   3.573  15.287  17.016
  762    HA   HIS  92           HA       HIS  92   1.114  15.135  18.482
  763   1HB   HIS  92          2HB       HIS  92   0.913  14.836  15.691
  764   2HB   HIS  92          1HB       HIS  92   0.812  13.208  16.351
  765    HD1  HIS  92           HD1      HIS  92  -0.880  13.503  18.783
  766    HD2  HIS  92           HD2      HIS  92  -1.623  15.648  15.303
  767    HE1  HIS  92           HE1      HIS  92  -3.311  14.141  18.891
  768    HE2  HIS  92           HE2      HIS  92  -3.771  15.279  16.691
  769    H    HIS  93           H        HIS  93   3.461  13.206  16.609
  770    HA   HIS  93           HA       HIS  93   4.730  11.403  17.153
  771   1HB   HIS  93          2HB       HIS  93   4.237  12.716  19.737
  772   2HB   HIS  93          1HB       HIS  93   4.595  11.000  19.878
  773    HD1  HIS  93           HD1      HIS  93   6.265  12.822  17.108
  774    HD2  HIS  93           HD2      HIS  93   7.089  11.738  21.037
  775    HE1  HIS  93           HE1      HIS  93   8.739  13.164  17.397
  776    HE2  HIS  93           HE2      HIS  93   9.206  12.553  19.796
  Start of MODEL    9
    1    H    GLN   1           H        GLN   1   2.429 -21.615   4.820
    2    HA   GLN   1           HA       GLN   1   2.013 -22.040   1.939
    3   1HB   GLN   1          2HB       GLN   1   0.660 -20.552   4.152
    4   2HB   GLN   1          1HB       GLN   1   0.607 -19.872   2.531
    5   1HG   GLN   1          2HG       GLN   1  -0.177 -22.296   1.890
    6   2HG   GLN   1          1HG       GLN   1  -0.636 -22.356   3.592
    7   1HE2  GLN   1          1HE2      GLN   1  -0.838 -20.062   0.878
    8   2HE2  GLN   1          2HE2      GLN   1  -2.483 -19.619   1.158
    9    H    SER   2           H        SER   2   2.371 -20.102   0.627
   10    HA   SER   2           HA       SER   2   4.713 -18.594   1.578
   11   1HB   SER   2          2HB       SER   2   5.165 -19.980  -0.380
   12   2HB   SER   2          1HB       SER   2   3.831 -19.222  -1.249
   13    HG   SER   2           HG       SER   2   4.953 -17.317  -1.302
   14    H    ASP   3           H        ASP   3   3.283 -17.124   2.681
   15    HA   ASP   3           HA       ASP   3   1.954 -15.210   0.879
   16   1HB   ASP   3          2HB       ASP   3   0.515 -14.599   2.767
   17   2HB   ASP   3          1HB       ASP   3   0.399 -16.323   2.424
   18    H    VAL   4           H        VAL   4   1.813 -12.947   1.939
   19    HA   VAL   4           HA       VAL   4   4.347 -12.288   3.281
   20    HB   VAL   4           HB       VAL   4   3.157 -10.599   1.077
   21   1HG1  VAL   4          1HG1      VAL   4   5.368  -9.510   1.124
   22   2HG1  VAL   4          2HG1      VAL   4   5.817 -10.525   2.495
   23   3HG1  VAL   4          3HG1      VAL   4   4.504  -9.357   2.653
   24   1HG2  VAL   4          1HG2      VAL   4   5.014 -12.898   0.948
   25   2HG2  VAL   4          2HG2      VAL   4   5.435 -11.483  -0.017
   26   3HG2  VAL   4          3HG2      VAL   4   3.881 -12.283  -0.256
   27    H    ARG   5           H        ARG   5   4.120 -11.017   5.016
   28    HA   ARG   5           HA       ARG   5   1.478  -9.991   5.673
   29   1HB   ARG   5          2HB       ARG   5   3.983 -10.556   7.170
   30   2HB   ARG   5          1HB       ARG   5   2.959  -9.272   7.794
   31   1HG   ARG   5          2HG       ARG   5   1.154 -11.272   7.337
   32   2HG   ARG   5          1HG       ARG   5   2.588 -12.165   7.847
   33   1HD   ARG   5          2HD       ARG   5   2.739 -10.822   9.863
   34   2HD   ARG   5          1HD       ARG   5   1.363  -9.850   9.343
   35    HE   ARG   5           HE       ARG   5   1.282 -12.406  10.612
   36   1HH1  ARG   5          1HH1      ARG   5  -0.428 -10.355   8.342
   37   2HH1  ARG   5          2HH1      ARG   5  -1.972 -11.060   8.678
   38   1HH2  ARG   5          1HH2      ARG   5  -0.755 -13.333  11.050
   39   2HH2  ARG   5          2HH2      ARG   5  -2.159 -12.754  10.218
   40    H    ILE   6           H        ILE   6   0.920  -8.033   4.971
   41    HA   ILE   6           HA       ILE   6   2.997  -5.961   4.723
   42    HB   ILE   6           HB       ILE   6   0.231  -5.930   3.506
   43   1HG1  ILE   6          2HG1      ILE   6   2.631  -6.342   1.803
   44   2HG1  ILE   6          1HG1      ILE   6   2.110  -7.717   2.769
   45   1HG2  ILE   6          1HG2      ILE   6   1.459  -3.751   3.888
   46   2HG2  ILE   6          2HG2      ILE   6   0.960  -4.082   2.229
   47   3HG2  ILE   6          3HG2      ILE   6   2.640  -4.315   2.706
   48   1HD1  ILE   6          1HD1      ILE   6   0.882  -6.492   0.411
   49   2HD1  ILE   6          2HD1      ILE   6  -0.242  -6.935   1.695
   50   3HD1  ILE   6          3HD1      ILE   6   0.823  -8.154   0.995
   51    H    LYS   7           H        LYS   7   2.980  -4.246   6.039
   52    HA   LYS   7           HA       LYS   7   0.678  -3.901   7.833
   53   1HB   LYS   7          2HB       LYS   7   3.531  -2.930   8.119
   54   2HB   LYS   7          1HB       LYS   7   2.244  -2.645   9.283
   55   1HG   LYS   7          2HG       LYS   7   2.070  -5.002   9.743
   56   2HG   LYS   7          1HG       LYS   7   3.242  -5.368   8.476
   57   1HD   LYS   7          2HD       LYS   7   4.772  -5.312  10.107
   58   2HD   LYS   7          1HD       LYS   7   4.593  -3.556  10.033
   59   1HE   LYS   7          2HE       LYS   7   2.875  -3.661  11.774
   60   2HE   LYS   7          1HE       LYS   7   3.050  -5.415  11.842
   61   1HZ   LYS   7          1HZ       LYS   7   5.420  -3.733  12.259
   62   2HZ   LYS   7          2HZ       LYS   7   5.069  -5.266  12.879
   63   3HZ   LYS   7          3HZ       LYS   7   4.306  -3.901  13.521
   64    H    PHE   8           H        PHE   8  -0.612  -2.199   7.594
   65    HA   PHE   8           HA       PHE   8   0.289   0.020   5.878
   66   1HB   PHE   8          2HB       PHE   8  -2.531  -0.888   6.510
   67   2HB   PHE   8          1HB       PHE   8  -2.099   0.450   5.451
   68    HD1  PHE   8           HD1      PHE   8  -1.562  -3.213   5.872
   69    HD2  PHE   8           HD2      PHE   8  -1.855   0.074   3.182
   70    HE1  PHE   8           HE1      PHE   8  -1.445  -4.765   3.968
   71    HE2  PHE   8           HE2      PHE   8  -1.740  -1.474   1.275
   72    HZ   PHE   8           HZ       PHE   8  -1.535  -3.896   1.666
   73    H    GLU   9           H        GLU   9  -0.001   2.146   6.509
   74    HA   GLU   9           HA       GLU   9  -0.819   2.558   9.310
   75   1HB   GLU   9          2HB       GLU   9   1.684   2.784   8.715
   76   2HB   GLU   9          1HB       GLU   9   1.216   4.279   7.917
   77   1HG   GLU   9          2HG       GLU   9   1.718   5.150   9.932
   78   2HG   GLU   9          1HG       GLU   9   0.049   4.696  10.277
   79    H    HIS  10           H        HIS  10  -2.482   3.878   9.582
   80    HA   HIS  10           HA       HIS  10  -2.919   6.096   7.722
   81   1HB   HIS  10          2HB       HIS  10  -4.318   4.185   6.946
   82   2HB   HIS  10          1HB       HIS  10  -5.107   4.160   8.518
   83    HD1  HIS  10           HD1      HIS  10  -7.424   4.798   7.736
   84    HD2  HIS  10           HD2      HIS  10  -4.507   7.497   6.522
   85    HE1  HIS  10           HE1      HIS  10  -8.677   6.755   6.776
   86    HE2  HIS  10           HE2      HIS  10  -6.893   8.421   6.150
   87    H    ASN  11           H        ASN  11  -2.981   7.873   8.944
   88    HA   ASN  11           HA       ASN  11  -3.341   9.314  10.665
   89   1HB   ASN  11          2HB       ASN  11  -5.726   7.509  10.823
   90   2HB   ASN  11          1HB       ASN  11  -5.471   8.701  12.090
   91   1HD2  ASN  11          1HD2      ASN  11  -7.471   8.369   9.841
   92   2HD2  ASN  11          2HD2      ASN  11  -7.490   9.915   9.070
   93    H    GLY  12           H        GLY  12  -1.566   7.023  11.096
   94   1HA   GLY  12          2HA       GLY  12  -0.190   6.513  12.907
   95   2HA   GLY  12          1HA       GLY  12  -1.381   7.216  13.987
   96    H    GLU  13           H        GLU  13  -3.145   5.196  12.082
   97    HA   GLU  13           HA       GLU  13  -3.212   3.151  14.135
   98   1HB   GLU  13          2HB       GLU  13  -4.907   3.773  11.732
   99   2HB   GLU  13          1HB       GLU  13  -5.064   2.234  12.567
  100   1HG   GLU  13          2HG       GLU  13  -5.140   4.624  14.279
  101   2HG   GLU  13          1HG       GLU  13  -6.493   4.430  13.164
  102    H    ARG  14           H        ARG  14  -2.708   0.995  13.870
  103    HA   ARG  14           HA       ARG  14  -1.078   0.376  11.504
  104   1HB   ARG  14          2HB       ARG  14  -0.704  -0.086  14.317
  105   2HB   ARG  14          1HB       ARG  14  -0.732  -1.628  13.475
  106   1HG   ARG  14          2HG       ARG  14   1.348  -1.320  12.793
  107   2HG   ARG  14          1HG       ARG  14   0.894   0.187  11.996
  108   1HD   ARG  14          2HD       ARG  14   2.294   1.146  13.460
  109   2HD   ARG  14          1HD       ARG  14   0.971   0.952  14.608
  110    HE   ARG  14           HE       ARG  14   2.183  -0.660  15.695
  111   1HH1  ARG  14          1HH1      ARG  14   3.639  -0.093  12.556
  112   2HH1  ARG  14          2HH1      ARG  14   5.043  -1.046  12.897
  113   1HH2  ARG  14          1HH2      ARG  14   4.039  -1.922  16.136
  114   2HH2  ARG  14          2HH2      ARG  14   5.272  -2.085  14.930
  115    H    ARG  15           H        ARG  15  -1.513  -1.346  10.222
  116    HA   ARG  15           HA       ARG  15  -3.706  -3.145  10.990
  117   1HB   ARG  15          2HB       ARG  15  -3.461  -1.504   8.486
  118   2HB   ARG  15          1HB       ARG  15  -4.330  -3.031   8.462
  119   1HG   ARG  15          2HG       ARG  15  -5.005  -0.976  10.518
  120   2HG   ARG  15          1HG       ARG  15  -5.607  -0.811   8.868
  121   1HD   ARG  15          2HD       ARG  15  -7.315  -2.064   9.620
  122   2HD   ARG  15          1HD       ARG  15  -6.201  -3.406   9.361
  123    HE   ARG  15           HE       ARG  15  -5.663  -2.595  11.901
  124   1HH1  ARG  15          1HH1      ARG  15  -8.592  -3.568  10.241
  125   2HH1  ARG  15          2HH1      ARG  15  -9.338  -4.199  11.670
  126   1HH2  ARG  15          1HH2      ARG  15  -6.652  -3.435  13.778
  127   2HH2  ARG  15          2HH2      ARG  15  -8.238  -4.123  13.677
  128    H    ILE  16           H        ILE  16  -3.344  -5.254  10.547
  129    HA   ILE  16           HA       ILE  16  -0.929  -5.906   8.979
  130    HB   ILE  16           HB       ILE  16  -2.172  -7.636  11.120
  131   1HG1  ILE  16          2HG1      ILE  16   0.197  -6.778  12.177
  132   2HG1  ILE  16          1HG1      ILE  16  -0.342  -5.332  11.331
  133   1HG2  ILE  16          1HG2      ILE  16  -0.495  -8.383   9.161
  134   2HG2  ILE  16          2HG2      ILE  16  -0.506  -9.115  10.765
  135   3HG2  ILE  16          3HG2      ILE  16   0.674  -7.864  10.378
  136   1HD1  ILE  16          1HD1      ILE  16  -1.007  -5.804  13.830
  137   2HD1  ILE  16          2HD1      ILE  16  -2.291  -6.741  13.066
  138   3HD1  ILE  16          3HD1      ILE  16  -2.123  -5.020  12.711
  139    H    ILE  17           H        ILE  17  -1.354  -6.793   7.059
  140    HA   ILE  17           HA       ILE  17  -3.656  -8.620   6.829
  141    HB   ILE  17           HB       ILE  17  -2.802  -6.702   4.656
  142   1HG1  ILE  17          2HG1      ILE  17  -5.412  -6.462   6.095
  143   2HG1  ILE  17          1HG1      ILE  17  -3.970  -5.808   6.863
  144   1HG2  ILE  17          1HG2      ILE  17  -3.810  -8.487   3.580
  145   2HG2  ILE  17          2HG2      ILE  17  -5.164  -7.388   3.835
  146   3HG2  ILE  17          3HG2      ILE  17  -4.943  -8.776   4.899
  147   1HD1  ILE  17          1HD1      ILE  17  -3.709  -4.741   4.416
  148   2HD1  ILE  17          2HD1      ILE  17  -4.567  -3.959   5.742
  149   3HD1  ILE  17          3HD1      ILE  17  -5.464  -4.857   4.518
  150    H    ALA  18           H        ALA  18  -3.230 -10.538   5.921
  151    HA   ALA  18           HA       ALA  18  -0.544 -10.969   4.810
  152   1HB   ALA  18          1HB       ALA  18  -1.765 -12.339   6.777
  153   2HB   ALA  18          2HB       ALA  18  -0.546 -13.039   5.712
  154   3HB   ALA  18          3HB       ALA  18  -2.260 -13.299   5.383
  155    H    PHE  19           H        PHE  19  -0.227 -11.991   2.834
  156    HA   PHE  19           HA       PHE  19  -2.591 -12.593   1.204
  157   1HB   PHE  19          2HB       PHE  19  -0.410 -10.629   0.537
  158   2HB   PHE  19          1HB       PHE  19  -1.314 -11.445  -0.733
  159    HD1  PHE  19           HD1      PHE  19  -3.874 -11.229  -0.668
  160    HD2  PHE  19           HD2      PHE  19  -1.235  -8.692   1.501
  161    HE1  PHE  19           HE1      PHE  19  -5.651  -9.537  -0.492
  162    HE2  PHE  19           HE2      PHE  19  -3.007  -6.997   1.683
  163    HZ   PHE  19           HZ       PHE  19  -5.219  -7.418   0.687
  164    H    SER  20           H        SER  20  -2.375 -14.613   0.496
  165    HA   SER  20           HA       SER  20   0.195 -15.915   0.418
  166   1HB   SER  20          2HB       SER  20  -1.003 -17.927  -0.027
  167   2HB   SER  20          1HB       SER  20  -1.993 -17.014   1.112
  168    HG   SER  20           HG       SER  20  -3.181 -16.263  -0.767
  169    H    ARG  21           H        ARG  21   1.427 -16.406  -1.317
  170    HA   ARG  21           HA       ARG  21   0.949 -14.997  -3.763
  171   1HB   ARG  21          2HB       ARG  21   3.090 -16.989  -2.987
  172   2HB   ARG  21          1HB       ARG  21   3.075 -16.089  -4.499
  173   1HG   ARG  21          2HG       ARG  21   3.281 -14.001  -3.312
  174   2HG   ARG  21          1HG       ARG  21   3.161 -14.836  -1.763
  175   1HD   ARG  21          2HD       ARG  21   5.220 -16.167  -2.967
  176   2HD   ARG  21          1HD       ARG  21   5.446 -14.524  -3.568
  177    HE   ARG  21           HE       ARG  21   5.021 -14.392  -0.808
  178   1HH1  ARG  21          1HH1      ARG  21   7.427 -15.611  -3.040
  179   2HH1  ARG  21          2HH1      ARG  21   8.744 -15.376  -1.941
  180   1HH2  ARG  21          1HH2      ARG  21   6.761 -14.088   0.637
  181   2HH2  ARG  21          2HH2      ARG  21   8.366 -14.508   0.147
  182    HA   PRO  22           HA       PRO  22   1.868 -15.309  -5.968
  183   1HB   PRO  22          2HB       PRO  22  -0.085 -15.318  -8.134
  184   2HB   PRO  22          1HB       PRO  22   1.653 -15.611  -8.203
  185   1HG   PRO  22          2HG       PRO  22  -0.181 -17.560  -8.623
  186   2HG   PRO  22          1HG       PRO  22   1.415 -17.877  -7.919
  187   1HD   PRO  22          2HD       PRO  22  -1.240 -17.605  -6.555
  188   2HD   PRO  22          1HD       PRO  22   0.071 -18.765  -6.249
  189    H    VAL  23           H        VAL  23   1.525 -13.268  -5.368
  190    HA   VAL  23           HA       VAL  23  -1.226 -12.386  -4.876
  191    HB   VAL  23           HB       VAL  23   0.349 -12.220  -2.989
  192   1HG1  VAL  23          1HG1      VAL  23   1.786  -9.906  -4.086
  193   2HG1  VAL  23          2HG1      VAL  23   2.218 -11.459  -4.799
  194   3HG1  VAL  23          3HG1      VAL  23   2.359 -11.219  -3.058
  195   1HG2  VAL  23          1HG2      VAL  23   0.058  -9.529  -2.879
  196   2HG2  VAL  23          2HG2      VAL  23  -1.225 -10.686  -2.529
  197   3HG2  VAL  23          3HG2      VAL  23  -1.117  -9.945  -4.125
  198    H    LYS  24           H        LYS  24  -2.189 -11.155  -6.329
  199    HA   LYS  24           HA       LYS  24  -0.616  -9.791  -8.370
  200   1HB   LYS  24          2HB       LYS  24  -3.578 -10.306  -8.062
  201   2HB   LYS  24          1HB       LYS  24  -2.908  -9.324  -9.357
  202   1HG   LYS  24          2HG       LYS  24  -2.095 -12.177  -8.872
  203   2HG   LYS  24          1HG       LYS  24  -3.421 -11.712  -9.938
  204   1HD   LYS  24          2HD       LYS  24  -0.869 -10.300 -10.381
  205   2HD   LYS  24          1HD       LYS  24  -0.863 -12.026 -10.752
  206   1HE   LYS  24          2HE       LYS  24  -3.113 -11.427 -11.985
  207   2HE   LYS  24          1HE       LYS  24  -2.409  -9.809 -12.012
  208   1HZ   LYS  24          1HZ       LYS  24  -0.351 -11.068 -12.935
  209   2HZ   LYS  24          2HZ       LYS  24  -1.639 -10.698 -13.967
  210   3HZ   LYS  24          3HZ       LYS  24  -1.479 -12.262 -13.343
  211    H    TYR  25           H        TYR  25  -0.335  -7.635  -8.491
  212    HA   TYR  25           HA       TYR  25  -0.765  -5.944  -6.326
  213   1HB   TYR  25          2HB       TYR  25   0.847  -5.462  -8.134
  214   2HB   TYR  25          1HB       TYR  25  -0.488  -5.156  -9.237
  215    HD1  TYR  25           HD1      TYR  25  -1.980  -3.174  -8.832
  216    HD2  TYR  25           HD2      TYR  25   1.623  -3.780  -6.653
  217    HE1  TYR  25           HE1      TYR  25  -1.998  -0.811  -8.158
  218    HE2  TYR  25           HE2      TYR  25   1.613  -1.419  -5.971
  219    HH   TYR  25           HH       TYR  25   0.471   0.831  -7.125
  220    H    GLU  26           H        GLU  26  -2.762  -6.446  -9.221
  221    HA   GLU  26           HA       GLU  26  -4.629  -4.408  -8.786
  222   1HB   GLU  26          2HB       GLU  26  -4.804  -7.063 -10.197
  223   2HB   GLU  26          1HB       GLU  26  -6.191  -5.988 -10.100
  224   1HG   GLU  26          2HG       GLU  26  -4.977  -4.254 -11.265
  225   2HG   GLU  26          1HG       GLU  26  -3.525  -5.252 -11.286
  226    H    ASP  27           H        ASP  27  -4.638  -7.794  -7.683
  227    HA   ASP  27           HA       ASP  27  -7.155  -7.669  -6.400
  228   1HB   ASP  27          2HB       ASP  27  -4.871  -9.549  -6.447
  229   2HB   ASP  27          1HB       ASP  27  -5.879  -9.615  -5.006
  230    H    VAL  28           H        VAL  28  -3.839  -7.213  -5.183
  231    HA   VAL  28           HA       VAL  28  -4.539  -6.861  -2.476
  232    HB   VAL  28           HB       VAL  28  -2.176  -5.607  -3.884
  233   1HG1  VAL  28          1HG1      VAL  28  -2.581  -4.691  -1.670
  234   2HG1  VAL  28          2HG1      VAL  28  -1.134  -5.698  -1.660
  235   3HG1  VAL  28          3HG1      VAL  28  -2.642  -6.317  -0.987
  236   1HG2  VAL  28          1HG2      VAL  28  -1.097  -7.574  -3.912
  237   2HG2  VAL  28          2HG2      VAL  28  -2.709  -8.278  -3.825
  238   3HG2  VAL  28          3HG2      VAL  28  -1.756  -8.073  -2.356
  239    H    GLU  29           H        GLU  29  -4.015  -4.479  -5.077
  240    HA   GLU  29           HA       GLU  29  -4.489  -2.185  -3.531
  241   1HB   GLU  29          2HB       GLU  29  -3.653  -2.552  -6.046
  242   2HB   GLU  29          1HB       GLU  29  -5.337  -2.175  -6.383
  243   1HG   GLU  29          2HG       GLU  29  -5.051  -0.099  -5.011
  244   2HG   GLU  29          1HG       GLU  29  -3.329  -0.463  -4.945
  245    H    HIS  30           H        HIS  30  -6.702  -4.248  -5.379
  246    HA   HIS  30           HA       HIS  30  -9.016  -2.712  -5.151
  247   1HB   HIS  30          2HB       HIS  30  -8.405  -5.149  -6.246
  248   2HB   HIS  30          1HB       HIS  30  -9.447  -5.609  -4.907
  249    HD1  HIS  30           HD1      HIS  30 -10.262  -5.931  -7.894
  250    HD2  HIS  30           HD2      HIS  30 -11.336  -2.733  -5.467
  251    HE1  HIS  30           HE1      HIS  30 -12.347  -4.978  -8.922
  252    HE2  HIS  30           HE2      HIS  30 -12.910  -2.970  -7.505
  253    H    LYS  31           H        LYS  31  -7.796  -5.261  -2.974
  254    HA   LYS  31           HA       LYS  31  -9.932  -5.015  -1.119
  255   1HB   LYS  31          2HB       LYS  31  -8.525  -7.041  -1.287
  256   2HB   LYS  31          1HB       LYS  31  -7.157  -6.128  -0.662
  257   1HG   LYS  31          2HG       LYS  31  -7.793  -6.496   1.431
  258   2HG   LYS  31          1HG       LYS  31  -9.404  -5.860   1.106
  259   1HD   LYS  31          2HD       LYS  31 -10.095  -8.044   0.245
  260   2HD   LYS  31          1HD       LYS  31  -8.478  -8.682   0.559
  261   1HE   LYS  31          2HE       LYS  31  -8.810  -8.794   2.806
  262   2HE   LYS  31          1HE       LYS  31  -9.877  -7.391   2.829
  263   1HZ   LYS  31          1HZ       LYS  31 -10.679 -10.025   1.726
  264   2HZ   LYS  31          2HZ       LYS  31 -11.676  -8.698   2.055
  265   3HZ   LYS  31          3HZ       LYS  31 -10.969  -9.560   3.327
  266    H    VAL  32           H        VAL  32  -6.579  -3.778  -1.067
  267    HA   VAL  32           HA       VAL  32  -6.729  -2.490   1.412
  268    HB   VAL  32           HB       VAL  32  -5.091  -1.584  -0.963
  269   1HG1  VAL  32          1HG1      VAL  32  -5.257   0.059   0.863
  270   2HG1  VAL  32          2HG1      VAL  32  -3.622  -0.574   0.683
  271   3HG1  VAL  32          3HG1      VAL  32  -4.653  -1.153   1.991
  272   1HG2  VAL  32          1HG2      VAL  32  -3.723  -3.111   1.102
  273   2HG2  VAL  32          2HG2      VAL  32  -3.685  -3.291  -0.653
  274   3HG2  VAL  32          3HG2      VAL  32  -4.975  -4.043   0.282
  275    H    THR  33           H        THR  33  -7.479  -1.252  -1.839
  276    HA   THR  33           HA       THR  33  -8.087   1.383  -1.004
  277    HB   THR  33           HB       THR  33  -8.952  -0.139  -3.473
  278    HG1  THR  33           HG1      THR  33  -7.069   0.383  -4.200
  279   1HG2  THR  33          1HG2      THR  33  -9.047   2.289  -4.377
  280   2HG2  THR  33          2HG2      THR  33  -9.346   2.706  -2.690
  281   3HG2  THR  33          3HG2      THR  33 -10.437   1.606  -3.536
  282    H    THR  34           H        THR  34 -10.087  -1.526  -1.405
  283    HA   THR  34           HA       THR  34 -12.549  -0.156  -0.937
  284    HB   THR  34           HB       THR  34 -11.923  -3.107  -0.722
  285    HG1  THR  34           HG1      THR  34 -11.671  -2.697  -2.805
  286   1HG2  THR  34          1HG2      THR  34 -14.049  -3.558  -0.287
  287   2HG2  THR  34          2HG2      THR  34 -14.619  -2.406  -1.495
  288   3HG2  THR  34          3HG2      THR  34 -14.223  -1.855   0.132
  289    H    VAL  35           H        VAL  35 -10.383  -2.061   1.149
  290    HA   VAL  35           HA       VAL  35 -12.049  -1.995   3.427
  291    HB   VAL  35           HB       VAL  35  -9.034  -2.220   3.368
  292   1HG1  VAL  35          1HG1      VAL  35 -10.645  -1.809   5.548
  293   2HG1  VAL  35          2HG1      VAL  35  -9.054  -2.566   5.579
  294   3HG1  VAL  35          3HG1      VAL  35 -10.504  -3.565   5.502
  295   1HG2  VAL  35          1HG2      VAL  35  -9.203  -4.380   2.798
  296   2HG2  VAL  35          2HG2      VAL  35 -10.812  -3.955   2.217
  297   3HG2  VAL  35          3HG2      VAL  35 -10.609  -4.641   3.829
  298    H    PHE  36           H        PHE  36  -9.238   0.042   2.550
  299    HA   PHE  36           HA       PHE  36  -9.733   1.807   4.787
  300   1HB   PHE  36          2HB       PHE  36  -7.722   1.938   2.538
  301   2HB   PHE  36          1HB       PHE  36  -7.796   3.087   3.869
  302    HD1  PHE  36           HD2      PHE  36  -7.967   1.760   6.267
  303    HD2  PHE  36           HD1      PHE  36  -6.070   0.371   2.718
  304    HE1  PHE  36           HE2      PHE  36  -6.524   0.295   7.614
  305    HE2  PHE  36           HE1      PHE  36  -4.624  -1.097   4.061
  306    HZ   PHE  36           HZ       PHE  36  -4.852  -1.137   6.510
  307    H    GLY  37           H        GLY  37 -10.702   1.702   1.455
  308   1HA   GLY  37          2HA       GLY  37 -12.466   3.102   0.669
  309   2HA   GLY  37          1HA       GLY  37 -11.950   4.344   1.800
  310    H    GLN  38           H        GLN  38 -12.361   5.397  -0.510
  311    HA   GLN  38           HA       GLN  38  -9.690   5.817  -1.638
  312   1HB   GLN  38          2HB       GLN  38 -10.832   5.967  -3.940
  313   2HB   GLN  38          1HB       GLN  38 -10.513   4.371  -3.284
  314   1HG   GLN  38          2HG       GLN  38 -12.744   3.952  -2.861
  315   2HG   GLN  38          1HG       GLN  38 -13.168   5.663  -2.837
  316   1HE2  GLN  38          1HE2      GLN  38 -13.391   2.887  -4.595
  317   2HE2  GLN  38          2HE2      GLN  38 -13.660   3.562  -6.162
  318    HA   PRO  39           HA       PRO  39  -9.119   6.892  -3.536
  319   1HB   PRO  39          2HB       PRO  39  -7.702   9.059  -4.182
  320   2HB   PRO  39          1HB       PRO  39  -9.261   8.726  -4.945
  321   1HG   PRO  39          2HG       PRO  39  -8.587  10.662  -2.776
  322   2HG   PRO  39          1HG       PRO  39  -9.714  10.841  -4.130
  323   1HD   PRO  39          2HD       PRO  39 -10.409  10.163  -1.514
  324   2HD   PRO  39          1HD       PRO  39 -11.428   9.927  -2.946
  325    H    LEU  40           H        LEU  40  -7.250   6.013  -2.836
  326    HA   LEU  40           HA       LEU  40  -5.676   7.406  -0.794
  327   1HB   LEU  40          2HB       LEU  40  -6.791   4.618  -0.607
  328   2HB   LEU  40          1HB       LEU  40  -5.345   5.080   0.272
  329    HG   LEU  40           HG       LEU  40  -7.997   6.491   0.570
  330   1HD1  LEU  40          1HD1      LEU  40  -7.577   5.154   2.907
  331   2HD1  LEU  40          2HD1      LEU  40  -7.017   3.984   1.712
  332   3HD1  LEU  40          3HD1      LEU  40  -8.654   4.627   1.616
  333   1HD2  LEU  40          1HD2      LEU  40  -6.979   7.362   2.626
  334   2HD2  LEU  40          2HD2      LEU  40  -6.073   7.840   1.191
  335   3HD2  LEU  40          3HD2      LEU  40  -5.471   6.541   2.221
  336    H    ASP  41           H        ASP  41  -3.543   7.363  -1.211
  337    HA   ASP  41           HA       ASP  41  -2.617   5.608  -3.379
  338   1HB   ASP  41          2HB       ASP  41  -1.840   8.327  -2.449
  339   2HB   ASP  41          1HB       ASP  41  -0.561   7.306  -3.096
  340    H    LEU  42           H        LEU  42  -0.943   4.199  -3.113
  341    HA   LEU  42           HA       LEU  42  -0.086   3.708  -0.358
  342   1HB   LEU  42          2HB       LEU  42   0.206   2.032  -2.854
  343   2HB   LEU  42          1HB       LEU  42   0.768   1.558  -1.261
  344    HG   LEU  42           HG       LEU  42  -2.094   2.278  -1.449
  345   1HD1  LEU  42          1HD1      LEU  42  -2.327   1.066  -3.350
  346   2HD1  LEU  42          2HD1      LEU  42  -2.346  -0.266  -2.194
  347   3HD1  LEU  42          3HD1      LEU  42  -0.864   0.124  -3.066
  348   1HD2  LEU  42          1HD2      LEU  42  -1.712   1.446   0.612
  349   2HD2  LEU  42          2HD2      LEU  42  -0.315   0.501   0.093
  350   3HD2  LEU  42          3HD2      LEU  42  -1.946  -0.100  -0.201
  351    H    HIS  43           H        HIS  43   1.706   4.750   0.249
  352    HA   HIS  43           HA       HIS  43   3.892   5.046  -1.704
  353   1HB   HIS  43          2HB       HIS  43   2.734   7.089  -0.544
  354   2HB   HIS  43          1HB       HIS  43   3.741   6.642   0.829
  355    HD1  HIS  43           HD1      HIS  43   4.132   7.534  -2.841
  356    HD2  HIS  43           HD2      HIS  43   6.258   7.658   0.725
  357    HE1  HIS  43           HE1      HIS  43   6.257   8.769  -3.369
  358    HE2  HIS  43           HE2      HIS  43   7.432   8.993  -1.155
  359    H    TYR  44           H        TYR  44   5.717   3.963  -1.368
  360    HA   TYR  44           HA       TYR  44   6.022   2.438   1.087
  361   1HB   TYR  44          2HB       TYR  44   6.550   1.836  -1.527
  362   2HB   TYR  44          1HB       TYR  44   8.152   2.270  -0.941
  363    HD1  TYR  44           HD1      TYR  44   9.081   1.040   1.061
  364    HD2  TYR  44           HD2      TYR  44   5.587  -0.244  -0.996
  365    HE1  TYR  44           HE1      TYR  44   9.325  -1.193   2.058
  366    HE2  TYR  44           HE2      TYR  44   5.819  -2.484  -0.006
  367    HH   TYR  44           HH       TYR  44   8.414  -3.711   1.181
  368    H    MET  45           H        MET  45   7.307   3.017   2.718
  369    HA   MET  45           HA       MET  45   9.479   4.932   2.204
  370   1HB   MET  45          2HB       MET  45   7.216   5.724   3.407
  371   2HB   MET  45          1HB       MET  45   8.068   5.102   4.814
  372   1HG   MET  45          2HG       MET  45   9.266   7.103   2.918
  373   2HG   MET  45          1HG       MET  45   8.336   7.556   4.343
  374   1HE   MET  45          1HE       MET  45  10.434   8.960   4.377
  375   2HE   MET  45          2HE       MET  45  11.963   8.478   5.107
  376   3HE   MET  45          3HE       MET  45  10.537   8.703   6.118
  377    H    ASN  46           H        ASN  46  11.366   4.062   2.760
  378    HA   ASN  46           HA       ASN  46  11.453   1.753   4.508
  379   1HB   ASN  46          2HB       ASN  46  13.217   2.990   2.525
  380   2HB   ASN  46          1HB       ASN  46  14.080   2.423   3.950
  381   1HD2  ASN  46          1HD2      ASN  46  14.137   1.422   1.205
  382   2HD2  ASN  46          2HD2      ASN  46  13.681  -0.241   1.299
  383    H    ASN  47           H        ASN  47  13.141   4.891   4.435
  384    HA   ASN  47           HA       ASN  47  12.671   5.526   7.128
  385   1HB   ASN  47          2HB       ASN  47  14.894   3.722   6.678
  386   2HB   ASN  47          1HB       ASN  47  15.455   5.245   7.361
  387   1HD2  ASN  47          1HD2      ASN  47  15.950   3.401   9.012
  388   2HD2  ASN  47          2HD2      ASN  47  14.778   3.231  10.270
  389    H    GLU  48           H        GLU  48  15.227   5.767   4.657
  390    HA   GLU  48           HA       GLU  48  15.255   8.683   5.053
  391   1HB   GLU  48          2HB       GLU  48  17.360   6.790   4.015
  392   2HB   GLU  48          1HB       GLU  48  17.485   8.536   3.844
  393   1HG   GLU  48          2HG       GLU  48  17.199   7.110   6.480
  394   2HG   GLU  48          1HG       GLU  48  18.737   7.598   5.770
  395    H    LEU  49           H        LEU  49  14.824   6.130   2.664
  396    HA   LEU  49           HA       LEU  49  14.335   8.185   0.616
  397   1HB   LEU  49          2HB       LEU  49  15.497   5.459   0.510
  398   2HB   LEU  49          1HB       LEU  49  14.480   5.934  -0.836
  399    HG   LEU  49           HG       LEU  49  16.054   8.092  -0.755
  400   1HD1  LEU  49          1HD1      LEU  49  18.081   6.016  -0.101
  401   2HD1  LEU  49          2HD1      LEU  49  17.258   6.841   1.220
  402   3HD1  LEU  49          3HD1      LEU  49  18.175   7.771   0.036
  403   1HD2  LEU  49          1HD2      LEU  49  16.357   5.457  -2.116
  404   2HD2  LEU  49          2HD2      LEU  49  17.582   6.703  -2.356
  405   3HD2  LEU  49          3HD2      LEU  49  15.901   7.024  -2.784
  406    H    SER  50           H        SER  50  12.561   7.875  -0.834
  407    HA   SER  50           HA       SER  50  10.398   6.204   0.271
  408   1HB   SER  50          2HB       SER  50   9.628   8.605  -1.288
  409   2HB   SER  50          1HB       SER  50   8.895   7.912   0.157
  410    HG   SER  50           HG       SER  50  10.599   8.830   1.371
  411    H    ILE  51           H        ILE  51   9.557   4.756  -1.068
  412    HA   ILE  51           HA       ILE  51  10.104   5.014  -3.956
  413    HB   ILE  51           HB       ILE  51   9.556   2.446  -2.467
  414   1HG1  ILE  51          2HG1      ILE  51  11.633   3.369  -1.607
  415   2HG1  ILE  51          1HG1      ILE  51  11.991   2.003  -2.655
  416   1HG2  ILE  51          1HG2      ILE  51   9.307   2.863  -5.096
  417   2HG2  ILE  51          2HG2      ILE  51   9.859   1.334  -4.414
  418   3HG2  ILE  51          3HG2      ILE  51  11.031   2.500  -5.029
  419   1HD1  ILE  51          1HD1      ILE  51  12.385   3.729  -4.487
  420   2HD1  ILE  51          2HD1      ILE  51  13.581   3.621  -3.197
  421   3HD1  ILE  51          3HD1      ILE  51  12.393   4.923  -3.188
  422    H    LEU  52           H        LEU  52   8.423   4.960  -5.367
  423    HA   LEU  52           HA       LEU  52   5.730   4.808  -4.222
  424   1HB   LEU  52          2HB       LEU  52   6.945   6.408  -6.235
  425   2HB   LEU  52          1HB       LEU  52   5.688   5.455  -7.001
  426    HG   LEU  52           HG       LEU  52   5.201   7.127  -4.542
  427   1HD1  LEU  52          1HD1      LEU  52   3.978   8.529  -6.447
  428   2HD1  LEU  52          2HD1      LEU  52   5.316   7.891  -7.402
  429   3HD1  LEU  52          3HD1      LEU  52   5.641   8.845  -5.955
  430   1HD2  LEU  52          1HD2      LEU  52   2.861   6.914  -5.197
  431   2HD2  LEU  52          2HD2      LEU  52   3.596   5.331  -4.941
  432   3HD2  LEU  52          3HD2      LEU  52   3.329   5.926  -6.579
  433    H    LEU  53           H        LEU  53   4.446   3.100  -4.528
  434    HA   LEU  53           HA       LEU  53   5.324   1.034  -6.413
  435   1HB   LEU  53          2HB       LEU  53   3.703  -0.432  -5.182
  436   2HB   LEU  53          1HB       LEU  53   5.053   0.154  -4.229
  437    HG   LEU  53           HG       LEU  53   2.750   1.908  -3.994
  438   1HD1  LEU  53          1HD1      LEU  53   1.270   0.153  -4.245
  439   2HD1  LEU  53          2HD1      LEU  53   1.556   0.154  -2.504
  440   3HD1  LEU  53          3HD1      LEU  53   2.376  -1.021  -3.531
  441   1HD2  LEU  53          1HD2      LEU  53   4.930   1.400  -2.536
  442   2HD2  LEU  53          2HD2      LEU  53   3.794   0.329  -1.717
  443   3HD2  LEU  53          3HD2      LEU  53   3.449   2.054  -1.842
  444    H    LYS  54           H        LYS  54   4.554   1.971  -8.323
  445    HA   LYS  54           HA       LYS  54   1.636   2.245  -8.551
  446   1HB   LYS  54          2HB       LYS  54   3.937   3.498  -9.963
  447   2HB   LYS  54          1HB       LYS  54   2.454   3.253 -10.876
  448   1HG   LYS  54          2HG       LYS  54   1.330   4.846  -9.743
  449   2HG   LYS  54          1HG       LYS  54   2.138   4.487  -8.217
  450   1HD   LYS  54          2HD       LYS  54   2.935   6.606  -8.764
  451   2HD   LYS  54          1HD       LYS  54   4.220   5.533  -9.320
  452   1HE   LYS  54          2HE       LYS  54   3.912   7.069 -11.069
  453   2HE   LYS  54          1HE       LYS  54   3.081   5.606 -11.597
  454   1HZ   LYS  54          1HZ       LYS  54   1.024   6.733 -10.569
  455   2HZ   LYS  54          2HZ       LYS  54   1.574   7.273 -12.072
  456   3HZ   LYS  54          3HZ       LYS  54   1.928   8.161 -10.678
  457    H    ASN  55           H        ASN  55   4.423   0.556  -9.878
  458    HA   ASN  55           HA       ASN  55   2.661  -0.968 -11.669
  459   1HB   ASN  55          2HB       ASN  55   5.551  -0.267 -11.710
  460   2HB   ASN  55          1HB       ASN  55   5.102  -1.833 -12.372
  461   1HD2  ASN  55          1HD2      ASN  55   4.500  -1.888 -14.425
  462   2HD2  ASN  55          2HD2      ASN  55   4.007  -0.526 -15.366
  463    H    GLN  56           H        GLN  56   3.132  -3.320 -11.872
  464    HA   GLN  56           HA       GLN  56   2.935  -4.607  -9.369
  465   1HB   GLN  56          2HB       GLN  56   2.298  -5.345 -11.879
  466   2HB   GLN  56          1HB       GLN  56   3.818  -6.212 -11.707
  467   1HG   GLN  56          2HG       GLN  56   1.962  -6.491  -9.448
  468   2HG   GLN  56          1HG       GLN  56   1.403  -7.175 -10.971
  469   1HE2  GLN  56          1HE2      GLN  56   2.004  -8.647  -8.635
  470   2HE2  GLN  56          2HE2      GLN  56   3.334  -9.689  -8.991
  471    H    ASP  57           H        ASP  57   5.636  -4.126 -11.594
  472    HA   ASP  57           HA       ASP  57   7.489  -5.854 -10.393
  473   1HB   ASP  57          2HB       ASP  57   7.524  -3.775 -12.405
  474   2HB   ASP  57          1HB       ASP  57   8.946  -3.650 -11.373
  475    H    ASP  58           H        ASP  58   6.635  -2.500  -9.674
  476    HA   ASP  58           HA       ASP  58   8.704  -1.916  -7.875
  477   1HB   ASP  58          2HB       ASP  58   5.871  -0.859  -8.010
  478   2HB   ASP  58          1HB       ASP  58   7.118  -0.188  -6.965
  479    H    LEU  59           H        LEU  59   5.421  -3.156  -7.245
  480    HA   LEU  59           HA       LEU  59   5.731  -3.385  -4.450
  481   1HB   LEU  59          2HB       LEU  59   3.595  -3.487  -5.931
  482   2HB   LEU  59          1HB       LEU  59   3.948  -5.201  -6.036
  483    HG   LEU  59           HG       LEU  59   3.827  -5.369  -3.575
  484   1HD1  LEU  59          1HD1      LEU  59   2.535  -3.189  -2.655
  485   2HD1  LEU  59          2HD1      LEU  59   3.615  -2.441  -3.833
  486   3HD1  LEU  59          3HD1      LEU  59   4.278  -3.426  -2.528
  487   1HD2  LEU  59          1HD2      LEU  59   1.283  -4.035  -4.325
  488   2HD2  LEU  59          2HD2      LEU  59   1.562  -5.598  -3.558
  489   3HD2  LEU  59          3HD2      LEU  59   1.800  -5.414  -5.296
  490    H    ASP  60           H        ASP  60   6.310  -5.667  -7.099
  491    HA   ASP  60           HA       ASP  60   6.899  -7.918  -5.475
  492   1HB   ASP  60          2HB       ASP  60   6.501  -7.584  -8.133
  493   2HB   ASP  60          1HB       ASP  60   8.258  -7.708  -8.098
  494    H    LYS  61           H        LYS  61   8.876  -5.325  -6.815
  495    HA   LYS  61           HA       LYS  61  11.407  -6.401  -6.235
  496   1HB   LYS  61          2HB       LYS  61  10.334  -3.676  -6.794
  497   2HB   LYS  61          1HB       LYS  61  11.937  -3.786  -6.084
  498   1HG   LYS  61          2HG       LYS  61  11.231  -5.365  -8.527
  499   2HG   LYS  61          1HG       LYS  61  11.712  -3.672  -8.642
  500   1HD   LYS  61          2HD       LYS  61  13.381  -5.653  -7.128
  501   2HD   LYS  61          1HD       LYS  61  13.523  -5.497  -8.880
  502   1HE   LYS  61          2HE       LYS  61  13.622  -2.888  -8.053
  503   2HE   LYS  61          1HE       LYS  61  14.463  -3.725  -6.748
  504   1HZ   LYS  61          1HZ       LYS  61  15.161  -3.626  -9.618
  505   2HZ   LYS  61          2HZ       LYS  61  15.775  -4.838  -8.608
  506   3HZ   LYS  61          3HZ       LYS  61  16.115  -3.214  -8.284
  507    H    ALA  62           H        ALA  62   9.177  -4.445  -4.314
  508    HA   ALA  62           HA       ALA  62  10.906  -3.943  -2.145
  509   1HB   ALA  62          1HB       ALA  62   8.030  -4.229  -1.543
  510   2HB   ALA  62          2HB       ALA  62   8.450  -3.065  -2.799
  511   3HB   ALA  62          3HB       ALA  62   9.143  -2.908  -1.184
  512    H    ILE  63           H        ILE  63   8.713  -6.624  -2.860
  513    HA   ILE  63           HA       ILE  63   8.894  -7.897  -0.341
  514    HB   ILE  63           HB       ILE  63   8.360  -9.217  -3.010
  515   1HG1  ILE  63          2HG1      ILE  63   6.246  -8.332  -1.062
  516   2HG1  ILE  63          1HG1      ILE  63   6.879  -7.207  -2.257
  517   1HG2  ILE  63          1HG2      ILE  63   8.665 -10.994  -1.601
  518   2HG2  ILE  63          2HG2      ILE  63   6.950 -10.682  -1.328
  519   3HG2  ILE  63          3HG2      ILE  63   8.149 -10.096  -0.173
  520   1HD1  ILE  63          1HD1      ILE  63   6.288  -9.060  -3.958
  521   2HD1  ILE  63          2HD1      ILE  63   5.005  -8.051  -3.291
  522   3HD1  ILE  63          3HD1      ILE  63   5.263  -9.680  -2.664
  523    H    ASP  64           H        ASP  64  10.770  -8.246  -3.333
  524    HA   ASP  64           HA       ASP  64  12.311 -10.460  -2.673
  525   1HB   ASP  64          2HB       ASP  64  12.784  -8.064  -4.417
  526   2HB   ASP  64          1HB       ASP  64  14.097  -9.203  -4.140
  527    H    ILE  65           H        ILE  65  12.771  -7.065  -1.800
  528    HA   ILE  65           HA       ILE  65  15.320  -7.343  -0.619
  529    HB   ILE  65           HB       ILE  65  13.209  -5.320   0.138
  530   1HG1  ILE  65          2HG1      ILE  65  15.328  -5.111  -2.017
  531   2HG1  ILE  65          1HG1      ILE  65  13.616  -5.383  -2.320
  532   1HG2  ILE  65          1HG2      ILE  65  15.007  -3.963   0.905
  533   2HG2  ILE  65          2HG2      ILE  65  16.208  -5.072   0.245
  534   3HG2  ILE  65          3HG2      ILE  65  15.216  -5.561   1.619
  535   1HD1  ILE  65          1HD1      ILE  65  13.789  -3.128  -2.655
  536   2HD1  ILE  65          2HD1      ILE  65  15.009  -2.924  -1.398
  537   3HD1  ILE  65          3HD1      ILE  65  13.321  -3.182  -0.953
  538    H    LEU  66           H        LEU  66  12.044  -7.690   0.659
  539    HA   LEU  66           HA       LEU  66  12.735  -7.895   3.388
  540   1HB   LEU  66          2HB       LEU  66  10.390  -9.227   2.035
  541   2HB   LEU  66          1HB       LEU  66  10.534  -8.802   3.729
  542    HG   LEU  66           HG       LEU  66  10.543  -6.715   1.559
  543   1HD1  LEU  66          1HD1      LEU  66   8.087  -7.301   3.128
  544   2HD1  LEU  66          2HD1      LEU  66   8.461  -8.315   1.733
  545   3HD1  LEU  66          3HD1      LEU  66   8.265  -6.575   1.530
  546   1HD2  LEU  66          1HD2      LEU  66  10.062  -6.672   4.533
  547   2HD2  LEU  66          2HD2      LEU  66   9.731  -5.307   3.466
  548   3HD2  LEU  66          3HD2      LEU  66  11.380  -5.911   3.643
  549    H    ASP  67           H        ASP  67  12.279 -10.371   0.871
  550    HA   ASP  67           HA       ASP  67  12.648 -12.634   2.477
  551   1HB   ASP  67          2HB       ASP  67  12.719 -12.038  -0.405
  552   2HB   ASP  67          1HB       ASP  67  13.687 -13.429   0.076
  553    H    ARG  68           H        ARG  68  14.988 -10.449   1.032
  554    HA   ARG  68           HA       ARG  68  17.292 -12.060   1.367
  555   1HB   ARG  68          2HB       ARG  68  16.739  -9.190   0.839
  556   2HB   ARG  68          1HB       ARG  68  18.329  -9.584   1.479
  557   1HG   ARG  68          2HG       ARG  68  19.020 -10.439  -0.461
  558   2HG   ARG  68          1HG       ARG  68  17.507 -11.306  -0.731
  559   1HD   ARG  68          2HD       ARG  68  16.477  -9.423  -1.693
  560   2HD   ARG  68          1HD       ARG  68  17.718  -8.329  -1.081
  561    HE   ARG  68           HE       ARG  68  17.820  -9.912  -3.483
  562   1HH1  ARG  68          1HH1      ARG  68  19.735  -8.237  -1.070
  563   2HH1  ARG  68          2HH1      ARG  68  21.098  -8.029  -2.118
  564   1HH2  ARG  68          1HH2      ARG  68  19.618  -9.636  -4.856
  565   2HH2  ARG  68          2HH2      ARG  68  21.031  -8.824  -4.271
  566    H    SER  69           H        SER  69  15.538  -9.916   3.523
  567    HA   SER  69           HA       SER  69  17.582 -10.289   5.597
  568   1HB   SER  69          2HB       SER  69  16.847  -7.961   5.044
  569   2HB   SER  69          1HB       SER  69  15.228  -8.387   5.604
  570    HG   SER  69           HG       SER  69  16.081  -8.743   7.660
  571    H    SER  70           H        SER  70  17.242 -11.989   6.876
  572    HA   SER  70           HA       SER  70  14.824 -13.377   7.158
  573   1HB   SER  70          2HB       SER  70  16.832 -13.448   9.373
  574   2HB   SER  70          1HB       SER  70  15.938 -14.772   8.629
  575    HG   SER  70           HG       SER  70  18.201 -14.706   8.085
  576    H    SER  71           H        SER  71  16.161 -10.687   8.992
  577    HA   SER  71           HA       SER  71  14.315 -10.864  11.161
  578   1HB   SER  71          2HB       SER  71  15.150  -8.563  11.719
  579   2HB   SER  71          1HB       SER  71  16.428  -9.763  11.530
  580    HG   SER  71           HG       SER  71  17.181  -8.679   9.892
  581    H    MET  72           H        MET  72  14.619  -8.183   8.814
  582    HA   MET  72           HA       MET  72  11.906  -7.378   9.233
  583   1HB   MET  72          2HB       MET  72  14.233  -6.389   7.723
  584   2HB   MET  72          1HB       MET  72  12.676  -6.033   6.985
  585   1HG   MET  72          2HG       MET  72  12.545  -4.281   8.323
  586   2HG   MET  72          1HG       MET  72  12.324  -5.406   9.662
  587   1HE   MET  72          1HE       MET  72  14.849  -2.416   8.577
  588   2HE   MET  72          2HE       MET  72  14.800  -2.302  10.336
  589   3HE   MET  72          3HE       MET  72  13.306  -2.521   9.425
  590    H    LYS  73           H        LYS  73  10.314  -8.637   8.520
  591    HA   LYS  73           HA       LYS  73  10.466  -9.686   5.768
  592   1HB   LYS  73          2HB       LYS  73   8.819 -11.404   6.513
  593   2HB   LYS  73          1HB       LYS  73  10.375 -11.510   7.322
  594   1HG   LYS  73          2HG       LYS  73   9.506 -10.595   9.323
  595   2HG   LYS  73          1HG       LYS  73   8.012 -10.098   8.528
  596   1HD   LYS  73          2HD       LYS  73   7.404 -12.435   8.187
  597   2HD   LYS  73          1HD       LYS  73   8.915 -12.947   8.939
  598   1HE   LYS  73          2HE       LYS  73   8.031 -11.440  10.919
  599   2HE   LYS  73          1HE       LYS  73   6.470 -11.782  10.174
  600   1HZ   LYS  73          1HZ       LYS  73   8.378 -13.651  11.421
  601   2HZ   LYS  73          2HZ       LYS  73   7.274 -14.213  10.268
  602   3HZ   LYS  73          3HZ       LYS  73   6.715 -13.487  11.689
  603    H    SER  74           H        SER  74   8.414  -8.042   8.130
  604    HA   SER  74           HA       SER  74   6.100  -7.907   6.493
  605   1HB   SER  74          2HB       SER  74   6.653  -7.349   9.137
  606   2HB   SER  74          1HB       SER  74   6.370  -5.747   8.455
  607    HG   SER  74           HG       SER  74   4.627  -7.980   8.228
  608    H    LEU  75           H        LEU  75   5.117  -5.698   5.916
  609    HA   LEU  75           HA       LEU  75   7.179  -4.101   4.540
  610   1HB   LEU  75          2HB       LEU  75   4.332  -4.696   3.743
  611   2HB   LEU  75          1HB       LEU  75   5.351  -3.527   2.925
  612    HG   LEU  75           HG       LEU  75   6.977  -5.501   2.565
  613   1HD1  LEU  75          1HD1      LEU  75   4.502  -6.890   3.502
  614   2HD1  LEU  75          2HD1      LEU  75   6.189  -7.223   3.888
  615   3HD1  LEU  75          3HD1      LEU  75   5.548  -7.648   2.303
  616   1HD2  LEU  75          1HD2      LEU  75   5.695  -6.222   0.556
  617   2HD2  LEU  75          2HD2      LEU  75   5.825  -4.473   0.735
  618   3HD2  LEU  75          3HD2      LEU  75   4.322  -5.293   1.156
  619    H    ARG  76           H        ARG  76   7.262  -1.953   4.868
  620    HA   ARG  76           HA       ARG  76   5.274  -0.778   6.687
  621   1HB   ARG  76          2HB       ARG  76   8.079   0.110   5.980
  622   2HB   ARG  76          1HB       ARG  76   6.993   1.005   7.033
  623   1HG   ARG  76          2HG       ARG  76   7.016  -1.524   8.138
  624   2HG   ARG  76          1HG       ARG  76   8.680  -1.285   7.605
  625   1HD   ARG  76          2HD       ARG  76   7.079   0.513   9.424
  626   2HD   ARG  76          1HD       ARG  76   8.442  -0.510   9.876
  627    HE   ARG  76           HE       ARG  76   9.113   1.408   7.852
  628   1HH1  ARG  76          1HH1      ARG  76   8.741   0.943  11.303
  629   2HH1  ARG  76          2HH1      ARG  76   9.813   2.236  11.719
  630   1HH2  ARG  76          1HH2      ARG  76  10.528   3.122   8.413
  631   2HH2  ARG  76          2HH2      ARG  76  10.827   3.470  10.083
  632    H    ILE  77           H        ILE  77   3.722  -0.482   4.970
  633    HA   ILE  77           HA       ILE  77   4.427   1.613   3.023
  634    HB   ILE  77           HB       ILE  77   1.990  -0.168   2.960
  635   1HG1  ILE  77          2HG1      ILE  77   4.592  -0.498   1.447
  636   2HG1  ILE  77          1HG1      ILE  77   4.067  -1.509   2.789
  637   1HG2  ILE  77          1HG2      ILE  77   1.406   1.495   1.538
  638   2HG2  ILE  77          2HG2      ILE  77   2.396   0.563   0.416
  639   3HG2  ILE  77          3HG2      ILE  77   3.076   1.971   1.230
  640   1HD1  ILE  77          1HD1      ILE  77   3.715  -2.214   0.269
  641   2HD1  ILE  77          2HD1      ILE  77   2.245  -1.261   0.467
  642   3HD1  ILE  77          3HD1      ILE  77   2.556  -2.635   1.528
  643    H    LEU  78           H        LEU  78   3.550   3.589   3.176
  644    HA   LEU  78           HA       LEU  78   1.408   3.987   5.158
  645   1HB   LEU  78          2HB       LEU  78   2.188   6.267   5.401
  646   2HB   LEU  78          1HB       LEU  78   3.502   5.142   5.682
  647    HG   LEU  78           HG       LEU  78   3.867   5.680   3.044
  648   1HD1  LEU  78          1HD1      LEU  78   1.949   7.428   3.441
  649   2HD1  LEU  78          2HD1      LEU  78   3.347   7.828   2.446
  650   3HD1  LEU  78          3HD1      LEU  78   3.263   8.391   4.115
  651   1HD2  LEU  78          1HD2      LEU  78   4.947   7.169   5.431
  652   2HD2  LEU  78          2HD2      LEU  78   5.635   7.246   3.808
  653   3HD2  LEU  78          3HD2      LEU  78   5.615   5.717   4.688
  654    H    LEU  79           H        LEU  79  -0.505   4.827   4.558
  655    HA   LEU  79           HA       LEU  79  -0.779   5.685   1.755
  656   1HB   LEU  79          2HB       LEU  79  -3.214   5.099   2.043
  657   2HB   LEU  79          1HB       LEU  79  -2.093   3.753   2.022
  658    HG   LEU  79           HG       LEU  79  -2.229   3.991   4.642
  659   1HD1  LEU  79          1HD1      LEU  79  -3.598   5.651   5.253
  660   2HD1  LEU  79          2HD1      LEU  79  -4.893   4.524   4.852
  661   3HD1  LEU  79          3HD1      LEU  79  -4.377   5.727   3.671
  662   1HD2  LEU  79          1HD2      LEU  79  -2.936   1.953   3.983
  663   2HD2  LEU  79          2HD2      LEU  79  -3.920   2.599   2.670
  664   3HD2  LEU  79          3HD2      LEU  79  -4.528   2.629   4.326
  665    H    LEU  80           H        LEU  80  -1.641   7.640   1.284
  666    HA   LEU  80           HA       LEU  80  -2.395   9.339   3.573
  667   1HB   LEU  80          2HB       LEU  80  -1.337  10.251   0.900
  668   2HB   LEU  80          1HB       LEU  80  -1.609  11.243   2.318
  669    HG   LEU  80           HG       LEU  80   0.297   8.979   2.602
  670   1HD1  LEU  80          1HD1      LEU  80   0.614  10.423   0.369
  671   2HD1  LEU  80          2HD1      LEU  80   1.962   9.795   1.314
  672   3HD1  LEU  80          3HD1      LEU  80   1.451  11.470   1.514
  673   1HD2  LEU  80          1HD2      LEU  80  -0.483  10.942   4.256
  674   2HD2  LEU  80          2HD2      LEU  80   0.890  11.736   3.488
  675   3HD2  LEU  80          3HD2      LEU  80   1.114  10.200   4.323
  676    H    SER  81           H        SER  81  -4.164  10.709   3.407
  677    HA   SER  81           HA       SER  81  -6.168   9.888   1.443
  678   1HB   SER  81          2HB       SER  81  -6.549  10.056   4.010
  679   2HB   SER  81          1HB       SER  81  -6.676  11.792   3.718
  680    HG   SER  81           HG       SER  81  -8.615  10.166   3.538
  681    H    GLN  82           H        GLN  82  -7.293  11.367   0.131
  682    HA   GLN  82           HA       GLN  82  -5.741  13.652  -0.660
  683   1HB   GLN  82          2HB       GLN  82  -8.109  12.223  -1.748
  684   2HB   GLN  82          1HB       GLN  82  -7.868  13.894  -2.241
  685   1HG   GLN  82          2HG       GLN  82  -5.418  12.378  -2.439
  686   2HG   GLN  82          1HG       GLN  82  -6.722  11.633  -3.363
  687   1HE2  GLN  82          1HE2      GLN  82  -4.696  14.437  -3.004
  688   2HE2  GLN  82          2HE2      GLN  82  -5.075  15.154  -4.529
  689    H    ASP  83           H        ASP  83  -7.683  13.368   1.839
  690    HA   ASP  83           HA       ASP  83  -8.678  16.126   1.629
  691   1HB   ASP  83          2HB       ASP  83 -10.045  13.831   3.058
  692   2HB   ASP  83          1HB       ASP  83 -10.614  15.497   3.005
  693    H    ARG  84           H        ARG  84  -6.454  16.448   2.566
  694    HA   ARG  84           HA       ARG  84  -6.260  15.794   5.410
  695   1HB   ARG  84          2HB       ARG  84  -4.186  17.278   3.804
  696   2HB   ARG  84          1HB       ARG  84  -3.965  16.363   5.287
  697   1HG   ARG  84          2HG       ARG  84  -3.294  14.664   4.035
  698   2HG   ARG  84          1HG       ARG  84  -4.954  14.514   3.456
  699   1HD   ARG  84          2HD       ARG  84  -4.312  15.099   1.415
  700   2HD   ARG  84          1HD       ARG  84  -3.708  16.634   2.033
  701    HE   ARG  84           HE       ARG  84  -2.161  14.304   1.345
  702   1HH1  ARG  84          1HH1      ARG  84  -2.206  17.271   3.210
  703   2HH1  ARG  84          2HH1      ARG  84  -0.481  17.411   3.262
  704   1HH2  ARG  84          1HH2      ARG  84   0.113  14.492   1.421
  705   2HH2  ARG  84          2HH2      ARG  84   0.836  15.833   2.246
  706    H    ASN  85           H        ASN  85  -8.309  17.537   4.940
  707    HA   ASN  85           HA       ASN  85  -7.302  20.220   5.544
  708   1HB   ASN  85          2HB       ASN  85  -9.533  19.231   4.078
  709   2HB   ASN  85          1HB       ASN  85 -10.164  20.120   5.461
  710   1HD2  ASN  85          1HD2      ASN  85 -10.390  22.227   5.213
  711   2HD2  ASN  85          2HD2      ASN  85  -9.573  23.204   4.044
  712    H    LEU  86           H        LEU  86  -7.550  21.184   7.496
  713    HA   LEU  86           HA       LEU  86  -7.990  21.485   9.705
  714   1HB   LEU  86          2HB       LEU  86 -10.235  19.514   9.257
  715   2HB   LEU  86          1HB       LEU  86 -10.040  20.532  10.668
  716    HG   LEU  86           HG       LEU  86 -10.354  21.713   7.917
  717   1HD1  LEU  86          1HD1      LEU  86 -12.765  21.982   8.484
  718   2HD1  LEU  86          2HD1      LEU  86 -12.522  20.878   9.839
  719   3HD1  LEU  86          3HD1      LEU  86 -12.279  20.313   8.186
  720   1HD2  LEU  86          1HD2      LEU  86 -11.472  23.463   9.574
  721   2HD2  LEU  86          2HD2      LEU  86  -9.737  23.448   9.257
  722   3HD2  LEU  86          3HD2      LEU  86 -10.372  22.692  10.719
  723    H    GLU  87           H        GLU  87  -8.196  20.195  11.867
  724    HA   GLU  87           HA       GLU  87  -7.225  18.740  13.320
  725   1HB   GLU  87          2HB       GLU  87  -7.979  16.990  11.022
  726   2HB   GLU  87          1HB       GLU  87  -6.959  16.314  12.283
  727   1HG   GLU  87          2HG       GLU  87  -9.121  15.749  12.920
  728   2HG   GLU  87          1HG       GLU  87  -8.723  17.141  13.924
  729    H    HIS  88           H        HIS  88  -5.217  19.773  13.448
  730    HA   HIS  88           HA       HIS  88  -3.063  18.484  11.901
  731   1HB   HIS  88          2HB       HIS  88  -3.608  20.981  11.444
  732   2HB   HIS  88          1HB       HIS  88  -2.828  21.276  12.996
  733    HD1  HIS  88           HD1      HIS  88  -1.731  22.258  10.195
  734    HD2  HIS  88           HD2      HIS  88  -0.419  18.919  12.292
  735    HE1  HIS  88           HE1      HIS  88   0.605  21.820   9.370
  736    HE2  HIS  88           HE2      HIS  88   1.413  19.858  10.728
  737    H    HIS  89           H        HIS  89  -2.028  17.123  13.215
  738    HA   HIS  89           HA       HIS  89  -1.264  18.093  15.888
  739   1HB   HIS  89          2HB       HIS  89  -3.085  16.358  15.982
  740   2HB   HIS  89          1HB       HIS  89  -1.966  15.218  15.248
  741    HD1  HIS  89           HD1      HIS  89  -2.195  17.390  18.359
  742    HD2  HIS  89           HD2      HIS  89  -0.458  13.848  17.049
  743    HE1  HIS  89           HE1      HIS  89  -1.145  16.363  20.397
  744    HE2  HIS  89           HE2      HIS  89  -0.177  14.177  19.599
  745    H    HIS  90           H        HIS  90  -0.492  15.082  14.145
  746    HA   HIS  90           HA       HIS  90   1.516  14.053  13.791
  747   1HB   HIS  90          2HB       HIS  90   1.156  15.928  11.972
  748   2HB   HIS  90          1HB       HIS  90   2.562  16.654  12.747
  749    HD1  HIS  90           HD1      HIS  90   1.536  13.481  10.959
  750    HD2  HIS  90           HD2      HIS  90   4.971  15.561  12.031
  751    HE1  HIS  90           HE1      HIS  90   3.429  12.294   9.805
  752    HE2  HIS  90           HE2      HIS  90   5.507  13.522  10.533
  753    H    HIS  91           H        HIS  91   1.970  13.901  16.106
  754    HA   HIS  91           HA       HIS  91   3.421  13.964  17.860
  755   1HB   HIS  91          2HB       HIS  91   5.248  15.471  15.972
  756   2HB   HIS  91          1HB       HIS  91   5.726  14.701  17.478
  757    HD1  HIS  91           HD1      HIS  91   6.786  12.501  17.151
  758    HD2  HIS  91           HD2      HIS  91   4.095  13.373  14.106
  759    HE1  HIS  91           HE1      HIS  91   6.933  10.567  15.550
  760    HE2  HIS  91           HE2      HIS  91   5.324  11.135  13.696
  761    H    HIS  92           H        HIS  92   5.104  15.861  18.914
  762    HA   HIS  92           HA       HIS  92   3.864  18.462  18.820
  763   1HB   HIS  92          2HB       HIS  92   2.543  16.850  20.445
  764   2HB   HIS  92          1HB       HIS  92   3.864  17.234  21.544
  765    HD1  HIS  92           HD1      HIS  92   3.853  19.523  22.631
  766    HD2  HIS  92           HD2      HIS  92   0.927  19.092  19.712
  767    HE1  HIS  92           HE1      HIS  92   2.382  21.550  22.850
  768    HE2  HIS  92           HE2      HIS  92   0.704  21.333  20.983
  769    H    HIS  93           H        HIS  93   5.285  20.023  19.307
  770    HA   HIS  93           HA       HIS  93   7.724  19.287  20.783
  771   1HB   HIS  93          2HB       HIS  93   7.470  20.775  18.180
  772   2HB   HIS  93          1HB       HIS  93   8.860  21.029  19.228
  773    HD1  HIS  93           HD1      HIS  93  10.122  18.642  19.882
  774    HD2  HIS  93           HD2      HIS  93   7.825  18.752  16.421
  775    HE1  HIS  93           HE1      HIS  93  10.902  16.694  18.495
  776    HE2  HIS  93           HE2      HIS  93   9.576  16.850  16.357
  Start of MODEL   10
    1    H    GLN   1           H        GLN   1   9.066 -20.137   1.880
    2    HA   GLN   1           HA       GLN   1   7.252 -21.557   1.913
    3   1HB   GLN   1          2HB       GLN   1   6.797 -20.326   4.627
    4   2HB   GLN   1          1HB       GLN   1   5.494 -21.136   3.770
    5   1HG   GLN   1          2HG       GLN   1   6.208 -22.968   4.820
    6   2HG   GLN   1          1HG       GLN   1   7.484 -22.982   3.602
    7   1HE2  GLN   1          1HE2      GLN   1   6.954 -23.286   6.792
    8   2HE2  GLN   1          2HE2      GLN   1   8.471 -22.736   7.409
    9    H    SER   2           H        SER   2   4.794 -20.864   1.783
   10    HA   SER   2           HA       SER   2   4.773 -18.366   0.296
   11   1HB   SER   2          2HB       SER   2   2.612 -20.467   0.612
   12   2HB   SER   2          1HB       SER   2   2.581 -19.111  -0.515
   13    HG   SER   2           HG       SER   2   4.097 -20.055  -1.726
   14    H    ASP   3           H        ASP   3   2.549 -17.156   0.490
   15    HA   ASP   3           HA       ASP   3   1.115 -15.865   1.689
   16   1HB   ASP   3          2HB       ASP   3   1.684 -17.664   4.053
   17   2HB   ASP   3          1HB       ASP   3   0.333 -16.550   3.877
   18    H    VAL   4           H        VAL   4   1.553 -13.872   2.381
   19    HA   VAL   4           HA       VAL   4   3.774 -13.475   4.271
   20    HB   VAL   4           HB       VAL   4   3.341 -11.722   1.846
   21   1HG1  VAL   4          1HG1      VAL   4   5.649 -10.934   2.459
   22   2HG1  VAL   4          2HG1      VAL   4   5.475 -11.826   3.968
   23   3HG1  VAL   4          3HG1      VAL   4   4.379 -10.495   3.602
   24   1HG2  VAL   4          1HG2      VAL   4   4.869 -14.212   2.180
   25   2HG2  VAL   4          2HG2      VAL   4   5.752 -12.881   1.436
   26   3HG2  VAL   4          3HG2      VAL   4   4.245 -13.449   0.719
   27    H    ARG   5           H        ARG   5   3.603 -11.704   5.646
   28    HA   ARG   5           HA       ARG   5   0.903 -10.627   5.935
   29   1HB   ARG   5          2HB       ARG   5   2.937 -11.429   7.753
   30   2HB   ARG   5          1HB       ARG   5   2.676  -9.705   7.985
   31   1HG   ARG   5          2HG       ARG   5   1.028 -10.334   9.347
   32   2HG   ARG   5          1HG       ARG   5   0.117 -10.640   7.866
   33   1HD   ARG   5          2HD       ARG   5   0.790 -12.964   7.888
   34   2HD   ARG   5          1HD       ARG   5   1.821 -12.680   9.292
   35    HE   ARG   5           HE       ARG   5  -0.892 -11.967   9.801
   36   1HH1  ARG   5          1HH1      ARG   5   1.283 -14.706   9.603
   37   2HH1  ARG   5          2HH1      ARG   5   0.353 -15.680  10.691
   38   1HH2  ARG   5          1HH2      ARG   5  -2.114 -13.257  11.234
   39   2HH2  ARG   5          2HH2      ARG   5  -1.573 -14.858  11.616
   40    H    ILE   6           H        ILE   6   0.364  -8.548   5.596
   41    HA   ILE   6           HA       ILE   6   2.527  -6.675   4.874
   42    HB   ILE   6           HB       ILE   6  -0.340  -6.523   3.930
   43   1HG1  ILE   6          2HG1      ILE   6   2.031  -7.494   2.324
   44   2HG1  ILE   6          1HG1      ILE   6   0.910  -8.584   3.133
   45   1HG2  ILE   6          1HG2      ILE   6   0.782  -5.064   2.161
   46   2HG2  ILE   6          2HG2      ILE   6   2.172  -5.026   3.244
   47   3HG2  ILE   6          3HG2      ILE   6   0.618  -4.390   3.782
   48   1HD1  ILE   6          1HD1      ILE   6   0.173  -8.488   0.925
   49   2HD1  ILE   6          2HD1      ILE   6   0.389  -6.740   0.833
   50   3HD1  ILE   6          3HD1      ILE   6  -0.919  -7.419   1.803
   51    H    LYS   7           H        LYS   7   2.621  -4.720   5.867
   52    HA   LYS   7           HA       LYS   7   0.601  -4.190   7.941
   53   1HB   LYS   7          2HB       LYS   7   3.486  -4.108   7.950
   54   2HB   LYS   7          1HB       LYS   7   2.834  -2.531   8.375
   55   1HG   LYS   7          2HG       LYS   7   1.289  -4.124   9.913
   56   2HG   LYS   7          1HG       LYS   7   2.780  -5.067   9.861
   57   1HD   LYS   7          2HD       LYS   7   4.019  -3.410  10.902
   58   2HD   LYS   7          1HD       LYS   7   2.889  -2.135  10.442
   59   1HE   LYS   7          2HE       LYS   7   1.516  -2.527  12.202
   60   2HE   LYS   7          1HE       LYS   7   1.828  -4.262  12.200
   61   1HZ   LYS   7          1HZ       LYS   7   3.768  -2.225  13.158
   62   2HZ   LYS   7          2HZ       LYS   7   3.905  -3.906  13.296
   63   3HZ   LYS   7          3HZ       LYS   7   2.713  -3.082  14.169
   64    H    PHE   8           H        PHE   8  -0.741  -2.556   7.628
   65    HA   PHE   8           HA       PHE   8   0.056  -0.401   5.778
   66   1HB   PHE   8          2HB       PHE   8  -2.674  -1.585   6.312
   67   2HB   PHE   8          1HB       PHE   8  -2.418  -0.103   5.396
   68    HD1  PHE   8           HD1      PHE   8  -0.796  -0.290   3.367
   69    HD2  PHE   8           HD2      PHE   8  -2.722  -3.609   5.210
   70    HE1  PHE   8           HE1      PHE   8  -0.468  -1.613   1.318
   71    HE2  PHE   8           HE2      PHE   8  -2.395  -4.938   3.164
   72    HZ   PHE   8           HZ       PHE   8  -1.267  -3.940   1.216
   73    H    GLU   9           H        GLU   9  -0.217   1.701   6.397
   74    HA   GLU   9           HA       GLU   9  -1.219   2.149   9.132
   75   1HB   GLU   9          2HB       GLU   9   1.210   3.155   7.731
   76   2HB   GLU   9          1HB       GLU   9   0.410   4.238   8.862
   77   1HG   GLU   9          2HG       GLU   9   1.262   3.175  10.610
   78   2HG   GLU   9          1HG       GLU   9   0.721   1.611  10.004
   79    H    HIS  10           H        HIS  10  -2.777   3.616   9.408
   80    HA   HIS  10           HA       HIS  10  -3.299   5.576   7.283
   81   1HB   HIS  10          2HB       HIS  10  -4.800   3.502   7.139
   82   2HB   HIS  10          1HB       HIS  10  -5.528   4.062   8.640
   83    HD1  HIS  10           HD1      HIS  10  -7.802   4.624   7.701
   84    HD2  HIS  10           HD2      HIS  10  -4.704   6.513   5.677
   85    HE1  HIS  10           HE1      HIS  10  -8.913   6.279   6.169
   86    HE2  HIS  10           HE2      HIS  10  -7.015   7.469   5.017
   87    H    ASN  11           H        ASN  11  -3.140   7.517   8.197
   88    HA   ASN  11           HA       ASN  11  -3.263   9.240   9.675
   89   1HB   ASN  11          2HB       ASN  11  -5.732   7.663  10.247
   90   2HB   ASN  11          1HB       ASN  11  -5.302   8.959  11.357
   91   1HD2  ASN  11          1HD2      ASN  11  -5.388   8.441   7.835
   92   2HD2  ASN  11          2HD2      ASN  11  -6.166   9.940   7.471
   93    H    GLY  12           H        GLY  12  -1.503   7.066  10.350
   94   1HA   GLY  12          2HA       GLY  12  -0.011   6.970  12.183
   95   2HA   GLY  12          1HA       GLY  12  -1.290   7.570  13.227
   96    H    GLU  13           H        GLU  13  -3.290   5.673  12.339
   97    HA   GLU  13           HA       GLU  13  -2.770   3.566  14.142
   98   1HB   GLU  13          2HB       GLU  13  -4.994   4.569  12.789
   99   2HB   GLU  13          1HB       GLU  13  -4.815   2.933  12.175
  100   1HG   GLU  13          2HG       GLU  13  -4.528   2.494  14.824
  101   2HG   GLU  13          1HG       GLU  13  -5.613   3.884  14.838
  102    H    ARG  14           H        ARG  14  -2.468   1.330  13.758
  103    HA   ARG  14           HA       ARG  14  -1.310   0.698  11.123
  104   1HB   ARG  14          2HB       ARG  14   0.172  -0.908  12.280
  105   2HB   ARG  14          1HB       ARG  14   0.443   0.751  12.787
  106   1HG   ARG  14          2HG       ARG  14  -1.456  -0.294  14.568
  107   2HG   ARG  14          1HG       ARG  14  -0.231  -1.548  14.362
  108   1HD   ARG  14          2HD       ARG  14   1.515  -0.035  14.992
  109   2HD   ARG  14          1HD       ARG  14   0.402   1.332  14.982
  110    HE   ARG  14           HE       ARG  14  -0.366  -0.728  16.824
  111   1HH1  ARG  14          1HH1      ARG  14   1.669   2.094  16.407
  112   2HH1  ARG  14          2HH1      ARG  14   1.745   2.440  18.101
  113   1HH2  ARG  14          1HH2      ARG  14  -0.257  -0.268  19.056
  114   2HH2  ARG  14          2HH2      ARG  14   0.654   1.098  19.604
  115    H    ARG  15           H        ARG  15  -1.857  -1.210  10.138
  116    HA   ARG  15           HA       ARG  15  -3.785  -2.949  11.533
  117   1HB   ARG  15          2HB       ARG  15  -3.961  -1.912   8.698
  118   2HB   ARG  15          1HB       ARG  15  -4.965  -3.211   9.330
  119   1HG   ARG  15          2HG       ARG  15  -5.768  -1.601  11.083
  120   2HG   ARG  15          1HG       ARG  15  -4.922  -0.330  10.197
  121   1HD   ARG  15          2HD       ARG  15  -6.255  -0.959   8.179
  122   2HD   ARG  15          1HD       ARG  15  -7.179  -2.061   9.198
  123    HE   ARG  15           HE       ARG  15  -7.413   0.799   9.077
  124   1HH1  ARG  15          1HH1      ARG  15  -7.951  -2.032  11.068
  125   2HH1  ARG  15          2HH1      ARG  15  -9.159  -1.270  12.044
  126   1HH2  ARG  15          1HH2      ARG  15  -9.009   1.802  10.369
  127   2HH2  ARG  15          2HH2      ARG  15  -9.760   0.909  11.649
  128    H    ILE  16           H        ILE  16  -3.746  -5.144  10.985
  129    HA   ILE  16           HA       ILE  16  -1.357  -6.004   9.478
  130    HB   ILE  16           HB       ILE  16  -2.747  -7.559  11.665
  131   1HG1  ILE  16          2HG1      ILE  16  -0.090  -6.177  11.968
  132   2HG1  ILE  16          1HG1      ILE  16  -1.592  -5.340  12.339
  133   1HG2  ILE  16          1HG2      ILE  16  -0.426  -8.052   9.894
  134   2HG2  ILE  16          2HG2      ILE  16  -1.600  -9.179  10.570
  135   3HG2  ILE  16          3HG2      ILE  16  -0.282  -8.574  11.572
  136   1HD1  ILE  16          1HD1      ILE  16  -1.447  -6.188  14.375
  137   2HD1  ILE  16          2HD1      ILE  16  -0.119  -7.250  13.905
  138   3HD1  ILE  16          3HD1      ILE  16  -1.787  -7.771  13.672
  139    H    ILE  17           H        ILE  17  -1.685  -7.181   7.695
  140    HA   ILE  17           HA       ILE  17  -4.116  -8.798   7.456
  141    HB   ILE  17           HB       ILE  17  -4.627  -6.662   6.354
  142   1HG1  ILE  17          2HG1      ILE  17  -5.201  -7.599   4.090
  143   2HG1  ILE  17          1HG1      ILE  17  -4.264  -9.029   4.505
  144   1HG2  ILE  17          1HG2      ILE  17  -2.040  -6.533   5.655
  145   2HG2  ILE  17          2HG2      ILE  17  -3.312  -5.614   4.853
  146   3HG2  ILE  17          3HG2      ILE  17  -2.731  -7.119   4.144
  147   1HD1  ILE  17          1HD1      ILE  17  -5.786  -9.672   6.163
  148   2HD1  ILE  17          2HD1      ILE  17  -6.780  -9.143   4.807
  149   3HD1  ILE  17          3HD1      ILE  17  -6.549  -8.083   6.199
  150    H    ALA  18           H        ALA  18  -3.813 -10.721   6.466
  151    HA   ALA  18           HA       ALA  18  -1.107 -11.308   5.483
  152   1HB   ALA  18          1HB       ALA  18  -1.306 -13.396   6.325
  153   2HB   ALA  18          2HB       ALA  18  -3.015 -13.522   5.906
  154   3HB   ALA  18          3HB       ALA  18  -2.524 -12.631   7.347
  155    H    PHE  19           H        PHE  19  -0.729 -12.155   3.474
  156    HA   PHE  19           HA       PHE  19  -3.045 -12.448   1.674
  157   1HB   PHE  19          2HB       PHE  19  -0.568 -10.826   1.358
  158   2HB   PHE  19          1HB       PHE  19  -1.188 -11.640  -0.073
  159    HD1  PHE  19           HD1      PHE  19  -2.311  -9.429   2.709
  160    HD2  PHE  19           HD2      PHE  19  -2.799 -10.598  -1.354
  161    HE1  PHE  19           HE1      PHE  19  -3.938  -7.613   2.384
  162    HE2  PHE  19           HE2      PHE  19  -4.425  -8.784  -1.686
  163    HZ   PHE  19           HZ       PHE  19  -4.997  -7.287   0.184
  164    H    SER  20           H        SER  20  -2.784 -13.920  -0.083
  165    HA   SER  20           HA       SER  20  -0.936 -16.096   0.541
  166   1HB   SER  20          2HB       SER  20  -3.290 -16.693   0.279
  167   2HB   SER  20          1HB       SER  20  -3.309 -15.989  -1.339
  168    HG   SER  20           HG       SER  20  -2.917 -18.415  -0.951
  169    H    ARG  21           H        ARG  21   0.567 -16.907  -0.890
  170    HA   ARG  21           HA       ARG  21   1.283 -15.128  -3.102
  171   1HB   ARG  21          2HB       ARG  21   2.844 -16.163  -1.158
  172   2HB   ARG  21          1HB       ARG  21   3.046 -17.402  -2.389
  173   1HG   ARG  21          2HG       ARG  21   4.118 -15.980  -3.839
  174   2HG   ARG  21          1HG       ARG  21   3.382 -14.537  -3.139
  175   1HD   ARG  21          2HD       ARG  21   5.007 -15.939  -1.200
  176   2HD   ARG  21          1HD       ARG  21   5.935 -15.537  -2.644
  177    HE   ARG  21           HE       ARG  21   4.376 -13.346  -1.620
  178   1HH1  ARG  21          1HH1      ARG  21   7.438 -15.029  -1.388
  179   2HH1  ARG  21          2HH1      ARG  21   8.286 -13.654  -0.765
  180   1HH2  ARG  21          1HH2      ARG  21   5.498 -11.543  -0.793
  181   2HH2  ARG  21          2HH2      ARG  21   7.185 -11.679  -0.422
  182    HA   PRO  22           HA       PRO  22   2.473 -15.138  -4.969
  183   1HB   PRO  22          2HB       PRO  22   1.157 -14.982  -7.553
  184   2HB   PRO  22          1HB       PRO  22   2.865 -15.238  -7.192
  185   1HG   PRO  22          2HG       PRO  22   1.266 -17.159  -8.264
  186   2HG   PRO  22          1HG       PRO  22   2.666 -17.519  -7.241
  187   1HD   PRO  22          2HD       PRO  22  -0.243 -17.474  -6.526
  188   2HD   PRO  22          1HD       PRO  22   1.022 -18.621  -6.033
  189    H    VAL  23           H        VAL  23   1.930 -13.013  -4.772
  190    HA   VAL  23           HA       VAL  23  -0.942 -12.399  -4.626
  191    HB   VAL  23           HB       VAL  23   0.293 -12.073  -2.526
  192   1HG1  VAL  23          1HG1      VAL  23   1.852  -9.951  -3.997
  193   2HG1  VAL  23          2HG1      VAL  23   2.484 -11.528  -3.524
  194   3HG1  VAL  23          3HG1      VAL  23   1.990 -10.372  -2.289
  195   1HG2  VAL  23          1HG2      VAL  23  -1.652 -10.672  -3.022
  196   2HG2  VAL  23          2HG2      VAL  23  -0.598  -9.475  -3.772
  197   3HG2  VAL  23          3HG2      VAL  23  -0.465  -9.809  -2.045
  198    H    LYS  24           H        LYS  24  -1.828 -10.873  -5.902
  199    HA   LYS  24           HA       LYS  24  -0.094  -9.615  -7.900
  200   1HB   LYS  24          2HB       LYS  24  -2.974 -10.377  -7.789
  201   2HB   LYS  24          1HB       LYS  24  -2.531  -9.006  -8.796
  202   1HG   LYS  24          2HG       LYS  24  -2.495 -10.834 -10.239
  203   2HG   LYS  24          1HG       LYS  24  -0.797 -10.552  -9.847
  204   1HD   LYS  24          2HD       LYS  24  -1.546 -12.287  -7.875
  205   2HD   LYS  24          1HD       LYS  24  -2.525 -12.844  -9.233
  206   1HE   LYS  24          2HE       LYS  24  -0.255 -12.634 -10.538
  207   2HE   LYS  24          1HE       LYS  24   0.443 -12.769  -8.925
  208   1HZ   LYS  24          1HZ       LYS  24   0.331 -14.952  -9.525
  209   2HZ   LYS  24          2HZ       LYS  24  -1.053 -14.757 -10.478
  210   3HZ   LYS  24          3HZ       LYS  24  -1.186 -14.799  -8.792
  211    H    TYR  25           H        TYR  25  -0.009  -7.410  -8.241
  212    HA   TYR  25           HA       TYR  25  -0.363  -5.719  -6.030
  213   1HB   TYR  25          2HB       TYR  25   1.242  -5.200  -7.801
  214   2HB   TYR  25          1HB       TYR  25  -0.073  -4.986  -8.954
  215    HD1  TYR  25           HD2      TYR  25   0.879  -3.695  -5.569
  216    HD2  TYR  25           HD1      TYR  25  -0.628  -2.800  -9.446
  217    HE1  TYR  25           HE2      TYR  25   0.740  -1.319  -4.960
  218    HE2  TYR  25           HE1      TYR  25  -0.773  -0.421  -8.847
  219    HH   TYR  25           HH       TYR  25   0.713   1.046  -6.762
  220    H    GLU  26           H        GLU  26  -2.367  -6.188  -8.931
  221    HA   GLU  26           HA       GLU  26  -4.243  -4.168  -8.421
  222   1HB   GLU  26          2HB       GLU  26  -4.428  -6.763  -9.945
  223   2HB   GLU  26          1HB       GLU  26  -5.800  -5.673  -9.807
  224   1HG   GLU  26          2HG       GLU  26  -3.120  -4.949 -10.970
  225   2HG   GLU  26          1HG       GLU  26  -4.559  -5.369 -11.897
  226    H    ASP  27           H        ASP  27  -4.148  -7.557  -7.376
  227    HA   ASP  27           HA       ASP  27  -6.688  -7.608  -6.157
  228   1HB   ASP  27          2HB       ASP  27  -4.600  -9.431  -6.546
  229   2HB   ASP  27          1HB       ASP  27  -4.774  -9.311  -4.798
  230    H    VAL  28           H        VAL  28  -3.462  -6.880  -4.841
  231    HA   VAL  28           HA       VAL  28  -4.341  -6.538  -2.164
  232    HB   VAL  28           HB       VAL  28  -1.907  -5.273  -3.439
  233   1HG1  VAL  28          1HG1      VAL  28  -1.866  -6.143  -0.626
  234   2HG1  VAL  28          2HG1      VAL  28  -2.918  -4.772  -0.980
  235   3HG1  VAL  28          3HG1      VAL  28  -1.202  -4.694  -1.378
  236   1HG2  VAL  28          1HG2      VAL  28  -2.419  -7.958  -3.356
  237   2HG2  VAL  28          2HG2      VAL  28  -1.521  -7.703  -1.859
  238   3HG2  VAL  28          3HG2      VAL  28  -0.815  -7.227  -3.403
  239    H    GLU  29           H        GLU  29  -3.690  -4.227  -4.789
  240    HA   GLU  29           HA       GLU  29  -4.236  -1.874  -3.390
  241   1HB   GLU  29          2HB       GLU  29  -3.196  -1.989  -5.650
  242   2HB   GLU  29          1HB       GLU  29  -4.766  -2.408  -6.320
  243   1HG   GLU  29          2HG       GLU  29  -4.624   0.056  -4.694
  244   2HG   GLU  29          1HG       GLU  29  -3.815   0.085  -6.258
  245    H    HIS  30           H        HIS  30  -6.426  -3.957  -5.266
  246    HA   HIS  30           HA       HIS  30  -8.730  -2.409  -5.061
  247   1HB   HIS  30          2HB       HIS  30  -8.258  -4.601  -6.387
  248   2HB   HIS  30          1HB       HIS  30  -8.848  -5.408  -4.941
  249    HD1  HIS  30           HD1      HIS  30 -10.819  -2.475  -5.101
  250    HD2  HIS  30           HD2      HIS  30 -10.759  -6.037  -7.244
  251    HE1  HIS  30           HE1      HIS  30 -13.091  -2.661  -6.164
  252    HE2  HIS  30           HE2      HIS  30 -13.053  -4.855  -7.401
  253    H    LYS  31           H        LYS  31  -7.543  -4.963  -2.883
  254    HA   LYS  31           HA       LYS  31  -9.705  -4.790  -1.063
  255   1HB   LYS  31          2HB       LYS  31  -8.153  -6.739  -1.256
  256   2HB   LYS  31          1HB       LYS  31  -6.900  -5.766  -0.497
  257   1HG   LYS  31          2HG       LYS  31  -7.882  -5.852   1.568
  258   2HG   LYS  31          1HG       LYS  31  -9.504  -6.062   0.907
  259   1HD   LYS  31          2HD       LYS  31  -9.242  -8.331   0.628
  260   2HD   LYS  31          1HD       LYS  31  -7.486  -8.221   0.494
  261   1HE   LYS  31          2HE       LYS  31  -7.202  -8.037   2.802
  262   2HE   LYS  31          1HE       LYS  31  -8.878  -7.560   3.065
  263   1HZ   LYS  31          1HZ       LYS  31  -7.831 -10.256   2.427
  264   2HZ   LYS  31          2HZ       LYS  31  -9.473  -9.869   2.288
  265   3HZ   LYS  31          3HZ       LYS  31  -8.703  -9.771   3.793
  266    H    VAL  32           H        VAL  32  -6.405  -3.429  -0.957
  267    HA   VAL  32           HA       VAL  32  -6.632  -2.147   1.517
  268    HB   VAL  32           HB       VAL  32  -4.998  -1.195  -0.843
  269   1HG1  VAL  32          1HG1      VAL  32  -3.609  -0.070   0.763
  270   2HG1  VAL  32          2HG1      VAL  32  -4.546  -0.732   2.102
  271   3HG1  VAL  32          3HG1      VAL  32  -5.279   0.443   1.011
  272   1HG2  VAL  32          1HG2      VAL  32  -3.505  -2.818  -0.473
  273   2HG2  VAL  32          2HG2      VAL  32  -4.807  -3.634   0.392
  274   3HG2  VAL  32          3HG2      VAL  32  -3.632  -2.663   1.279
  275    H    THR  33           H        THR  33  -7.380  -0.929  -1.743
  276    HA   THR  33           HA       THR  33  -8.031   1.691  -0.987
  277    HB   THR  33           HB       THR  33  -9.080   0.058  -3.310
  278    HG1  THR  33           HG1      THR  33  -6.854   1.793  -3.032
  279   1HG2  THR  33          1HG2      THR  33 -10.349   2.197  -2.766
  280   2HG2  THR  33          2HG2      THR  33  -9.707   2.019  -4.400
  281   3HG2  THR  33          3HG2      THR  33  -8.878   3.045  -3.228
  282    H    THR  34           H        THR  34 -10.043  -1.243  -1.146
  283    HA   THR  34           HA       THR  34 -12.467   0.143  -0.522
  284    HB   THR  34           HB       THR  34 -11.906  -2.807  -0.167
  285    HG1  THR  34           HG1      THR  34 -12.703  -1.346  -2.459
  286   1HG2  THR  34          1HG2      THR  34 -13.980  -2.367   0.822
  287   2HG2  THR  34          2HG2      THR  34 -14.354  -2.954  -0.799
  288   3HG2  THR  34          3HG2      THR  34 -14.436  -1.228  -0.444
  289    H    VAL  35           H        VAL  35 -10.132  -1.718   1.407
  290    HA   VAL  35           HA       VAL  35 -11.569  -1.663   3.823
  291    HB   VAL  35           HB       VAL  35  -8.564  -1.747   3.486
  292   1HG1  VAL  35          1HG1      VAL  35 -10.365  -2.026   5.819
  293   2HG1  VAL  35          2HG1      VAL  35  -8.711  -1.419   5.725
  294   3HG1  VAL  35          3HG1      VAL  35  -9.017  -3.156   5.710
  295   1HG2  VAL  35          1HG2      VAL  35  -8.697  -3.898   2.897
  296   2HG2  VAL  35          2HG2      VAL  35 -10.395  -3.580   2.550
  297   3HG2  VAL  35          3HG2      VAL  35  -9.925  -4.246   4.113
  298    H    PHE  36           H        PHE  36  -8.926   0.484   2.711
  299    HA   PHE  36           HA       PHE  36  -9.382   2.257   4.960
  300   1HB   PHE  36          2HB       PHE  36  -7.423   2.415   2.668
  301   2HB   PHE  36          1HB       PHE  36  -7.484   3.551   4.010
  302    HD1  PHE  36           HD1      PHE  36  -7.038   2.709   6.334
  303    HD2  PHE  36           HD2      PHE  36  -6.286   0.367   2.861
  304    HE1  PHE  36           HE1      PHE  36  -5.547   1.253   7.641
  305    HE2  PHE  36           HE2      PHE  36  -4.796  -1.091   4.163
  306    HZ   PHE  36           HZ       PHE  36  -4.427  -0.648   6.555
  307    H    GLY  37           H        GLY  37 -10.468   2.065   1.679
  308   1HA   GLY  37          2HA       GLY  37 -12.256   3.427   0.899
  309   2HA   GLY  37          1HA       GLY  37 -11.746   4.690   2.009
  310    H    GLN  38           H        GLN  38 -12.241   5.693  -0.310
  311    HA   GLN  38           HA       GLN  38  -9.610   6.210  -1.485
  312   1HB   GLN  38          2HB       GLN  38 -10.618   6.175  -3.779
  313   2HB   GLN  38          1HB       GLN  38 -10.520   4.598  -3.009
  314   1HG   GLN  38          2HG       GLN  38 -13.038   6.178  -2.788
  315   2HG   GLN  38          1HG       GLN  38 -12.670   5.335  -4.291
  316   1HE2  GLN  38          1HE2      GLN  38 -14.361   5.058  -1.550
  317   2HE2  GLN  38          2HE2      GLN  38 -14.368   3.341  -1.356
  318    HA   PRO  39           HA       PRO  39  -9.064   7.338  -3.380
  319   1HB   PRO  39          2HB       PRO  39  -7.702   9.578  -3.896
  320   2HB   PRO  39          1HB       PRO  39  -9.216   9.211  -4.733
  321   1HG   PRO  39          2HG       PRO  39  -8.713  11.077  -2.452
  322   2HG   PRO  39          1HG       PRO  39  -9.762  11.290  -3.865
  323   1HD   PRO  39          2HD       PRO  39 -10.623  10.506  -1.350
  324   2HD   PRO  39          1HD       PRO  39 -11.509  10.225  -2.861
  325    H    LEU  40           H        LEU  40  -7.050   6.643  -2.797
  326    HA   LEU  40           HA       LEU  40  -5.706   7.928  -0.533
  327   1HB   LEU  40          2HB       LEU  40  -6.616   5.083  -0.697
  328   2HB   LEU  40          1HB       LEU  40  -5.154   5.471   0.190
  329    HG   LEU  40           HG       LEU  40  -7.907   6.576   0.763
  330   1HD1  LEU  40          1HD1      LEU  40  -7.151   5.255   2.985
  331   2HD1  LEU  40          2HD1      LEU  40  -6.388   4.256   1.749
  332   3HD1  LEU  40          3HD1      LEU  40  -8.127   4.544   1.703
  333   1HD2  LEU  40          1HD2      LEU  40  -6.726   8.260   1.665
  334   2HD2  LEU  40          2HD2      LEU  40  -5.218   7.346   1.648
  335   3HD2  LEU  40          3HD2      LEU  40  -6.383   7.101   2.948
  336    H    ASP  41           H        ASP  41  -3.509   7.932  -0.636
  337    HA   ASP  41           HA       ASP  41  -2.309   6.765  -3.055
  338   1HB   ASP  41          2HB       ASP  41  -2.168   9.258  -2.682
  339   2HB   ASP  41          1HB       ASP  41  -1.151   8.926  -1.285
  340    H    LEU  42           H        LEU  42  -1.119   4.986  -2.808
  341    HA   LEU  42           HA       LEU  42  -0.209   4.191  -0.170
  342   1HB   LEU  42          2HB       LEU  42   0.507   2.103  -1.299
  343   2HB   LEU  42          1HB       LEU  42  -1.195   2.465  -1.499
  344    HG   LEU  42           HG       LEU  42   0.102   3.598  -3.730
  345   1HD1  LEU  42          1HD1      LEU  42   1.428   1.913  -4.668
  346   2HD1  LEU  42          2HD1      LEU  42   0.923   0.723  -3.469
  347   3HD1  LEU  42          3HD1      LEU  42   1.990   2.047  -3.002
  348   1HD2  LEU  42          1HD2      LEU  42  -1.972   2.826  -4.211
  349   2HD2  LEU  42          2HD2      LEU  42  -1.819   1.426  -3.150
  350   3HD2  LEU  42          3HD2      LEU  42  -1.060   1.414  -4.740
  351    H    HIS  43           H        HIS  43   1.662   4.909   0.595
  352    HA   HIS  43           HA       HIS  43   3.881   5.347  -1.298
  353   1HB   HIS  43          2HB       HIS  43   2.741   7.144   0.491
  354   2HB   HIS  43          1HB       HIS  43   4.208   6.612   1.306
  355    HD1  HIS  43           HD1      HIS  43   3.166   9.241  -0.726
  356    HD2  HIS  43           HD2      HIS  43   6.453   6.699  -0.852
  357    HE1  HIS  43           HE1      HIS  43   4.894  10.444  -2.101
  358    HE2  HIS  43           HE2      HIS  43   6.876   8.889  -2.161
  359    H    TYR  44           H        TYR  44   5.480   3.922  -1.167
  360    HA   TYR  44           HA       TYR  44   5.822   2.386   1.309
  361   1HB   TYR  44          2HB       TYR  44   5.506   0.954  -0.567
  362   2HB   TYR  44          1HB       TYR  44   6.638   1.875  -1.551
  363    HD1  TYR  44           HD2      TYR  44   9.077   1.729  -1.074
  364    HD2  TYR  44           HD1      TYR  44   6.256  -0.805   0.847
  365    HE1  TYR  44           HE2      TYR  44  10.895   0.202  -0.437
  366    HE2  TYR  44           HE1      TYR  44   8.064  -2.341   1.492
  367    HH   TYR  44           HH       TYR  44  11.166  -1.596   1.583
  368    H    MET  45           H        MET  45   7.579   2.643   2.561
  369    HA   MET  45           HA       MET  45   9.788   4.280   1.496
  370   1HB   MET  45          2HB       MET  45  10.222   4.963   3.842
  371   2HB   MET  45          1HB       MET  45   8.642   5.467   3.259
  372   1HG   MET  45          2HG       MET  45   8.700   2.876   4.645
  373   2HG   MET  45          1HG       MET  45   9.090   4.278   5.639
  374   1HE   MET  45          1HE       MET  45   7.330   3.132   6.873
  375   2HE   MET  45          2HE       MET  45   5.740   2.712   6.234
  376   3HE   MET  45          3HE       MET  45   5.971   4.235   7.094
  377    H    ASN  46           H        ASN  46  11.809   3.477   1.549
  378    HA   ASN  46           HA       ASN  46  12.149   0.718   2.356
  379   1HB   ASN  46          2HB       ASN  46  13.250   2.270   0.350
  380   2HB   ASN  46          1HB       ASN  46  14.570   2.131   1.508
  381   1HD2  ASN  46          1HD2      ASN  46  15.796   0.381   1.374
  382   2HD2  ASN  46          2HD2      ASN  46  15.374  -1.089   0.572
  383    H    ASN  47           H        ASN  47  13.924   3.741   3.051
  384    HA   ASN  47           HA       ASN  47  14.156   2.992   5.847
  385   1HB   ASN  47          2HB       ASN  47  16.536   3.216   4.012
  386   2HB   ASN  47          1HB       ASN  47  16.679   3.511   5.741
  387   1HD2  ASN  47          1HD2      ASN  47  16.390   1.161   3.269
  388   2HD2  ASN  47          2HD2      ASN  47  16.459  -0.238   4.279
  389    H    GLU  48           H        GLU  48  15.713   5.280   3.580
  390    HA   GLU  48           HA       GLU  48  14.653   7.489   5.220
  391   1HB   GLU  48          2HB       GLU  48  17.304   7.471   3.767
  392   2HB   GLU  48          1HB       GLU  48  16.682   8.750   4.801
  393   1HG   GLU  48          2HG       GLU  48  17.787   7.812   6.472
  394   2HG   GLU  48          1HG       GLU  48  16.630   6.485   6.404
  395    H    LEU  49           H        LEU  49  14.032   6.062   2.440
  396    HA   LEU  49           HA       LEU  49  13.606   8.592   0.994
  397   1HB   LEU  49          2HB       LEU  49  14.800   6.042   0.075
  398   2HB   LEU  49          1HB       LEU  49  13.669   6.800  -1.027
  399    HG   LEU  49           HG       LEU  49  15.978   7.412  -1.544
  400   1HD1  LEU  49          1HD1      LEU  49  14.502   9.793  -0.441
  401   2HD1  LEU  49          2HD1      LEU  49  14.094   8.990  -1.957
  402   3HD1  LEU  49          3HD1      LEU  49  15.666   9.764  -1.764
  403   1HD2  LEU  49          1HD2      LEU  49  17.476   8.242  -0.072
  404   2HD2  LEU  49          2HD2      LEU  49  16.472   7.376   1.088
  405   3HD2  LEU  49          3HD2      LEU  49  16.255   9.111   0.857
  406    H    SER  50           H        SER  50  11.811   8.443  -0.637
  407    HA   SER  50           HA       SER  50   9.678   6.636   0.309
  408   1HB   SER  50          2HB       SER  50   8.959   9.254  -0.937
  409   2HB   SER  50          1HB       SER  50   8.120   8.333   0.310
  410    HG   SER  50           HG       SER  50  10.250  10.135   0.546
  411    H    ILE  51           H        ILE  51   9.085   5.219  -1.185
  412    HA   ILE  51           HA       ILE  51   9.260   5.987  -4.030
  413    HB   ILE  51           HB       ILE  51   9.530   3.176  -2.962
  414   1HG1  ILE  51          2HG1      ILE  51  11.794   4.868  -4.017
  415   2HG1  ILE  51          1HG1      ILE  51  11.406   4.801  -2.302
  416   1HG2  ILE  51          1HG2      ILE  51  10.302   4.241  -5.668
  417   2HG2  ILE  51          2HG2      ILE  51   8.716   3.553  -5.321
  418   3HG2  ILE  51          3HG2      ILE  51  10.161   2.559  -5.156
  419   1HD1  ILE  51          1HD1      ILE  51  11.969   2.332  -3.906
  420   2HD1  ILE  51          2HD1      ILE  51  11.979   2.534  -2.154
  421   3HD1  ILE  51          3HD1      ILE  51  13.245   3.275  -3.137
  422    H    LEU  52           H        LEU  52   7.462   5.757  -5.244
  423    HA   LEU  52           HA       LEU  52   5.080   4.632  -3.936
  424   1HB   LEU  52          2HB       LEU  52   5.496   7.033  -5.300
  425   2HB   LEU  52          1HB       LEU  52   4.585   6.041  -6.423
  426    HG   LEU  52           HG       LEU  52   3.620   6.273  -3.605
  427   1HD1  LEU  52          1HD1      LEU  52   3.703   8.452  -5.609
  428   2HD1  LEU  52          2HD1      LEU  52   3.706   8.526  -3.848
  429   3HD1  LEU  52          3HD1      LEU  52   2.200   8.231  -4.715
  430   1HD2  LEU  52          1HD2      LEU  52   1.504   5.845  -4.557
  431   2HD2  LEU  52          2HD2      LEU  52   2.624   4.740  -5.354
  432   3HD2  LEU  52          3HD2      LEU  52   2.080   6.197  -6.187
  433    H    LEU  53           H        LEU  53   4.327   2.727  -4.596
  434    HA   LEU  53           HA       LEU  53   5.438   1.452  -6.943
  435   1HB   LEU  53          2HB       LEU  53   3.235   0.332  -5.229
  436   2HB   LEU  53          1HB       LEU  53   4.403  -0.538  -6.203
  437    HG   LEU  53           HG       LEU  53   5.710   1.031  -4.138
  438   1HD1  LEU  53          1HD1      LEU  53   3.348   0.318  -3.191
  439   2HD1  LEU  53          2HD1      LEU  53   4.810   0.213  -2.211
  440   3HD1  LEU  53          3HD1      LEU  53   4.165  -1.231  -2.990
  441   1HD2  LEU  53          1HD2      LEU  53   6.687  -0.823  -5.475
  442   2HD2  LEU  53          2HD2      LEU  53   5.631  -1.943  -4.615
  443   3HD2  LEU  53          3HD2      LEU  53   6.856  -1.035  -3.733
  444    H    LYS  54           H        LYS  54   4.628   2.577  -8.711
  445    HA   LYS  54           HA       LYS  54   1.742   2.839  -9.026
  446   1HB   LYS  54          2HB       LYS  54   3.755   4.482  -9.754
  447   2HB   LYS  54          1HB       LYS  54   3.550   3.583 -11.250
  448   1HG   LYS  54          2HG       LYS  54   1.105   4.657  -9.966
  449   2HG   LYS  54          1HG       LYS  54   2.209   5.811 -10.716
  450   1HD   LYS  54          2HD       LYS  54   1.504   3.386 -12.277
  451   2HD   LYS  54          1HD       LYS  54   0.249   4.609 -12.070
  452   1HE   LYS  54          2HE       LYS  54   1.306   5.240 -14.049
  453   2HE   LYS  54          1HE       LYS  54   2.039   6.287 -12.833
  454   1HZ   LYS  54          1HZ       LYS  54   3.565   5.126 -14.499
  455   2HZ   LYS  54          2HZ       LYS  54   3.298   3.720 -13.592
  456   3HZ   LYS  54          3HZ       LYS  54   4.007   5.074 -12.866
  457    H    ASN  55           H        ASN  55   4.411   0.947 -10.297
  458    HA   ASN  55           HA       ASN  55   2.518  -0.519 -12.018
  459   1HB   ASN  55          2HB       ASN  55   5.498  -0.086 -12.344
  460   2HB   ASN  55          1HB       ASN  55   4.556  -1.201 -13.328
  461   1HD2  ASN  55          1HD2      ASN  55   4.544  -0.284 -15.285
  462   2HD2  ASN  55          2HD2      ASN  55   4.022   1.327 -15.625
  463    H    GLN  56           H        GLN  56   3.017  -2.853 -12.300
  464    HA   GLN  56           HA       GLN  56   3.213  -4.169  -9.817
  465   1HB   GLN  56          2HB       GLN  56   2.022  -5.113 -11.754
  466   2HB   GLN  56          1HB       GLN  56   3.552  -5.323 -12.592
  467   1HG   GLN  56          2HG       GLN  56   4.016  -7.220 -11.520
  468   2HG   GLN  56          1HG       GLN  56   3.507  -6.576  -9.961
  469   1HE2  GLN  56          1HE2      GLN  56   2.704  -8.819  -9.754
  470   2HE2  GLN  56          2HE2      GLN  56   1.117  -9.167 -10.341
  471    H    ASP  57           H        ASP  57   5.623  -3.374 -12.241
  472    HA   ASP  57           HA       ASP  57   7.680  -5.104 -11.575
  473   1HB   ASP  57          2HB       ASP  57   7.515  -3.208 -13.399
  474   2HB   ASP  57          1HB       ASP  57   8.308  -2.233 -12.165
  475    H    ASP  58           H        ASP  58   6.873  -1.962 -10.128
  476    HA   ASP  58           HA       ASP  58   9.008  -1.886  -8.289
  477   1HB   ASP  58          2HB       ASP  58   7.067  -0.124  -9.050
  478   2HB   ASP  58          1HB       ASP  58   6.502  -0.577  -7.446
  479    H    LEU  59           H        LEU  59   5.757  -3.246  -8.089
  480    HA   LEU  59           HA       LEU  59   5.692  -3.778  -5.329
  481   1HB   LEU  59          2HB       LEU  59   3.671  -3.901  -6.565
  482   2HB   LEU  59          1HB       LEU  59   4.343  -5.047  -7.701
  483    HG   LEU  59           HG       LEU  59   2.650  -5.953  -6.076
  484   1HD1  LEU  59          1HD1      LEU  59   3.545  -8.015  -6.217
  485   2HD1  LEU  59          2HD1      LEU  59   5.113  -7.504  -5.597
  486   3HD1  LEU  59          3HD1      LEU  59   4.683  -7.184  -7.277
  487   1HD2  LEU  59          1HD2      LEU  59   4.888  -5.420  -4.140
  488   2HD2  LEU  59          2HD2      LEU  59   3.600  -6.583  -3.828
  489   3HD2  LEU  59          3HD2      LEU  59   3.211  -4.877  -4.050
  490    H    ASP  60           H        ASP  60   6.743  -5.786  -8.064
  491    HA   ASP  60           HA       ASP  60   7.493  -8.026  -6.484
  492   1HB   ASP  60          2HB       ASP  60   6.994  -8.110  -8.939
  493   2HB   ASP  60          1HB       ASP  60   8.529  -7.300  -9.232
  494    H    LYS  61           H        LYS  61   9.168  -5.119  -7.510
  495    HA   LYS  61           HA       LYS  61  11.813  -5.924  -6.972
  496   1HB   LYS  61          2HB       LYS  61  11.033  -3.849  -8.214
  497   2HB   LYS  61          1HB       LYS  61  10.716  -3.128  -6.645
  498   1HG   LYS  61          2HG       LYS  61  13.137  -3.560  -6.089
  499   2HG   LYS  61          1HG       LYS  61  13.361  -3.967  -7.792
  500   1HD   LYS  61          2HD       LYS  61  13.328  -1.818  -8.417
  501   2HD   LYS  61          1HD       LYS  61  11.927  -1.459  -7.406
  502   1HE   LYS  61          2HE       LYS  61  14.726  -1.749  -6.325
  503   2HE   LYS  61          1HE       LYS  61  14.038  -0.208  -6.834
  504   1HZ   LYS  61          1HZ       LYS  61  13.833  -0.589  -4.435
  505   2HZ   LYS  61          2HZ       LYS  61  12.890  -1.962  -4.728
  506   3HZ   LYS  61          3HZ       LYS  61  12.321  -0.434  -5.178
  507    H    ALA  62           H        ALA  62   9.287  -4.551  -4.913
  508    HA   ALA  62           HA       ALA  62  10.889  -4.105  -2.621
  509   1HB   ALA  62          1HB       ALA  62   8.638  -4.206  -1.420
  510   2HB   ALA  62          2HB       ALA  62   7.931  -4.447  -3.019
  511   3HB   ALA  62          3HB       ALA  62   8.835  -2.974  -2.666
  512    H    ILE  63           H        ILE  63   9.104  -6.914  -3.796
  513    HA   ILE  63           HA       ILE  63   9.188  -8.490  -1.481
  514    HB   ILE  63           HB       ILE  63   9.362  -9.514  -4.322
  515   1HG1  ILE  63          2HG1      ILE  63   7.464  -8.026  -4.179
  516   2HG1  ILE  63          1HG1      ILE  63   6.874  -9.685  -4.176
  517   1HG2  ILE  63          1HG2      ILE  63   9.835 -11.180  -2.585
  518   2HG2  ILE  63          2HG2      ILE  63   8.330 -11.527  -3.436
  519   3HG2  ILE  63          3HG2      ILE  63   8.287 -10.813  -1.824
  520   1HD1  ILE  63          1HD1      ILE  63   5.592  -8.637  -2.555
  521   2HD1  ILE  63          2HD1      ILE  63   6.956  -7.710  -1.932
  522   3HD1  ILE  63          3HD1      ILE  63   6.850  -9.441  -1.615
  523    H    ASP  64           H        ASP  64  11.479  -8.285  -4.202
  524    HA   ASP  64           HA       ASP  64  13.296 -10.219  -3.372
  525   1HB   ASP  64          2HB       ASP  64  13.625  -7.696  -4.984
  526   2HB   ASP  64          1HB       ASP  64  14.997  -8.742  -4.636
  527    H    ILE  65           H        ILE  65  13.109  -6.781  -2.506
  528    HA   ILE  65           HA       ILE  65  15.487  -6.747  -0.955
  529    HB   ILE  65           HB       ILE  65  13.105  -4.918  -0.627
  530   1HG1  ILE  65          2HG1      ILE  65  15.488  -4.161  -2.263
  531   2HG1  ILE  65          1HG1      ILE  65  14.284  -5.216  -2.996
  532   1HG2  ILE  65          1HG2      ILE  65  15.938  -4.869   0.300
  533   2HG2  ILE  65          2HG2      ILE  65  14.460  -4.450   1.167
  534   3HG2  ILE  65          3HG2      ILE  65  15.117  -3.346  -0.041
  535   1HD1  ILE  65          1HD1      ILE  65  13.094  -2.925  -1.675
  536   2HD1  ILE  65          2HD1      ILE  65  12.871  -3.535  -3.315
  537   3HD1  ILE  65          3HD1      ILE  65  14.229  -2.473  -2.944
  538    H    LEU  66           H        LEU  66  12.067  -7.226  -0.132
  539    HA   LEU  66           HA       LEU  66  12.335  -7.296   2.651
  540   1HB   LEU  66          2HB       LEU  66  10.205  -7.269   1.213
  541   2HB   LEU  66          1HB       LEU  66  10.386  -9.012   1.134
  542    HG   LEU  66           HG       LEU  66  10.346  -9.021   3.668
  543   1HD1  LEU  66          1HD1      LEU  66   9.064  -6.329   3.482
  544   2HD1  LEU  66          2HD1      LEU  66  10.811  -6.464   3.669
  545   3HD1  LEU  66          3HD1      LEU  66   9.739  -7.158   4.884
  546   1HD2  LEU  66          1HD2      LEU  66   8.377  -9.820   2.873
  547   2HD2  LEU  66          2HD2      LEU  66   8.084  -8.411   1.855
  548   3HD2  LEU  66          3HD2      LEU  66   7.772  -8.327   3.589
  549    H    ASP  67           H        ASP  67  12.550  -9.928   0.264
  550    HA   ASP  67           HA       ASP  67  12.966 -12.006   2.143
  551   1HB   ASP  67          2HB       ASP  67  13.428 -11.724  -0.809
  552   2HB   ASP  67          1HB       ASP  67  14.046 -13.136   0.042
  553    H    ARG  68           H        ARG  68  15.144  -9.743   0.565
  554    HA   ARG  68           HA       ARG  68  17.577 -11.055   1.144
  555   1HB   ARG  68          2HB       ARG  68  16.743  -8.478   0.103
  556   2HB   ARG  68          1HB       ARG  68  18.127  -8.316   1.175
  557   1HG   ARG  68          2HG       ARG  68  18.053 -10.290  -1.088
  558   2HG   ARG  68          1HG       ARG  68  18.623  -8.632  -1.277
  559   1HD   ARG  68          2HD       ARG  68  20.432  -8.968   0.183
  560   2HD   ARG  68          1HD       ARG  68  19.733 -10.448   0.840
  561    HE   ARG  68           HE       ARG  68  20.293 -10.645  -1.959
  562   1HH1  ARG  68          1HH1      ARG  68  21.747 -10.876   1.223
  563   2HH1  ARG  68          2HH1      ARG  68  23.013 -11.934   0.699
  564   1HH2  ARG  68          1HH2      ARG  68  21.965 -12.038  -2.636
  565   2HH2  ARG  68          2HH2      ARG  68  23.137 -12.593  -1.489
  566    H    SER  69           H        SER  69  15.543  -8.895   3.035
  567    HA   SER  69           HA       SER  69  17.511  -8.932   5.216
  568   1HB   SER  69          2HB       SER  69  16.705  -6.709   4.554
  569   2HB   SER  69          1HB       SER  69  15.043  -7.212   4.864
  570    HG   SER  69           HG       SER  69  16.916  -6.319   6.602
  571    H    SER  70           H        SER  70  17.257 -10.570   6.596
  572    HA   SER  70           HA       SER  70  14.901 -12.084   6.910
  573   1HB   SER  70          2HB       SER  70  16.047 -13.016   8.937
  574   2HB   SER  70          1HB       SER  70  17.039 -13.056   7.481
  575    HG   SER  70           HG       SER  70  18.384 -11.681   8.359
  576    H    SER  71           H        SER  71  16.228  -9.368   8.757
  577    HA   SER  71           HA       SER  71  14.428  -9.427  10.910
  578   1HB   SER  71          2HB       SER  71  15.219  -7.265  11.469
  579   2HB   SER  71          1HB       SER  71  16.584  -8.065  10.694
  580    HG   SER  71           HG       SER  71  15.996  -6.956   8.751
  581    H    MET  72           H        MET  72  14.140  -8.025   7.691
  582    HA   MET  72           HA       MET  72  11.600  -6.772   8.363
  583   1HB   MET  72          2HB       MET  72  13.540  -5.932   6.730
  584   2HB   MET  72          1HB       MET  72  12.600  -6.850   5.561
  585   1HG   MET  72          2HG       MET  72  10.794  -5.446   5.700
  586   2HG   MET  72          1HG       MET  72  11.204  -4.900   7.324
  587   1HE   MET  72          1HE       MET  72  12.586  -5.093   3.743
  588   2HE   MET  72          2HE       MET  72  13.015  -3.423   3.374
  589   3HE   MET  72          3HE       MET  72  11.321  -3.881   3.544
  590    H    LYS  73           H        LYS  73  10.199  -8.477   8.725
  591    HA   LYS  73           HA       LYS  73   9.811 -10.425   6.571
  592   1HB   LYS  73          2HB       LYS  73   8.367 -11.619   8.196
  593   2HB   LYS  73          1HB       LYS  73  10.015 -11.405   8.763
  594   1HG   LYS  73          2HG       LYS  73   9.404  -9.896  10.393
  595   2HG   LYS  73          1HG       LYS  73   7.923  -9.429   9.555
  596   1HD   LYS  73          2HD       LYS  73   8.231 -12.230  10.538
  597   2HD   LYS  73          1HD       LYS  73   7.819 -10.951  11.682
  598   1HE   LYS  73          2HE       LYS  73   6.255 -10.984   9.183
  599   2HE   LYS  73          1HE       LYS  73   6.002 -12.359  10.257
  600   1HZ   LYS  73          1HZ       LYS  73   5.200 -11.004  11.936
  601   2HZ   LYS  73          2HZ       LYS  73   4.556 -10.276  10.552
  602   3HZ   LYS  73          3HZ       LYS  73   5.911  -9.602  11.308
  603    H    SER  74           H        SER  74   8.153  -7.823   8.269
  604    HA   SER  74           HA       SER  74   5.713  -8.254   6.733
  605   1HB   SER  74          2HB       SER  74   6.431  -6.355   8.971
  606   2HB   SER  74          1HB       SER  74   4.903  -6.257   8.096
  607    HG   SER  74           HG       SER  74   4.590  -7.527   9.899
  608    H    LEU  75           H        LEU  75   4.675  -6.263   5.738
  609    HA   LEU  75           HA       LEU  75   6.702  -4.885   4.134
  610   1HB   LEU  75          2HB       LEU  75   4.015  -5.874   3.646
  611   2HB   LEU  75          1HB       LEU  75   4.188  -4.204   3.140
  612    HG   LEU  75           HG       LEU  75   6.093  -6.369   2.263
  613   1HD1  LEU  75          1HD1      LEU  75   3.597  -5.384   0.887
  614   2HD1  LEU  75          2HD1      LEU  75   3.882  -7.005   1.519
  615   3HD1  LEU  75          3HD1      LEU  75   4.826  -6.412   0.152
  616   1HD2  LEU  75          1HD2      LEU  75   6.867  -4.031   2.102
  617   2HD2  LEU  75          2HD2      LEU  75   5.462  -3.655   1.103
  618   3HD2  LEU  75          3HD2      LEU  75   6.677  -4.793   0.522
  619    H    ARG  76           H        ARG  76   7.247  -2.863   4.593
  620    HA   ARG  76           HA       ARG  76   5.601  -1.303   6.419
  621   1HB   ARG  76          2HB       ARG  76   8.265  -0.524   5.225
  622   2HB   ARG  76          1HB       ARG  76   7.491   0.155   6.650
  623   1HG   ARG  76          2HG       ARG  76   7.737  -2.580   7.176
  624   2HG   ARG  76          1HG       ARG  76   9.258  -2.104   6.420
  625   1HD   ARG  76          2HD       ARG  76   9.363  -1.873   8.847
  626   2HD   ARG  76          1HD       ARG  76   9.518  -0.309   8.050
  627    HE   ARG  76           HE       ARG  76   6.877  -0.444   8.590
  628   1HH1  ARG  76          1HH1      ARG  76   9.714  -0.944  10.581
  629   2HH1  ARG  76          2HH1      ARG  76   8.948  -0.383  12.028
  630   1HH2  ARG  76          1HH2      ARG  76   5.877   0.305  10.503
  631   2HH2  ARG  76          2HH2      ARG  76   6.774   0.325  11.983
  632    H    ILE  77           H        ILE  77   3.842  -0.849   5.012
  633    HA   ILE  77           HA       ILE  77   4.451   1.118   2.896
  634    HB   ILE  77           HB       ILE  77   1.993  -0.631   3.028
  635   1HG1  ILE  77          2HG1      ILE  77   4.236  -1.033   1.069
  636   2HG1  ILE  77          1HG1      ILE  77   4.293  -1.798   2.653
  637   1HG2  ILE  77          1HG2      ILE  77   2.201   0.078   0.460
  638   2HG2  ILE  77          2HG2      ILE  77   2.973   1.480   1.201
  639   3HG2  ILE  77          3HG2      ILE  77   1.326   1.039   1.653
  640   1HD1  ILE  77          1HD1      ILE  77   3.378  -3.419   1.270
  641   2HD1  ILE  77          2HD1      ILE  77   2.363  -2.255   0.417
  642   3HD1  ILE  77          3HD1      ILE  77   1.975  -2.715   2.075
  643    H    LEU  78           H        LEU  78   3.745   3.121   3.246
  644    HA   LEU  78           HA       LEU  78   1.625   3.551   5.251
  645   1HB   LEU  78          2HB       LEU  78   4.038   4.473   5.546
  646   2HB   LEU  78          1HB       LEU  78   3.563   5.657   4.345
  647    HG   LEU  78           HG       LEU  78   1.499   5.881   6.094
  648   1HD1  LEU  78          1HD1      LEU  78   2.898   4.216   7.538
  649   2HD1  LEU  78          2HD1      LEU  78   2.113   5.603   8.293
  650   3HD1  LEU  78          3HD1      LEU  78   3.839   5.654   7.932
  651   1HD2  LEU  78          1HD2      LEU  78   3.379   7.510   5.104
  652   2HD2  LEU  78          2HD2      LEU  78   3.916   7.441   6.782
  653   3HD2  LEU  78          3HD2      LEU  78   2.281   7.983   6.400
  654    H    LEU  79           H        LEU  79  -0.295   4.113   4.407
  655    HA   LEU  79           HA       LEU  79  -0.328   5.439   1.786
  656   1HB   LEU  79          2HB       LEU  79  -2.674   4.732   1.626
  657   2HB   LEU  79          1HB       LEU  79  -1.578   3.380   1.828
  658    HG   LEU  79           HG       LEU  79  -2.282   3.803   4.408
  659   1HD1  LEU  79          1HD1      LEU  79  -4.847   4.271   2.927
  660   2HD1  LEU  79          2HD1      LEU  79  -3.868   5.609   3.532
  661   3HD1  LEU  79          3HD1      LEU  79  -4.519   4.415   4.653
  662   1HD2  LEU  79          1HD2      LEU  79  -3.219   1.752   4.249
  663   2HD2  LEU  79          2HD2      LEU  79  -2.502   1.794   2.638
  664   3HD2  LEU  79          3HD2      LEU  79  -4.206   2.189   2.855
  665    H    LEU  80           H        LEU  80  -1.197   7.416   1.477
  666    HA   LEU  80           HA       LEU  80  -2.305   8.792   3.843
  667   1HB   LEU  80          2HB       LEU  80  -0.789  10.104   1.593
  668   2HB   LEU  80          1HB       LEU  80  -1.273  10.824   3.114
  669    HG   LEU  80           HG       LEU  80   0.286   8.827   4.041
  670   1HD1  LEU  80          1HD1      LEU  80   0.743   8.498   1.416
  671   2HD1  LEU  80          2HD1      LEU  80   1.938   8.148   2.663
  672   3HD1  LEU  80          3HD1      LEU  80   1.994   9.682   1.793
  673   1HD2  LEU  80          1HD2      LEU  80   1.651  10.493   4.741
  674   2HD2  LEU  80          2HD2      LEU  80   0.331  11.496   4.142
  675   3HD2  LEU  80          3HD2      LEU  80   1.758  11.228   3.142
  676    H    SER  81           H        SER  81  -3.835  10.528   3.397
  677    HA   SER  81           HA       SER  81  -5.614   9.808   1.213
  678   1HB   SER  81          2HB       SER  81  -6.304  12.066   3.015
  679   2HB   SER  81          1HB       SER  81  -7.308  10.741   2.428
  680    HG   SER  81           HG       SER  81  -6.428   9.406   3.973
  681    H    GLN  82           H        GLN  82  -6.077  11.043  -0.537
  682    HA   GLN  82           HA       GLN  82  -4.328  13.298  -1.042
  683   1HB   GLN  82          2HB       GLN  82  -4.867  11.386  -2.697
  684   2HB   GLN  82          1HB       GLN  82  -6.375  12.245  -2.968
  685   1HG   GLN  82          2HG       GLN  82  -4.729  12.787  -4.668
  686   2HG   GLN  82          1HG       GLN  82  -5.146  14.207  -3.711
  687   1HE2  GLN  82          1HE2      GLN  82  -3.390  15.434  -3.626
  688   2HE2  GLN  82          2HE2      GLN  82  -1.800  14.892  -3.223
  689    H    ASP  83           H        ASP  83  -7.077  13.095   0.536
  690    HA   ASP  83           HA       ASP  83  -7.891  15.803  -0.199
  691   1HB   ASP  83          2HB       ASP  83  -9.494  13.381  -0.548
  692   2HB   ASP  83          1HB       ASP  83 -10.308  14.589   0.438
  693    H    ARG  84           H        ARG  84  -6.389  14.522   2.045
  694    HA   ARG  84           HA       ARG  84  -7.583  15.972   4.183
  695   1HB   ARG  84          2HB       ARG  84  -8.253  13.161   3.894
  696   2HB   ARG  84          1HB       ARG  84  -7.449  13.474   5.425
  697   1HG   ARG  84          2HG       ARG  84  -9.148  14.793   6.208
  698   2HG   ARG  84          1HG       ARG  84  -9.671  15.265   4.591
  699   1HD   ARG  84          2HD       ARG  84  -9.930  12.435   5.537
  700   2HD   ARG  84          1HD       ARG  84 -11.149  13.644   5.946
  701    HE   ARG  84           HE       ARG  84 -10.906  13.891   3.259
  702   1HH1  ARG  84          1HH1      ARG  84 -11.487  11.147   5.355
  703   2HH1  ARG  84          2HH1      ARG  84 -12.411  10.284   4.174
  704   1HH2  ARG  84          1HH2      ARG  84 -12.130  12.744   1.707
  705   2HH2  ARG  84          2HH2      ARG  84 -12.776  11.188   2.106
  706    H    ASN  85           H        ASN  85  -5.447  16.880   4.029
  707    HA   ASN  85           HA       ASN  85  -3.495  15.358   5.587
  708   1HB   ASN  85          2HB       ASN  85  -3.196  15.560   2.869
  709   2HB   ASN  85          1HB       ASN  85  -2.265  16.943   3.436
  710   1HD2  ASN  85          1HD2      ASN  85  -2.779  13.588   4.510
  711   2HD2  ASN  85          2HD2      ASN  85  -1.100  13.220   4.699
  712    H    LEU  86           H        LEU  86  -2.458  16.524   7.079
  713    HA   LEU  86           HA       LEU  86  -1.831  19.264   6.918
  714   1HB   LEU  86          2HB       LEU  86  -4.515  18.660   7.806
  715   2HB   LEU  86          1HB       LEU  86  -3.610  19.454   9.081
  716    HG   LEU  86           HG       LEU  86  -4.021  20.533   6.291
  717   1HD1  LEU  86          1HD1      LEU  86  -5.738  21.782   7.058
  718   2HD1  LEU  86          2HD1      LEU  86  -5.056  21.923   8.679
  719   3HD1  LEU  86          3HD1      LEU  86  -5.892  20.447   8.200
  720   1HD2  LEU  86          1HD2      LEU  86  -2.033  21.511   6.868
  721   2HD2  LEU  86          2HD2      LEU  86  -2.361  21.419   8.599
  722   3HD2  LEU  86          3HD2      LEU  86  -3.159  22.645   7.614
  723    H    GLU  87           H        GLU  87  -2.583  16.533   9.043
  724    HA   GLU  87           HA       GLU  87  -1.283  17.300  11.368
  725   1HB   GLU  87          2HB       GLU  87  -1.456  14.511  10.208
  726   2HB   GLU  87          1HB       GLU  87  -1.112  14.907  11.886
  727   1HG   GLU  87          2HG       GLU  87  -3.452  16.215  11.534
  728   2HG   GLU  87          1HG       GLU  87  -3.666  14.854  10.434
  729    H    HIS  88           H        HIS  88   0.759  16.582  12.278
  730    HA   HIS  88           HA       HIS  88   2.949  17.031  10.469
  731   1HB   HIS  88          2HB       HIS  88   2.515  17.399  13.207
  732   2HB   HIS  88          1HB       HIS  88   3.740  16.139  13.118
  733    HD1  HIS  88           HD1      HIS  88   3.195  19.762  12.561
  734    HD2  HIS  88           HD2      HIS  88   6.202  16.958  11.958
  735    HE1  HIS  88           HE1      HIS  88   5.278  21.096  12.110
  736    HE2  HIS  88           HE2      HIS  88   7.089  19.378  11.762
  737    H    HIS  89           H        HIS  89   4.980  15.592  10.801
  738    HA   HIS  89           HA       HIS  89   4.156  12.791  10.428
  739   1HB   HIS  89          2HB       HIS  89   5.283  14.079   8.524
  740   2HB   HIS  89          1HB       HIS  89   6.754  14.001   9.488
  741    HD1  HIS  89           HD1      HIS  89   4.153  11.381   8.522
  742    HD2  HIS  89           HD2      HIS  89   8.264  11.994   8.515
  743    HE1  HIS  89           HE1      HIS  89   5.145   9.267   7.592
  744    HE2  HIS  89           HE2      HIS  89   7.629   9.687   7.530
  745    H    HIS  90           H        HIS  90   6.890  14.724  11.684
  746    HA   HIS  90           HA       HIS  90   8.302  14.432  13.436
  747   1HB   HIS  90          2HB       HIS  90   6.000  12.706  14.291
  748   2HB   HIS  90          1HB       HIS  90   7.478  12.736  15.244
  749    HD1  HIS  90           HD1      HIS  90   6.857  14.087  17.242
  750    HD2  HIS  90           HD2      HIS  90   5.603  15.859  13.699
  751    HE1  HIS  90           HE1      HIS  90   5.934  16.332  17.902
  752    HE2  HIS  90           HE2      HIS  90   5.095  17.345  15.753
  753    H    HIS  91           H        HIS  91  10.111  13.610  12.528
  754    HA   HIS  91           HA       HIS  91  10.293  10.694  12.177
  755   1HB   HIS  91          2HB       HIS  91  10.897  12.692  10.393
  756   2HB   HIS  91          1HB       HIS  91  12.474  12.338  11.084
  757    HD1  HIS  91           HD1      HIS  91  10.969   9.185  11.236
  758    HD2  HIS  91           HD2      HIS  91  12.346  11.511   8.076
  759    HE1  HIS  91           HE1      HIS  91  11.364   7.583   9.344
  760    HE2  HIS  91           HE2      HIS  91  12.295   8.995   7.478
  761    H    HIS  92           H        HIS  92  12.557   9.803  12.550
  762    HA   HIS  92           HA       HIS  92  14.309   9.322  13.902
  763   1HB   HIS  92          2HB       HIS  92  14.141  12.289  14.299
  764   2HB   HIS  92          1HB       HIS  92  15.212  11.338  15.320
  765    HD1  HIS  92           HD1      HIS  92  17.242  12.580  14.230
  766    HD2  HIS  92           HD2      HIS  92  15.002  10.275  11.594
  767    HE1  HIS  92           HE1      HIS  92  18.658  12.355  12.163
  768    HE2  HIS  92           HE2      HIS  92  17.325  10.871  10.624
  769    H    HIS  93           H        HIS  93  12.729  11.753  15.991
  770    HA   HIS  93           HA       HIS  93  11.733   9.623  17.713
  771   1HB   HIS  93          2HB       HIS  93  14.027  10.176  18.531
  772   2HB   HIS  93          1HB       HIS  93  13.495  11.835  18.790
  773    HD1  HIS  93           HD1      HIS  93  13.267   8.405  20.232
  774    HD2  HIS  93           HD2      HIS  93  11.797  12.215  21.011
  775    HE1  HIS  93           HE1      HIS  93  12.300   8.293  22.551
  776    HE2  HIS  93           HE2      HIS  93  11.315  10.576  22.952
  Start of MODEL   11
    1    H    GLN   1           H        GLN   1   7.531 -22.452   1.441
    2    HA   GLN   1           HA       GLN   1   6.396 -20.445   2.286
    3   1HB   GLN   1          2HB       GLN   1   8.198 -20.719  -0.049
    4   2HB   GLN   1          1HB       GLN   1   7.502 -19.123   0.186
    5   1HG   GLN   1          2HG       GLN   1   9.159 -18.732   1.602
    6   2HG   GLN   1          1HG       GLN   1   8.365 -19.847   2.712
    7   1HE2  GLN   1          1HE2      GLN   1   9.146 -21.943   2.920
    8   2HE2  GLN   1          2HE2      GLN   1  10.705 -22.408   2.340
    9    H    SER   2           H        SER   2   4.689 -19.131   2.128
   10    HA   SER   2           HA       SER   2   3.531 -18.275  -0.311
   11   1HB   SER   2          2HB       SER   2   1.307 -19.379  -0.036
   12   2HB   SER   2          1HB       SER   2   2.602 -20.516  -0.414
   13    HG   SER   2           HG       SER   2   2.665 -21.108   1.758
   14    H    ASP   3           H        ASP   3   1.600 -16.910   0.047
   15    HA   ASP   3           HA       ASP   3   0.413 -15.308   1.130
   16   1HB   ASP   3          2HB       ASP   3   1.127 -16.992   3.527
   17   2HB   ASP   3          1HB       ASP   3   0.201 -15.503   3.673
   18    H    VAL   4           H        VAL   4   0.758 -13.265   2.019
   19    HA   VAL   4           HA       VAL   4   3.399 -12.697   3.159
   20    HB   VAL   4           HB       VAL   4   2.243 -11.018   0.928
   21   1HG1  VAL   4          1HG1      VAL   4   4.806 -10.362   0.955
   22   2HG1  VAL   4          2HG1      VAL   4   4.675 -10.886   2.634
   23   3HG1  VAL   4          3HG1      VAL   4   3.642  -9.589   2.031
   24   1HG2  VAL   4          1HG2      VAL   4   2.843 -13.150  -0.017
   25   2HG2  VAL   4          2HG2      VAL   4   4.400 -13.122   0.808
   26   3HG2  VAL   4          3HG2      VAL   4   4.060 -11.959  -0.475
   27    H    ARG   5           H        ARG   5   3.257 -11.396   4.887
   28    HA   ARG   5           HA       ARG   5   0.695 -10.188   5.535
   29   1HB   ARG   5          2HB       ARG   5   3.135 -10.937   7.017
   30   2HB   ARG   5          1HB       ARG   5   2.323  -9.489   7.597
   31   1HG   ARG   5          2HG       ARG   5   0.682 -10.662   8.530
   32   2HG   ARG   5          1HG       ARG   5   0.467 -11.658   7.090
   33   1HD   ARG   5          2HD       ARG   5   2.908 -12.197   8.642
   34   2HD   ARG   5          1HD       ARG   5   1.395 -12.575   9.464
   35    HE   ARG   5           HE       ARG   5   2.580 -14.024   7.327
   36   1HH1  ARG   5          1HH1      ARG   5  -0.522 -13.065   8.633
   37   2HH1  ARG   5          2HH1      ARG   5  -1.364 -14.425   7.972
   38   1HH2  ARG   5          1HH2      ARG   5   1.468 -15.816   6.451
   39   2HH2  ARG   5          2HH2      ARG   5  -0.232 -15.990   6.731
   40    H    ILE   6           H        ILE   6   0.197  -8.174   5.039
   41    HA   ILE   6           HA       ILE   6   2.360  -6.256   4.486
   42    HB   ILE   6           HB       ILE   6  -0.541  -6.007   3.683
   43   1HG1  ILE   6          2HG1      ILE   6   0.374  -7.979   2.599
   44   2HG1  ILE   6          1HG1      ILE   6   0.210  -6.684   1.417
   45   1HG2  ILE   6          1HG2      ILE   6   1.879  -4.364   3.311
   46   2HG2  ILE   6          2HG2      ILE   6   0.183  -3.892   3.398
   47   3HG2  ILE   6          3HG2      ILE   6   0.840  -4.547   1.899
   48   1HD1  ILE   6          1HD1      ILE   6   2.729  -6.248   2.093
   49   2HD1  ILE   6          2HD1      ILE   6   2.279  -7.442   0.876
   50   3HD1  ILE   6          3HD1      ILE   6   2.646  -7.956   2.523
   51    H    LYS   7           H        LYS   7   2.766  -4.818   6.029
   52    HA   LYS   7           HA       LYS   7   0.643  -4.140   7.940
   53   1HB   LYS   7          2HB       LYS   7   3.643  -3.780   8.110
   54   2HB   LYS   7          1HB       LYS   7   2.506  -3.232   9.335
   55   1HG   LYS   7          2HG       LYS   7   1.757  -5.585   9.611
   56   2HG   LYS   7          1HG       LYS   7   3.035  -6.075   8.498
   57   1HD   LYS   7          2HD       LYS   7   4.731  -5.299   9.989
   58   2HD   LYS   7          1HD       LYS   7   3.537  -4.525  11.034
   59   1HE   LYS   7          2HE       LYS   7   2.833  -6.524  11.936
   60   2HE   LYS   7          1HE       LYS   7   3.331  -7.455  10.525
   61   1HZ   LYS   7          1HZ       LYS   7   5.463  -7.605  11.253
   62   2HZ   LYS   7          2HZ       LYS   7   4.687  -7.526  12.754
   63   3HZ   LYS   7          3HZ       LYS   7   5.416  -6.144  12.107
   64    H    PHE   8           H        PHE   8  -0.473  -2.375   7.427
   65    HA   PHE   8           HA       PHE   8   0.980  -0.097   6.255
   66   1HB   PHE   8          2HB       PHE   8  -1.418   0.549   5.437
   67   2HB   PHE   8          1HB       PHE   8  -0.490  -0.654   4.555
   68    HD1  PHE   8           HD2      PHE   8  -0.980  -3.112   5.017
   69    HD2  PHE   8           HD1      PHE   8  -3.527   0.053   6.284
   70    HE1  PHE   8           HE2      PHE   8  -2.839  -4.705   5.251
   71    HE2  PHE   8           HE1      PHE   8  -5.390  -1.535   6.517
   72    HZ   PHE   8           HZ       PHE   8  -5.049  -3.917   5.998
   73    H    GLU   9           H        GLU   9   0.645   1.943   7.062
   74    HA   GLU   9           HA       GLU   9  -0.991   2.118   9.509
   75   1HB   GLU   9          2HB       GLU   9   1.652   2.173   9.618
   76   2HB   GLU   9          1HB       GLU   9   1.417   3.852   9.155
   77   1HG   GLU   9          2HG       GLU   9   0.171   4.319  11.109
   78   2HG   GLU   9          1HG       GLU   9   0.022   2.608  11.504
   79    H    HIS  10           H        HIS  10  -2.245   3.885   9.800
   80    HA   HIS  10           HA       HIS  10  -2.065   6.103   7.902
   81   1HB   HIS  10          2HB       HIS  10  -3.760   4.313   7.151
   82   2HB   HIS  10          1HB       HIS  10  -4.733   4.843   8.519
   83    HD1  HIS  10           HD1      HIS  10  -6.611   5.959   7.283
   84    HD2  HIS  10           HD2      HIS  10  -2.873   7.314   6.074
   85    HE1  HIS  10           HE1      HIS  10  -7.064   7.906   5.756
   86    HE2  HIS  10           HE2      HIS  10  -4.787   8.721   5.051
   87    H    ASN  11           H        ASN  11  -1.832   7.841   9.135
   88    HA   ASN  11           HA       ASN  11  -2.067   9.381  10.787
   89   1HB   ASN  11          2HB       ASN  11  -4.794   8.092  10.977
   90   2HB   ASN  11          1HB       ASN  11  -4.336   9.534  11.875
   91   1HD2  ASN  11          1HD2      ASN  11  -4.730  11.421  10.952
   92   2HD2  ASN  11          2HD2      ASN  11  -5.026  11.679   9.268
   93    H    GLY  12           H        GLY  12  -0.857   6.799  11.454
   94   1HA   GLY  12          2HA       GLY  12   0.219   6.399  13.562
   95   2HA   GLY  12          1HA       GLY  12  -1.244   6.940  14.369
   96    H    GLU  13           H        GLU  13  -3.163   5.414  13.023
   97    HA   GLU  13           HA       GLU  13  -2.886   2.926  14.386
   98   1HB   GLU  13          2HB       GLU  13  -4.988   4.397  13.110
   99   2HB   GLU  13          1HB       GLU  13  -5.000   2.750  12.494
  100   1HG   GLU  13          2HG       GLU  13  -5.103   3.547  15.397
  101   2HG   GLU  13          1HG       GLU  13  -6.466   3.004  14.421
  102    H    ARG  14           H        ARG  14  -2.336   0.931  13.653
  103    HA   ARG  14           HA       ARG  14  -1.606   0.703  10.804
  104   1HB   ARG  14          2HB       ARG  14   0.197  -0.808  11.444
  105   2HB   ARG  14          1HB       ARG  14   0.374   0.744  12.251
  106   1HG   ARG  14          2HG       ARG  14   0.660  -0.430  14.114
  107   2HG   ARG  14          1HG       ARG  14  -1.079  -0.723  14.064
  108   1HD   ARG  14          2HD       ARG  14  -0.710  -2.789  12.829
  109   2HD   ARG  14          1HD       ARG  14   1.027  -2.485  12.814
  110    HE   ARG  14           HE       ARG  14  -0.521  -3.566  14.967
  111   1HH1  ARG  14          1HH1      ARG  14   2.367  -1.740  14.200
  112   2HH1  ARG  14          2HH1      ARG  14   3.188  -2.190  15.657
  113   1HH2  ARG  14          1HH2      ARG  14   0.563  -4.157  16.886
  114   2HH2  ARG  14          2HH2      ARG  14   2.164  -3.565  17.182
  115    H    ARG  15           H        ARG  15  -1.750  -1.416   9.842
  116    HA   ARG  15           HA       ARG  15  -3.454  -3.350  11.231
  117   1HB   ARG  15          2HB       ARG  15  -4.569  -1.575   9.484
  118   2HB   ARG  15          1HB       ARG  15  -4.181  -2.910   8.409
  119   1HG   ARG  15          2HG       ARG  15  -6.309  -3.452   9.054
  120   2HG   ARG  15          1HG       ARG  15  -5.355  -4.355  10.234
  121   1HD   ARG  15          2HD       ARG  15  -5.582  -2.133  11.624
  122   2HD   ARG  15          1HD       ARG  15  -6.989  -1.886  10.593
  123    HE   ARG  15           HE       ARG  15  -7.334  -4.407  11.507
  124   1HH1  ARG  15          1HH1      ARG  15  -6.726  -1.353  13.116
  125   2HH1  ARG  15          2HH1      ARG  15  -7.577  -1.804  14.553
  126   1HH2  ARG  15          1HH2      ARG  15  -8.455  -4.989  13.406
  127   2HH2  ARG  15          2HH2      ARG  15  -8.557  -3.866  14.719
  128    H    ILE  16           H        ILE  16  -3.176  -5.474  10.594
  129    HA   ILE  16           HA       ILE  16  -1.029  -5.966   8.627
  130    HB   ILE  16           HB       ILE  16  -1.720  -7.746  10.968
  131   1HG1  ILE  16          2HG1      ILE  16   0.854  -6.439  11.169
  132   2HG1  ILE  16          1HG1      ILE  16  -0.436  -5.246  11.080
  133   1HG2  ILE  16          1HG2      ILE  16  -0.646  -8.920   9.160
  134   2HG2  ILE  16          2HG2      ILE  16   0.496  -8.734  10.490
  135   3HG2  ILE  16          3HG2      ILE  16   0.620  -7.696   9.069
  136   1HD1  ILE  16          1HD1      ILE  16  -1.572  -6.515  12.934
  137   2HD1  ILE  16          2HD1      ILE  16  -0.075  -5.687  13.364
  138   3HD1  ILE  16          3HD1      ILE  16  -0.075  -7.431  13.103
  139    H    ILE  17           H        ILE  17  -1.716  -6.952   6.826
  140    HA   ILE  17           HA       ILE  17  -3.908  -8.913   7.035
  141    HB   ILE  17           HB       ILE  17  -3.575  -7.009   4.713
  142   1HG1  ILE  17          2HG1      ILE  17  -4.253  -5.799   6.763
  143   2HG1  ILE  17          1HG1      ILE  17  -5.526  -5.814   5.548
  144   1HG2  ILE  17          1HG2      ILE  17  -6.101  -7.877   4.544
  145   2HG2  ILE  17          2HG2      ILE  17  -5.365  -9.286   5.307
  146   3HG2  ILE  17          3HG2      ILE  17  -4.747  -8.695   3.764
  147   1HD1  ILE  17          1HD1      ILE  17  -5.573  -6.757   8.257
  148   2HD1  ILE  17          2HD1      ILE  17  -6.003  -8.054   7.141
  149   3HD1  ILE  17          3HD1      ILE  17  -6.902  -6.538   7.118
  150    H    ALA  18           H        ALA  18  -3.652 -10.790   5.910
  151    HA   ALA  18           HA       ALA  18  -1.069 -11.193   4.595
  152   1HB   ALA  18          1HB       ALA  18  -1.253 -12.961   5.997
  153   2HB   ALA  18          2HB       ALA  18  -2.113 -13.657   4.626
  154   3HB   ALA  18          3HB       ALA  18  -3.016 -12.949   5.964
  155    H    PHE  19           H        PHE  19  -0.844 -12.004   2.507
  156    HA   PHE  19           HA       PHE  19  -3.279 -12.159   0.865
  157   1HB   PHE  19          2HB       PHE  19  -0.861 -10.442   0.433
  158   2HB   PHE  19          1HB       PHE  19  -1.749 -11.054  -0.960
  159    HD1  PHE  19           HD2      PHE  19  -1.908  -8.871   1.986
  160    HD2  PHE  19           HD1      PHE  19  -3.932 -10.232  -1.503
  161    HE1  PHE  19           HE2      PHE  19  -3.532  -7.038   2.217
  162    HE2  PHE  19           HE1      PHE  19  -5.560  -8.400  -1.278
  163    HZ   PHE  19           HZ       PHE  19  -5.360  -6.801   0.585
  164    H    SER  20           H        SER  20  -3.385 -14.089  -0.063
  165    HA   SER  20           HA       SER  20  -1.146 -15.860  -0.209
  166   1HB   SER  20          2HB       SER  20  -3.957 -16.054  -1.308
  167   2HB   SER  20          1HB       SER  20  -2.767 -17.348  -1.441
  168    HG   SER  20           HG       SER  20  -4.132 -17.585   0.396
  169    H    ARG  21           H        ARG  21   0.149 -16.378  -1.897
  170    HA   ARG  21           HA       ARG  21  -0.128 -14.758  -4.325
  171   1HB   ARG  21          2HB       ARG  21   2.177 -16.068  -2.942
  172   2HB   ARG  21          1HB       ARG  21   2.284 -15.769  -4.672
  173   1HG   ARG  21          2HG       ARG  21   1.715 -13.366  -4.174
  174   2HG   ARG  21          1HG       ARG  21   1.939 -13.756  -2.468
  175   1HD   ARG  21          2HD       ARG  21   4.071 -14.428  -4.454
  176   2HD   ARG  21          1HD       ARG  21   3.920 -12.780  -3.846
  177    HE   ARG  21           HE       ARG  21   3.934 -14.359  -1.609
  178   1HH1  ARG  21          1HH1      ARG  21   6.098 -13.880  -4.316
  179   2HH1  ARG  21          2HH1      ARG  21   7.524 -14.239  -3.399
  180   1HH2  ARG  21          1HH2      ARG  21   5.815 -14.831  -0.405
  181   2HH2  ARG  21          2HH2      ARG  21   7.363 -14.780  -1.180
  182    HA   PRO  22           HA       PRO  22   1.262 -14.934  -6.290
  183   1HB   PRO  22          2HB       PRO  22   0.378 -14.944  -8.838
  184   2HB   PRO  22          1HB       PRO  22   1.726 -15.954  -8.302
  185   1HG   PRO  22          2HG       PRO  22  -1.137 -16.697  -8.754
  186   2HG   PRO  22          1HG       PRO  22   0.335 -17.593  -9.174
  187   1HD   PRO  22          2HD       PRO  22  -1.195 -18.137  -6.973
  188   2HD   PRO  22          1HD       PRO  22   0.543 -18.478  -7.072
  189    H    VAL  23           H        VAL  23   0.391 -13.063  -5.694
  190    HA   VAL  23           HA       VAL  23  -2.478 -12.600  -6.123
  191    HB   VAL  23           HB       VAL  23  -1.690 -12.440  -3.794
  192   1HG1  VAL  23          1HG1      VAL  23  -0.376 -10.068  -3.539
  193   2HG1  VAL  23          2HG1      VAL  23   0.332 -10.714  -5.018
  194   3HG1  VAL  23          3HG1      VAL  23   0.390 -11.656  -3.528
  195   1HG2  VAL  23          1HG2      VAL  23  -2.470  -9.722  -4.835
  196   2HG2  VAL  23          2HG2      VAL  23  -2.782 -10.390  -3.232
  197   3HG2  VAL  23          3HG2      VAL  23  -3.596 -11.067  -4.642
  198    H    LYS  24           H        LYS  24  -3.206 -10.547  -6.902
  199    HA   LYS  24           HA       LYS  24  -1.256  -9.241  -8.675
  200   1HB   LYS  24          2HB       LYS  24  -4.105  -9.928  -8.911
  201   2HB   LYS  24          1HB       LYS  24  -3.721  -8.297  -9.440
  202   1HG   LYS  24          2HG       LYS  24  -3.492  -9.505 -11.383
  203   2HG   LYS  24          1HG       LYS  24  -1.829  -9.448 -10.792
  204   1HD   LYS  24          2HD       LYS  24  -2.310 -11.684  -9.681
  205   2HD   LYS  24          1HD       LYS  24  -3.786 -11.732 -10.647
  206   1HE   LYS  24          2HE       LYS  24  -2.383 -11.463 -12.686
  207   2HE   LYS  24          1HE       LYS  24  -0.951 -11.594 -11.665
  208   1HZ   LYS  24          1HZ       LYS  24  -1.383 -13.723 -12.578
  209   2HZ   LYS  24          2HZ       LYS  24  -3.015 -13.670 -12.142
  210   3HZ   LYS  24          3HZ       LYS  24  -1.826 -13.800 -10.946
  211    H    TYR  25           H        TYR  25  -0.833  -7.090  -8.533
  212    HA   TYR  25           HA       TYR  25  -1.238  -5.700  -6.156
  213   1HB   TYR  25          2HB       TYR  25   0.464  -5.198  -7.982
  214   2HB   TYR  25          1HB       TYR  25  -0.829  -4.369  -8.838
  215    HD1  TYR  25           HD2      TYR  25  -1.849  -2.318  -7.842
  216    HD2  TYR  25           HD1      TYR  25   1.584  -4.172  -6.143
  217    HE1  TYR  25           HE2      TYR  25  -1.367  -0.260  -6.585
  218    HE2  TYR  25           HE1      TYR  25   2.076  -2.119  -4.883
  219    HH   TYR  25           HH       TYR  25   0.744   0.827  -5.562
  220    H    GLU  26           H        GLU  26  -3.158  -5.733  -9.119
  221    HA   GLU  26           HA       GLU  26  -4.842  -3.567  -8.587
  222   1HB   GLU  26          2HB       GLU  26  -5.217  -6.104 -10.163
  223   2HB   GLU  26          1HB       GLU  26  -6.514  -4.924 -10.015
  224   1HG   GLU  26          2HG       GLU  26  -5.584  -3.547 -11.497
  225   2HG   GLU  26          1HG       GLU  26  -3.974  -3.738 -10.805
  226    H    ASP  27           H        ASP  27  -5.178  -6.994  -7.688
  227    HA   ASP  27           HA       ASP  27  -7.701  -6.698  -6.428
  228   1HB   ASP  27          2HB       ASP  27  -5.553  -8.803  -6.088
  229   2HB   ASP  27          1HB       ASP  27  -7.150  -8.900  -5.354
  230    H    VAL  28           H        VAL  28  -4.374  -6.694  -5.162
  231    HA   VAL  28           HA       VAL  28  -5.068  -6.481  -2.442
  232    HB   VAL  28           HB       VAL  28  -2.571  -5.361  -3.727
  233   1HG1  VAL  28          1HG1      VAL  28  -3.472  -5.803  -0.949
  234   2HG1  VAL  28          2HG1      VAL  28  -2.358  -4.604  -1.605
  235   3HG1  VAL  28          3HG1      VAL  28  -1.806  -6.253  -1.310
  236   1HG2  VAL  28          1HG2      VAL  28  -3.417  -8.142  -3.156
  237   2HG2  VAL  28          2HG2      VAL  28  -1.756  -7.712  -2.745
  238   3HG2  VAL  28          3HG2      VAL  28  -2.334  -7.517  -4.400
  239    H    GLU  29           H        GLU  29  -4.294  -3.982  -4.854
  240    HA   GLU  29           HA       GLU  29  -4.532  -1.753  -3.168
  241   1HB   GLU  29          2HB       GLU  29  -3.676  -1.959  -5.631
  242   2HB   GLU  29          1HB       GLU  29  -5.352  -1.635  -6.052
  243   1HG   GLU  29          2HG       GLU  29  -4.750   0.301  -4.172
  244   2HG   GLU  29          1HG       GLU  29  -3.284   0.170  -5.140
  245    H    HIS  30           H        HIS  30  -6.941  -3.407  -5.178
  246    HA   HIS  30           HA       HIS  30  -9.086  -1.674  -4.789
  247   1HB   HIS  30          2HB       HIS  30  -8.767  -3.898  -6.236
  248   2HB   HIS  30          1HB       HIS  30  -9.643  -4.599  -4.881
  249    HD1  HIS  30           HD1      HIS  30 -10.055  -1.703  -7.319
  250    HD2  HIS  30           HD2      HIS  30 -12.331  -4.406  -5.131
  251    HE1  HIS  30           HE1      HIS  30 -12.435  -1.306  -8.028
  252    HE2  HIS  30           HE2      HIS  30 -13.786  -3.000  -6.742
  253    H    LYS  31           H        LYS  31  -7.964  -4.377  -2.791
  254    HA   LYS  31           HA       LYS  31 -10.123  -4.308  -0.953
  255   1HB   LYS  31          2HB       LYS  31  -7.953  -5.969  -1.386
  256   2HB   LYS  31          1HB       LYS  31  -7.585  -5.231   0.167
  257   1HG   LYS  31          2HG       LYS  31  -9.712  -5.976   1.057
  258   2HG   LYS  31          1HG       LYS  31 -10.150  -6.654  -0.512
  259   1HD   LYS  31          2HD       LYS  31  -8.646  -8.397  -0.330
  260   2HD   LYS  31          1HD       LYS  31  -7.623  -7.530   0.820
  261   1HE   LYS  31          2HE       LYS  31 -10.375  -8.097   1.718
  262   2HE   LYS  31          1HE       LYS  31  -9.336  -9.506   1.503
  263   1HZ   LYS  31          1HZ       LYS  31  -9.266  -8.563   3.767
  264   2HZ   LYS  31          2HZ       LYS  31  -8.618  -7.131   3.140
  265   3HZ   LYS  31          3HZ       LYS  31  -7.749  -8.579   3.018
  266    H    VAL  32           H        VAL  32  -6.821  -2.957  -0.793
  267    HA   VAL  32           HA       VAL  32  -7.148  -1.753   1.743
  268    HB   VAL  32           HB       VAL  32  -5.287  -0.809  -0.440
  269   1HG1  VAL  32          1HG1      VAL  32  -5.112  -0.573   2.564
  270   2HG1  VAL  32          2HG1      VAL  32  -5.530   0.728   1.449
  271   3HG1  VAL  32          3HG1      VAL  32  -3.918   0.012   1.405
  272   1HG2  VAL  32          1HG2      VAL  32  -4.469  -2.905  -0.311
  273   2HG2  VAL  32          2HG2      VAL  32  -5.231  -3.225   1.248
  274   3HG2  VAL  32          3HG2      VAL  32  -3.724  -2.311   1.172
  275    H    THR  33           H        THR  33  -7.652  -0.521  -1.545
  276    HA   THR  33           HA       THR  33  -8.116   2.158  -0.881
  277    HB   THR  33           HB       THR  33  -9.238   0.528  -3.171
  278    HG1  THR  33           HG1      THR  33  -6.984   2.247  -3.033
  279   1HG2  THR  33          1HG2      THR  33 -10.548   2.392  -3.354
  280   2HG2  THR  33          2HG2      THR  33  -9.123   2.896  -4.265
  281   3HG2  THR  33          3HG2      THR  33  -9.353   3.443  -2.602
  282    H    THR  34           H        THR  34 -10.338  -0.616  -0.967
  283    HA   THR  34           HA       THR  34 -12.672   0.956  -0.466
  284    HB   THR  34           HB       THR  34 -12.339  -1.997   0.082
  285    HG1  THR  34           HG1      THR  34 -12.210  -2.254  -1.980
  286   1HG2  THR  34          1HG2      THR  34 -14.509  -2.067   0.476
  287   2HG2  THR  34          2HG2      THR  34 -14.857  -1.219  -1.030
  288   3HG2  THR  34          3HG2      THR  34 -14.532  -0.305   0.442
  289    H    VAL  35           H        VAL  35 -10.254  -0.531   1.581
  290    HA   VAL  35           HA       VAL  35 -11.770  -0.482   3.984
  291    HB   VAL  35           HB       VAL  35  -8.760  -0.392   3.721
  292   1HG1  VAL  35          1HG1      VAL  35  -9.788   0.197   5.949
  293   2HG1  VAL  35          2HG1      VAL  35  -8.663  -1.161   5.960
  294   3HG1  VAL  35          3HG1      VAL  35 -10.402  -1.455   6.008
  295   1HG2  VAL  35          1HG2      VAL  35  -9.792  -2.966   4.437
  296   2HG2  VAL  35          2HG2      VAL  35  -8.773  -2.515   3.071
  297   3HG2  VAL  35          3HG2      VAL  35 -10.528  -2.431   2.925
  298    H    PHE  36           H        PHE  36  -9.198   1.697   2.777
  299    HA   PHE  36           HA       PHE  36  -9.905   3.642   4.835
  300   1HB   PHE  36          2HB       PHE  36  -7.652   3.652   2.823
  301   2HB   PHE  36          1HB       PHE  36  -7.881   4.840   4.099
  302    HD1  PHE  36           HD1      PHE  36  -7.453   4.273   6.419
  303    HD2  PHE  36           HD2      PHE  36  -6.844   1.429   3.310
  304    HE1  PHE  36           HE1      PHE  36  -6.139   2.875   7.959
  305    HE2  PHE  36           HE2      PHE  36  -5.534   0.028   4.846
  306    HZ   PHE  36           HZ       PHE  36  -5.182   0.750   7.172
  307    H    GLY  37           H        GLY  37 -10.736   3.074   1.585
  308   1HA   GLY  37          2HA       GLY  37 -12.417   4.431   0.543
  309   2HA   GLY  37          1HA       GLY  37 -11.775   5.825   1.397
  310    H    GLN  38           H        GLN  38 -12.180   6.340  -1.129
  311    HA   GLN  38           HA       GLN  38  -9.509   6.200  -2.356
  312   1HB   GLN  38          2HB       GLN  38 -10.545   6.025  -4.576
  313   2HB   GLN  38          1HB       GLN  38 -10.964   4.657  -3.559
  314   1HG   GLN  38          2HG       GLN  38 -13.138   5.743  -3.076
  315   2HG   GLN  38          1HG       GLN  38 -12.712   7.014  -4.223
  316   1HE2  GLN  38          1HE2      GLN  38 -13.600   6.754  -6.144
  317   2HE2  GLN  38          2HE2      GLN  38 -13.963   5.245  -6.904
  318    HA   PRO  39           HA       PRO  39  -8.805   6.862  -4.296
  319   1HB   PRO  39          2HB       PRO  39  -7.115   8.618  -5.376
  320   2HB   PRO  39          1HB       PRO  39  -8.748   8.409  -6.018
  321   1HG   PRO  39          2HG       PRO  39  -7.644  10.592  -4.322
  322   2HG   PRO  39          1HG       PRO  39  -8.870  10.668  -5.599
  323   1HD   PRO  39          2HD       PRO  39  -9.342  10.573  -2.821
  324   2HD   PRO  39          1HD       PRO  39 -10.546  10.358  -4.105
  325    H    LEU  40           H        LEU  40  -7.077   5.826  -3.466
  326    HA   LEU  40           HA       LEU  40  -5.179   7.305  -1.793
  327   1HB   LEU  40          2HB       LEU  40  -6.701   4.833  -0.999
  328   2HB   LEU  40          1HB       LEU  40  -5.163   5.245  -0.261
  329    HG   LEU  40           HG       LEU  40  -7.544   7.098  -0.245
  330   1HD1  LEU  40          1HD1      LEU  40  -7.049   6.044   2.325
  331   2HD1  LEU  40          2HD1      LEU  40  -7.174   4.678   1.215
  332   3HD1  LEU  40          3HD1      LEU  40  -8.486   5.852   1.323
  333   1HD2  LEU  40          1HD2      LEU  40  -4.977   7.725   0.186
  334   2HD2  LEU  40          2HD2      LEU  40  -5.418   7.182   1.805
  335   3HD2  LEU  40          3HD2      LEU  40  -6.313   8.493   1.041
  336    H    ASP  41           H        ASP  41  -3.091   6.706  -2.052
  337    HA   ASP  41           HA       ASP  41  -2.564   4.401  -3.813
  338   1HB   ASP  41          2HB       ASP  41  -2.023   6.557  -4.861
  339   2HB   ASP  41          1HB       ASP  41  -0.957   6.948  -3.514
  340    H    LEU  42           H        LEU  42  -0.993   2.940  -3.259
  341    HA   LEU  42           HA       LEU  42  -0.178   2.922  -0.487
  342   1HB   LEU  42          2HB       LEU  42   0.517   0.952  -2.670
  343   2HB   LEU  42          1HB       LEU  42   0.697   0.707  -0.943
  344    HG   LEU  42           HG       LEU  42  -1.994   1.284  -1.211
  345   1HD1  LEU  42          1HD1      LEU  42  -2.884   0.104  -3.016
  346   2HD1  LEU  42          2HD1      LEU  42  -1.353  -0.694  -3.371
  347   3HD1  LEU  42          3HD1      LEU  42  -1.553   1.023  -3.715
  348   1HD2  LEU  42          1HD2      LEU  42  -2.293  -1.139  -0.789
  349   2HD2  LEU  42          2HD2      LEU  42  -1.090  -0.392   0.262
  350   3HD2  LEU  42          3HD2      LEU  42  -0.575  -1.375  -1.109
  351    H    HIS  43           H        HIS  43   1.538   4.044   0.143
  352    HA   HIS  43           HA       HIS  43   3.774   4.447  -1.716
  353   1HB   HIS  43          2HB       HIS  43   2.533   6.025   0.416
  354   2HB   HIS  43          1HB       HIS  43   4.287   5.994   0.521
  355    HD1  HIS  43           HD1      HIS  43   5.379   6.461  -2.089
  356    HD2  HIS  43           HD2      HIS  43   1.710   8.116  -1.050
  357    HE1  HIS  43           HE1      HIS  43   5.044   8.395  -3.661
  358    HE2  HIS  43           HE2      HIS  43   2.826   9.395  -3.000
  359    H    TYR  44           H        TYR  44   5.710   3.484  -1.399
  360    HA   TYR  44           HA       TYR  44   5.997   1.719   0.896
  361   1HB   TYR  44          2HB       TYR  44   6.693   1.412  -1.720
  362   2HB   TYR  44          1HB       TYR  44   8.232   1.901  -1.019
  363    HD1  TYR  44           HD2      TYR  44   5.595  -0.662  -0.977
  364    HD2  TYR  44           HD1      TYR  44   9.437   0.449   0.472
  365    HE1  TYR  44           HE2      TYR  44   5.940  -2.952  -0.159
  366    HE2  TYR  44           HE1      TYR  44   9.793  -1.840   1.298
  367    HH   TYR  44           HH       TYR  44   7.967  -4.442   0.360
  368    H    MET  45           H        MET  45   7.104   2.202   2.663
  369    HA   MET  45           HA       MET  45   9.172   4.298   2.519
  370   1HB   MET  45          2HB       MET  45   7.025   5.043   3.622
  371   2HB   MET  45          1HB       MET  45   7.331   3.847   4.873
  372   1HG   MET  45          2HG       MET  45   8.408   5.464   5.946
  373   2HG   MET  45          1HG       MET  45   9.697   5.235   4.765
  374   1HE   MET  45          1HE       MET  45   6.156   6.979   4.996
  375   2HE   MET  45          2HE       MET  45   6.667   8.665   4.954
  376   3HE   MET  45          3HE       MET  45   7.166   7.625   6.287
  377    H    ASN  46           H        ASN  46  11.052   3.242   2.739
  378    HA   ASN  46           HA       ASN  46  11.278   0.829   4.299
  379   1HB   ASN  46          2HB       ASN  46  13.081   2.417   2.536
  380   2HB   ASN  46          1HB       ASN  46  13.839   1.384   3.744
  381   1HD2  ASN  46          1HD2      ASN  46  14.267   0.911   1.105
  382   2HD2  ASN  46          2HD2      ASN  46  13.468  -0.545   0.627
  383    H    ASN  47           H        ASN  47  12.949   3.979   4.472
  384    HA   ASN  47           HA       ASN  47  12.684   4.032   7.346
  385   1HB   ASN  47          2HB       ASN  47  15.003   2.879   6.239
  386   2HB   ASN  47          1HB       ASN  47  15.479   4.483   6.786
  387   1HD2  ASN  47          1HD2      ASN  47  13.294   1.946   7.989
  388   2HD2  ASN  47          2HD2      ASN  47  13.951   1.910   9.588
  389    H    GLU  48           H        GLU  48  14.654   5.474   4.745
  390    HA   GLU  48           HA       GLU  48  13.608   8.111   5.527
  391   1HB   GLU  48          2HB       GLU  48  15.886   9.022   4.865
  392   2HB   GLU  48          1HB       GLU  48  15.813   8.125   6.374
  393   1HG   GLU  48          2HG       GLU  48  17.392   6.751   5.665
  394   2HG   GLU  48          1HG       GLU  48  16.413   6.301   4.273
  395    H    LEU  49           H        LEU  49  13.273   5.972   3.214
  396    HA   LEU  49           HA       LEU  49  13.256   7.994   1.083
  397   1HB   LEU  49          2HB       LEU  49  13.857   6.194  -0.529
  398   2HB   LEU  49          1HB       LEU  49  15.135   6.607   0.596
  399    HG   LEU  49           HG       LEU  49  13.467   4.399   1.536
  400   1HD1  LEU  49          1HD1      LEU  49  14.153   2.749  -0.031
  401   2HD1  LEU  49          2HD1      LEU  49  15.153   3.906  -0.909
  402   3HD1  LEU  49          3HD1      LEU  49  13.396   4.054  -0.942
  403   1HD2  LEU  49          1HD2      LEU  49  15.578   5.043   2.571
  404   2HD2  LEU  49          2HD2      LEU  49  16.431   4.716   1.063
  405   3HD2  LEU  49          3HD2      LEU  49  15.663   3.397   1.946
  406    H    SER  50           H        SER  50  11.644   7.725  -0.535
  407    HA   SER  50           HA       SER  50   9.438   5.936   0.254
  408   1HB   SER  50          2HB       SER  50   9.211   8.565   0.471
  409   2HB   SER  50          1HB       SER  50   8.890   8.458  -1.260
  410    HG   SER  50           HG       SER  50   6.928   8.150  -0.449
  411    H    ILE  51           H        ILE  51   8.809   4.509  -1.231
  412    HA   ILE  51           HA       ILE  51   9.662   4.928  -4.027
  413    HB   ILE  51           HB       ILE  51   9.089   2.269  -2.711
  414   1HG1  ILE  51          2HG1      ILE  51  11.869   2.819  -3.447
  415   2HG1  ILE  51          1HG1      ILE  51  11.276   3.881  -2.173
  416   1HG2  ILE  51          1HG2      ILE  51   9.882   1.258  -4.654
  417   2HG2  ILE  51          2HG2      ILE  51  10.650   2.737  -5.225
  418   3HG2  ILE  51          3HG2      ILE  51   8.894   2.591  -5.246
  419   1HD1  ILE  51          1HD1      ILE  51  12.343   1.922  -1.239
  420   2HD1  ILE  51          2HD1      ILE  51  11.242   0.873  -2.132
  421   3HD1  ILE  51          3HD1      ILE  51  10.621   1.925  -0.860
  422    H    LEU  52           H        LEU  52   8.151   4.876  -5.609
  423    HA   LEU  52           HA       LEU  52   5.359   4.615  -4.791
  424   1HB   LEU  52          2HB       LEU  52   6.773   6.230  -6.676
  425   2HB   LEU  52          1HB       LEU  52   5.586   5.279  -7.547
  426    HG   LEU  52           HG       LEU  52   4.939   7.030  -5.175
  427   1HD1  LEU  52          1HD1      LEU  52   4.035   7.742  -7.896
  428   2HD1  LEU  52          2HD1      LEU  52   5.738   8.011  -7.532
  429   3HD1  LEU  52          3HD1      LEU  52   4.494   8.775  -6.543
  430   1HD2  LEU  52          1HD2      LEU  52   3.133   5.714  -7.201
  431   2HD2  LEU  52          2HD2      LEU  52   2.637   6.695  -5.821
  432   3HD2  LEU  52          3HD2      LEU  52   3.407   5.131  -5.559
  433    H    LEU  53           H        LEU  53   4.158   2.884  -5.250
  434    HA   LEU  53           HA       LEU  53   5.282   0.832  -7.018
  435   1HB   LEU  53          2HB       LEU  53   2.980   0.592  -5.076
  436   2HB   LEU  53          1HB       LEU  53   3.779  -0.719  -5.921
  437    HG   LEU  53           HG       LEU  53   4.586  -0.812  -3.715
  438   1HD1  LEU  53          1HD1      LEU  53   6.981  -0.173  -3.907
  439   2HD1  LEU  53          2HD1      LEU  53   6.596   0.630  -5.428
  440   3HD1  LEU  53          3HD1      LEU  53   6.373  -1.113  -5.269
  441   1HD2  LEU  53          1HD2      LEU  53   4.849   0.921  -2.311
  442   2HD2  LEU  53          2HD2      LEU  53   3.898   1.799  -3.507
  443   3HD2  LEU  53          3HD2      LEU  53   5.658   1.914  -3.524
  444    H    LYS  54           H        LYS  54   4.670   1.434  -9.063
  445    HA   LYS  54           HA       LYS  54   1.866   2.079  -9.576
  446   1HB   LYS  54          2HB       LYS  54   4.283   2.943 -10.708
  447   2HB   LYS  54          1HB       LYS  54   3.511   1.965 -11.950
  448   1HG   LYS  54          2HG       LYS  54   1.404   3.391 -11.359
  449   2HG   LYS  54          1HG       LYS  54   2.597   4.515 -10.706
  450   1HD   LYS  54          2HD       LYS  54   3.764   4.130 -13.028
  451   2HD   LYS  54          1HD       LYS  54   2.144   3.643 -13.527
  452   1HE   LYS  54          2HE       LYS  54   2.769   6.263 -12.167
  453   2HE   LYS  54          1HE       LYS  54   2.703   6.060 -13.917
  454   1HZ   LYS  54          1HZ       LYS  54   0.379   5.105 -12.460
  455   2HZ   LYS  54          2HZ       LYS  54   0.470   5.974 -13.908
  456   3HZ   LYS  54          3HZ       LYS  54   0.615   6.780 -12.429
  457    H    ASN  55           H        ASN  55   4.227  -0.449 -10.200
  458    HA   ASN  55           HA       ASN  55   2.052  -2.141 -11.208
  459   1HB   ASN  55          2HB       ASN  55   4.583  -1.440 -12.603
  460   2HB   ASN  55          1HB       ASN  55   4.053  -3.116 -12.708
  461   1HD2  ASN  55          1HD2      ASN  55   4.027  -0.391 -14.378
  462   2HD2  ASN  55          2HD2      ASN  55   2.512  -0.523 -15.200
  463    H    GLN  56           H        GLN  56   2.874  -4.509 -11.366
  464    HA   GLN  56           HA       GLN  56   3.561  -5.377  -8.786
  465   1HB   GLN  56          2HB       GLN  56   2.349  -6.701 -10.579
  466   2HB   GLN  56          1HB       GLN  56   3.920  -6.996 -11.312
  467   1HG   GLN  56          2HG       GLN  56   4.459  -8.566  -9.819
  468   2HG   GLN  56          1HG       GLN  56   3.811  -7.642  -8.464
  469   1HE2  GLN  56          1HE2      GLN  56   2.654  -9.201  -7.469
  470   2HE2  GLN  56          2HE2      GLN  56   1.315 -10.028  -8.181
  471    H    ASP  57           H        ASP  57   5.539  -4.606 -11.571
  472    HA   ASP  57           HA       ASP  57   7.896  -5.933 -10.975
  473   1HB   ASP  57          2HB       ASP  57   7.164  -4.203 -12.919
  474   2HB   ASP  57          1HB       ASP  57   8.184  -3.145 -11.949
  475    H    ASP  58           H        ASP  58   6.745  -2.798  -9.764
  476    HA   ASP  58           HA       ASP  58   9.063  -2.199  -8.241
  477   1HB   ASP  58          2HB       ASP  58   6.243  -1.226  -7.721
  478   2HB   ASP  58          1HB       ASP  58   7.738  -0.465  -7.192
  479    H    LEU  59           H        LEU  59   6.056  -3.882  -7.526
  480    HA   LEU  59           HA       LEU  59   6.379  -4.125  -4.741
  481   1HB   LEU  59          2HB       LEU  59   4.249  -4.520  -5.826
  482   2HB   LEU  59          1HB       LEU  59   4.916  -5.870  -6.721
  483    HG   LEU  59           HG       LEU  59   5.269  -6.301  -3.895
  484   1HD1  LEU  59          1HD1      LEU  59   2.640  -5.271  -4.781
  485   2HD1  LEU  59          2HD1      LEU  59   3.426  -5.181  -3.206
  486   3HD1  LEU  59          3HD1      LEU  59   2.641  -6.675  -3.714
  487   1HD2  LEU  59          1HD2      LEU  59   4.024  -7.676  -6.230
  488   2HD2  LEU  59          2HD2      LEU  59   3.676  -8.262  -4.604
  489   3HD2  LEU  59          3HD2      LEU  59   5.341  -8.201  -5.180
  490    H    ASP  60           H        ASP  60   7.308  -6.283  -7.411
  491    HA   ASP  60           HA       ASP  60   8.311  -8.378  -5.822
  492   1HB   ASP  60          2HB       ASP  60   7.909  -8.078  -8.477
  493   2HB   ASP  60          1HB       ASP  60   9.660  -7.892  -8.412
  494    H    LYS  61           H        LYS  61   9.879  -5.500  -7.155
  495    HA   LYS  61           HA       LYS  61  12.518  -6.135  -6.419
  496   1HB   LYS  61          2HB       LYS  61  11.726  -4.274  -7.970
  497   2HB   LYS  61          1HB       LYS  61  11.355  -3.352  -6.520
  498   1HG   LYS  61          2HG       LYS  61  13.639  -3.292  -5.869
  499   2HG   LYS  61          1HG       LYS  61  14.087  -4.455  -7.118
  500   1HD   LYS  61          2HD       LYS  61  14.605  -2.672  -8.367
  501   2HD   LYS  61          1HD       LYS  61  12.865  -2.452  -8.556
  502   1HE   LYS  61          2HE       LYS  61  14.161  -1.319  -6.132
  503   2HE   LYS  61          1HE       LYS  61  14.453  -0.514  -7.674
  504   1HZ   LYS  61          1HZ       LYS  61  11.748  -1.119  -6.603
  505   2HZ   LYS  61          2HZ       LYS  61  12.118  -0.187  -7.965
  506   3HZ   LYS  61          3HZ       LYS  61  12.527   0.373  -6.424
  507    H    ALA  62           H        ALA  62   9.890  -4.536  -4.675
  508    HA   ALA  62           HA       ALA  62  11.380  -3.684  -2.441
  509   1HB   ALA  62          1HB       ALA  62   8.968  -3.960  -1.348
  510   2HB   ALA  62          2HB       ALA  62   8.503  -4.057  -3.045
  511   3HB   ALA  62          3HB       ALA  62   9.365  -2.639  -2.445
  512    H    ILE  63           H        ILE  63   9.637  -6.711  -3.091
  513    HA   ILE  63           HA       ILE  63   9.935  -7.832  -0.518
  514    HB   ILE  63           HB       ILE  63   9.763  -9.362  -3.121
  515   1HG1  ILE  63          2HG1      ILE  63   7.365  -8.862  -1.422
  516   2HG1  ILE  63          1HG1      ILE  63   7.941  -7.532  -2.418
  517   1HG2  ILE  63          1HG2      ILE  63   9.420 -11.240  -1.921
  518   2HG2  ILE  63          2HG2      ILE  63   8.521 -10.400  -0.659
  519   3HG2  ILE  63          3HG2      ILE  63  10.283 -10.355  -0.663
  520   1HD1  ILE  63          1HD1      ILE  63   7.092  -8.427  -4.259
  521   2HD1  ILE  63          2HD1      ILE  63   6.231  -9.540  -3.197
  522   3HD1  ILE  63          3HD1      ILE  63   7.776 -10.013  -3.903
  523    H    ASP  64           H        ASP  64  11.929  -8.077  -3.447
  524    HA   ASP  64           HA       ASP  64  13.797  -9.926  -2.529
  525   1HB   ASP  64          2HB       ASP  64  13.493  -8.295  -4.803
  526   2HB   ASP  64          1HB       ASP  64  15.084  -7.913  -4.155
  527    H    ILE  65           H        ILE  65  13.734  -6.397  -2.142
  528    HA   ILE  65           HA       ILE  65  16.266  -6.208  -0.866
  529    HB   ILE  65           HB       ILE  65  13.946  -4.291  -0.581
  530   1HG1  ILE  65          2HG1      ILE  65  16.196  -3.854  -2.504
  531   2HG1  ILE  65          1HG1      ILE  65  14.894  -4.941  -2.972
  532   1HG2  ILE  65          1HG2      ILE  65  15.743  -3.985   1.053
  533   2HG2  ILE  65          2HG2      ILE  65  15.667  -2.641  -0.083
  534   3HG2  ILE  65          3HG2      ILE  65  16.918  -3.873  -0.257
  535   1HD1  ILE  65          1HD1      ILE  65  14.839  -2.006  -2.519
  536   2HD1  ILE  65          2HD1      ILE  65  13.373  -2.947  -2.244
  537   3HD1  ILE  65          3HD1      ILE  65  14.145  -2.965  -3.828
  538    H    LEU  66           H        LEU  66  12.948  -6.500   0.363
  539    HA   LEU  66           HA       LEU  66  13.503  -6.178   3.090
  540   1HB   LEU  66          2HB       LEU  66  11.234  -6.206   2.040
  541   2HB   LEU  66          1HB       LEU  66  11.378  -7.945   1.876
  542    HG   LEU  66           HG       LEU  66  11.770  -7.860   4.475
  543   1HD1  LEU  66          1HD1      LEU  66  10.501  -6.086   5.558
  544   2HD1  LEU  66          2HD1      LEU  66  10.203  -5.330   3.993
  545   3HD1  LEU  66          3HD1      LEU  66  11.845  -5.425   4.628
  546   1HD2  LEU  66          1HD2      LEU  66   8.949  -7.334   3.693
  547   2HD2  LEU  66          2HD2      LEU  66   9.621  -8.595   4.726
  548   3HD2  LEU  66          3HD2      LEU  66   9.778  -8.717   2.975
  549    H    ASP  67           H        ASP  67  13.408  -9.127   1.097
  550    HA   ASP  67           HA       ASP  67  13.884 -11.001   3.108
  551   1HB   ASP  67          2HB       ASP  67  13.610 -11.073   0.336
  552   2HB   ASP  67          1HB       ASP  67  15.229 -11.698   0.620
  553    H    ARG  68           H        ARG  68  16.133  -8.966   1.324
  554    HA   ARG  68           HA       ARG  68  18.499 -10.251   2.290
  555   1HB   ARG  68          2HB       ARG  68  17.853  -8.159   0.445
  556   2HB   ARG  68          1HB       ARG  68  19.061  -7.558   1.573
  557   1HG   ARG  68          2HG       ARG  68  20.056 -10.021   0.931
  558   2HG   ARG  68          1HG       ARG  68  19.306  -9.506  -0.583
  559   1HD   ARG  68          2HD       ARG  68  20.602  -7.508  -0.638
  560   2HD   ARG  68          1HD       ARG  68  21.188  -7.769   1.004
  561    HE   ARG  68           HE       ARG  68  22.780  -9.190   0.180
  562   1HH1  ARG  68          1HH1      ARG  68  20.377  -8.644  -2.314
  563   2HH1  ARG  68          2HH1      ARG  68  21.290  -9.458  -3.540
  564   1HH2  ARG  68          1HH2      ARG  68  23.974 -10.259  -1.437
  565   2HH2  ARG  68          2HH2      ARG  68  23.334 -10.377  -3.042
  566    H    SER  69           H        SER  69  16.468  -7.619   3.402
  567    HA   SER  69           HA       SER  69  18.250  -6.467   5.258
  568   1HB   SER  69          2HB       SER  69  16.011  -5.560   4.353
  569   2HB   SER  69          1HB       SER  69  15.261  -6.525   5.624
  570    HG   SER  69           HG       SER  69  16.011  -5.184   7.096
  571    H    SER  70           H        SER  70  18.618  -6.824   7.417
  572    HA   SER  70           HA       SER  70  18.260  -9.470   8.395
  573   1HB   SER  70          2HB       SER  70  20.210  -7.990   8.940
  574   2HB   SER  70          1HB       SER  70  19.138  -7.039   9.967
  575    HG   SER  70           HG       SER  70  18.848  -8.829  11.278
  576    H    SER  71           H        SER  71  16.509  -6.459   8.889
  577    HA   SER  71           HA       SER  71  14.940  -7.626  11.058
  578   1HB   SER  71          2HB       SER  71  14.073  -5.448  11.450
  579   2HB   SER  71          1HB       SER  71  15.783  -5.220  11.089
  580    HG   SER  71           HG       SER  71  14.855  -4.951   8.801
  581    H    MET  72           H        MET  72  14.667  -8.870   8.517
  582    HA   MET  72           HA       MET  72  12.315  -7.972   7.189
  583   1HB   MET  72          2HB       MET  72  14.063  -9.349   6.099
  584   2HB   MET  72          1HB       MET  72  13.619 -10.700   7.133
  585   1HG   MET  72          2HG       MET  72  11.418  -9.494   5.602
  586   2HG   MET  72          1HG       MET  72  12.657 -10.312   4.652
  587   1HE   MET  72          1HE       MET  72   9.912 -10.869   4.504
  588   2HE   MET  72          2HE       MET  72   9.157 -12.114   5.498
  589   3HE   MET  72          3HE       MET  72  10.202 -12.571   4.153
  590    H    LYS  73           H        LYS  73  10.223  -8.649   7.368
  591    HA   LYS  73           HA       LYS  73   9.285 -10.884   8.753
  592   1HB   LYS  73          2HB       LYS  73   8.221  -9.572  10.712
  593   2HB   LYS  73          1HB       LYS  73   9.901 -10.066  10.842
  594   1HG   LYS  73          2HG       LYS  73  10.647  -7.955  10.904
  595   2HG   LYS  73          1HG       LYS  73   9.502  -7.399   9.684
  596   1HD   LYS  73          2HD       LYS  73   7.887  -6.898  11.229
  597   2HD   LYS  73          1HD       LYS  73   8.438  -8.133  12.360
  598   1HE   LYS  73          2HE       LYS  73   9.954  -5.597  11.766
  599   2HE   LYS  73          1HE       LYS  73   8.829  -5.779  13.113
  600   1HZ   LYS  73          1HZ       LYS  73  10.951  -6.203  13.984
  601   2HZ   LYS  73          2HZ       LYS  73  11.399  -7.186  12.682
  602   3HZ   LYS  73          3HZ       LYS  73  10.250  -7.733  13.797
  603    H    SER  74           H        SER  74   8.585  -7.482   8.013
  604    HA   SER  74           HA       SER  74   6.149  -8.308   6.650
  605   1HB   SER  74          2HB       SER  74   6.163  -6.230   8.855
  606   2HB   SER  74          1HB       SER  74   4.803  -6.556   7.782
  607    HG   SER  74           HG       SER  74   4.938  -8.776   8.609
  608    H    LEU  75           H        LEU  75   5.089  -6.151   5.704
  609    HA   LEU  75           HA       LEU  75   7.301  -4.704   4.412
  610   1HB   LEU  75          2HB       LEU  75   4.483  -5.274   3.503
  611   2HB   LEU  75          1HB       LEU  75   5.551  -4.162   2.670
  612    HG   LEU  75           HG       LEU  75   7.170  -6.148   2.467
  613   1HD1  LEU  75          1HD1      LEU  75   5.921  -8.346   2.377
  614   2HD1  LEU  75          2HD1      LEU  75   4.645  -7.553   3.299
  615   3HD1  LEU  75          3HD1      LEU  75   6.261  -7.709   3.985
  616   1HD2  LEU  75          1HD2      LEU  75   5.366  -5.108   0.782
  617   2HD2  LEU  75          2HD2      LEU  75   4.746  -6.756   0.890
  618   3HD2  LEU  75          3HD2      LEU  75   6.405  -6.471   0.364
  619    H    ARG  76           H        ARG  76   7.625  -2.667   5.035
  620    HA   ARG  76           HA       ARG  76   5.631  -1.266   6.594
  621   1HB   ARG  76          2HB       ARG  76   8.279  -1.276   6.805
  622   2HB   ARG  76          1HB       ARG  76   8.145   0.067   5.680
  623   1HG   ARG  76          2HG       ARG  76   7.054   1.413   7.204
  624   2HG   ARG  76          1HG       ARG  76   6.490   0.046   8.166
  625   1HD   ARG  76          2HD       ARG  76   8.164   0.617   9.549
  626   2HD   ARG  76          1HD       ARG  76   9.181  -0.237   8.390
  627    HE   ARG  76           HE       ARG  76   9.110   2.284   7.408
  628   1HH1  ARG  76          1HH1      ARG  76   9.895   0.975  10.560
  629   2HH1  ARG  76          2HH1      ARG  76  10.993   2.253  10.954
  630   1HH2  ARG  76          1HH2      ARG  76  10.562   3.966   7.936
  631   2HH2  ARG  76          2HH2      ARG  76  11.372   3.950   9.465
  632    H    ILE  77           H        ILE  77   4.027  -1.158   4.867
  633    HA   ILE  77           HA       ILE  77   4.617   0.835   2.786
  634    HB   ILE  77           HB       ILE  77   2.229  -1.009   2.948
  635   1HG1  ILE  77          2HG1      ILE  77   4.571  -1.372   1.090
  636   2HG1  ILE  77          1HG1      ILE  77   4.571  -2.093   2.696
  637   1HG2  ILE  77          1HG2      ILE  77   1.493   0.517   1.458
  638   2HG2  ILE  77          2HG2      ILE  77   2.500  -0.406   0.344
  639   3HG2  ILE  77          3HG2      ILE  77   3.118   1.080   1.063
  640   1HD1  ILE  77          1HD1      ILE  77   3.375  -3.051   0.308
  641   2HD1  ILE  77          2HD1      ILE  77   2.105  -2.740   1.491
  642   3HD1  ILE  77          3HD1      ILE  77   3.444  -3.812   1.898
  643    H    LEU  78           H        LEU  78   3.959   2.849   3.150
  644    HA   LEU  78           HA       LEU  78   1.780   3.328   5.059
  645   1HB   LEU  78          2HB       LEU  78   4.237   4.418   5.003
  646   2HB   LEU  78          1HB       LEU  78   3.394   5.577   3.992
  647    HG   LEU  78           HG       LEU  78   1.672   5.516   6.035
  648   1HD1  LEU  78          1HD1      LEU  78   2.591   4.066   7.552
  649   2HD1  LEU  78          2HD1      LEU  78   3.297   5.587   8.095
  650   3HD1  LEU  78          3HD1      LEU  78   4.249   4.476   7.109
  651   1HD2  LEU  78          1HD2      LEU  78   4.153   7.112   5.578
  652   2HD2  LEU  78          2HD2      LEU  78   3.180   7.406   7.018
  653   3HD2  LEU  78          3HD2      LEU  78   2.463   7.589   5.418
  654    H    LEU  79           H        LEU  79  -0.153   4.044   4.380
  655    HA   LEU  79           HA       LEU  79  -0.365   4.999   1.601
  656   1HB   LEU  79          2HB       LEU  79  -2.759   4.297   1.745
  657   2HB   LEU  79          1HB       LEU  79  -1.601   2.986   1.818
  658    HG   LEU  79           HG       LEU  79  -1.932   3.350   4.445
  659   1HD1  LEU  79          1HD1      LEU  79  -3.530   4.855   4.849
  660   2HD1  LEU  79          2HD1      LEU  79  -4.651   3.584   4.364
  661   3HD1  LEU  79          3HD1      LEU  79  -4.136   4.799   3.194
  662   1HD2  LEU  79          1HD2      LEU  79  -2.373   1.336   2.891
  663   2HD2  LEU  79          2HD2      LEU  79  -4.056   1.858   2.956
  664   3HD2  LEU  79          3HD2      LEU  79  -3.213   1.415   4.440
  665    H    LEU  80           H        LEU  80  -1.120   6.982   1.205
  666    HA   LEU  80           HA       LEU  80  -2.611   8.407   3.288
  667   1HB   LEU  80          2HB       LEU  80  -0.329   9.739   1.850
  668   2HB   LEU  80          1HB       LEU  80  -1.228  10.329   3.234
  669    HG   LEU  80           HG       LEU  80  -0.155   8.030   4.242
  670   1HD1  LEU  80          1HD1      LEU  80   2.338   8.401   3.555
  671   2HD1  LEU  80          2HD1      LEU  80   1.626   9.043   2.076
  672   3HD1  LEU  80          3HD1      LEU  80   1.285   7.386   2.572
  673   1HD2  LEU  80          1HD2      LEU  80   1.332   9.461   5.467
  674   2HD2  LEU  80          2HD2      LEU  80  -0.200  10.302   5.241
  675   3HD2  LEU  80          3HD2      LEU  80   1.191  10.726   4.245
  676    H    SER  81           H        SER  81  -3.896  10.145   2.514
  677    HA   SER  81           HA       SER  81  -4.958   9.737  -0.086
  678   1HB   SER  81          2HB       SER  81  -5.988  10.814   2.136
  679   2HB   SER  81          1HB       SER  81  -5.510  12.303   1.318
  680    HG   SER  81           HG       SER  81  -7.702  11.216   0.899
  681    H    GLN  82           H        GLN  82  -4.540  10.689  -1.984
  682    HA   GLN  82           HA       GLN  82  -2.300  12.522  -2.105
  683   1HB   GLN  82          2HB       GLN  82  -2.240  12.068  -4.481
  684   2HB   GLN  82          1HB       GLN  82  -2.348  10.556  -3.593
  685   1HG   GLN  82          2HG       GLN  82  -4.987  11.252  -4.106
  686   2HG   GLN  82          1HG       GLN  82  -4.117  11.658  -5.587
  687   1HE2  GLN  82          1HE2      GLN  82  -4.690   9.074  -3.256
  688   2HE2  GLN  82          2HE2      GLN  82  -4.435   7.772  -4.366
  689    H    ASP  83           H        ASP  83  -5.375  13.034  -1.566
  690    HA   ASP  83           HA       ASP  83  -6.813  14.772  -1.753
  691   1HB   ASP  83          2HB       ASP  83  -4.173  16.031  -2.329
  692   2HB   ASP  83          1HB       ASP  83  -5.630  16.981  -2.602
  693    H    ARG  84           H        ARG  84  -8.263  14.211  -3.277
  694    HA   ARG  84           HA       ARG  84  -7.901  15.343  -5.946
  695   1HB   ARG  84          2HB       ARG  84  -8.081  12.460  -5.311
  696   2HB   ARG  84          1HB       ARG  84  -9.099  13.008  -6.635
  697   1HG   ARG  84          2HG       ARG  84  -6.355  13.997  -6.778
  698   2HG   ARG  84          1HG       ARG  84  -6.491  12.239  -6.849
  699   1HD   ARG  84          2HD       ARG  84  -7.301  12.297  -8.928
  700   2HD   ARG  84          1HD       ARG  84  -8.491  13.527  -8.501
  701    HE   ARG  84           HE       ARG  84  -5.927  13.941  -9.747
  702   1HH1  ARG  84          1HH1      ARG  84  -8.515  15.420  -7.918
  703   2HH1  ARG  84          2HH1      ARG  84  -8.114  17.031  -8.411
  704   1HH2  ARG  84          1HH2      ARG  84  -5.397  16.063 -10.399
  705   2HH2  ARG  84          2HH2      ARG  84  -6.341  17.397  -9.824
  706    H    ASN  85           H        ASN  85  -9.465  16.518  -4.107
  707    HA   ASN  85           HA       ASN  85 -11.552  17.338  -3.730
  708   1HB   ASN  85          2HB       ASN  85 -11.754  16.173  -6.457
  709   2HB   ASN  85          1HB       ASN  85 -13.265  16.570  -5.650
  710   1HD2  ASN  85          1HD2      ASN  85 -10.227  17.854  -6.831
  711   2HD2  ASN  85          2HD2      ASN  85 -10.743  19.499  -6.931
  712    H    LEU  86           H        LEU  86 -14.058  16.507  -3.786
  713    HA   LEU  86           HA       LEU  86 -14.009  13.962  -2.307
  714   1HB   LEU  86          2HB       LEU  86 -15.922  16.297  -2.165
  715   2HB   LEU  86          1HB       LEU  86 -16.172  14.779  -1.326
  716    HG   LEU  86           HG       LEU  86 -13.848  15.259  -0.257
  717   1HD1  LEU  86          1HD1      LEU  86 -13.585  17.773   0.050
  718   2HD1  LEU  86          2HD1      LEU  86 -14.619  17.941  -1.369
  719   3HD1  LEU  86          3HD1      LEU  86 -13.077  17.095  -1.496
  720   1HD2  LEU  86          1HD2      LEU  86 -15.749  15.187   1.124
  721   2HD2  LEU  86          2HD2      LEU  86 -16.424  16.654   0.415
  722   3HD2  LEU  86          3HD2      LEU  86 -15.002  16.750   1.452
  723    H    GLU  87           H        GLU  87 -13.995  13.265  -4.764
  724    HA   GLU  87           HA       GLU  87 -15.042  12.194  -6.467
  725   1HB   GLU  87          2HB       GLU  87 -16.238  11.318  -4.188
  726   2HB   GLU  87          1HB       GLU  87 -17.630  11.934  -5.069
  727   1HG   GLU  87          2HG       GLU  87 -16.212  10.463  -6.951
  728   2HG   GLU  87          1HG       GLU  87 -16.106   9.512  -5.470
  729    H    HIS  88           H        HIS  88 -17.657  12.162  -7.404
  730    HA   HIS  88           HA       HIS  88 -19.200  13.335  -8.590
  731   1HB   HIS  88          2HB       HIS  88 -18.324  15.684  -6.892
  732   2HB   HIS  88          1HB       HIS  88 -19.727  15.665  -7.952
  733    HD1  HIS  88           HD1      HIS  88 -19.209  15.647  -4.582
  734    HD2  HIS  88           HD2      HIS  88 -21.223  12.983  -7.057
  735    HE1  HIS  88           HE1      HIS  88 -20.820  14.425  -3.087
  736    HE2  HIS  88           HE2      HIS  88 -21.931  12.730  -4.584
  737    H    HIS  89           H        HIS  89 -19.160  14.198 -10.607
  738    HA   HIS  89           HA       HIS  89 -16.683  14.675 -11.855
  739   1HB   HIS  89          2HB       HIS  89 -19.477  15.332 -12.814
  740   2HB   HIS  89          1HB       HIS  89 -18.036  15.340 -13.824
  741    HD1  HIS  89           HD1      HIS  89 -16.838  12.641 -12.654
  742    HD2  HIS  89           HD2      HIS  89 -20.714  13.202 -14.044
  743    HE1  HIS  89           HE1      HIS  89 -17.658  10.354 -13.299
  744    HE2  HIS  89           HE2      HIS  89 -20.039  10.706 -14.045
  745    H    HIS  90           H        HIS  90 -15.456  16.359 -11.224
  746    HA   HIS  90           HA       HIS  90 -16.449  19.039 -11.769
  747   1HB   HIS  90          2HB       HIS  90 -16.418  18.062  -9.139
  748   2HB   HIS  90          1HB       HIS  90 -14.995  19.087  -9.259
  749    HD1  HIS  90           HD1      HIS  90 -16.596  21.064 -11.350
  750    HD2  HIS  90           HD2      HIS  90 -17.662  19.969  -7.484
  751    HE1  HIS  90           HE1      HIS  90 -18.115  22.892 -10.526
  752    HE2  HIS  90           HE2      HIS  90 -18.665  22.258  -8.152
  753    H    HIS  91           H        HIS  91 -14.497  17.294 -13.024
  754    HA   HIS  91           HA       HIS  91 -12.392  19.123 -13.422
  755   1HB   HIS  91          2HB       HIS  91 -10.536  17.598 -12.541
  756   2HB   HIS  91          1HB       HIS  91 -11.452  18.501 -11.340
  757    HD1  HIS  91           HD1      HIS  91 -12.098  15.106 -12.970
  758    HD2  HIS  91           HD2      HIS  91 -11.733  16.863  -9.221
  759    HE1  HIS  91           HE1      HIS  91 -12.550  13.267 -11.319
  760    HE2  HIS  91           HE2      HIS  91 -12.267  14.337  -9.055
  761    H    HIS  92           H        HIS  92 -10.457  17.872 -14.595
  762    HA   HIS  92           HA       HIS  92 -11.432  15.601 -16.136
  763   1HB   HIS  92          2HB       HIS  92 -12.001  17.914 -17.244
  764   2HB   HIS  92          1HB       HIS  92 -10.297  17.902 -17.691
  765    HD1  HIS  92           HD1      HIS  92 -10.021  17.080 -19.996
  766    HD2  HIS  92           HD2      HIS  92 -13.139  15.141 -18.046
  767    HE1  HIS  92           HE1      HIS  92 -10.943  15.440 -21.666
  768    HE2  HIS  92           HE2      HIS  92 -12.753  14.202 -20.426
  769    H    HIS  93           H        HIS  93  -9.559  15.265 -14.335
  770    HA   HIS  93           HA       HIS  93  -7.240  14.540 -15.859
  771   1HB   HIS  93          2HB       HIS  93  -7.165  17.077 -14.716
  772   2HB   HIS  93          1HB       HIS  93  -6.300  16.070 -13.559
  773    HD1  HIS  93           HD1      HIS  93  -5.275  18.288 -15.829
  774    HD2  HIS  93           HD2      HIS  93  -4.650  14.182 -15.666
  775    HE1  HIS  93           HE1      HIS  93  -3.207  17.867 -17.198
  776    HE2  HIS  93           HE2      HIS  93  -2.811  15.386 -17.030
  Start of MODEL   12
    1    H    GLN   1           H        GLN   1   9.056 -20.627   2.665
    2    HA   GLN   1           HA       GLN   1   6.880 -20.422   3.358
    3   1HB   GLN   1          2HB       GLN   1   6.984 -18.390   4.693
    4   2HB   GLN   1          1HB       GLN   1   8.580 -19.116   4.598
    5   1HG   GLN   1          2HG       GLN   1   9.397 -17.191   3.893
    6   2HG   GLN   1          1HG       GLN   1   8.388 -17.298   2.454
    7   1HE2  GLN   1          1HE2      GLN   1   9.250 -14.982   4.069
    8   2HE2  GLN   1          2HE2      GLN   1   7.793 -14.170   4.520
    9    H    SER   2           H        SER   2   4.795 -19.708   3.098
   10    HA   SER   2           HA       SER   2   4.314 -17.936   0.794
   11   1HB   SER   2          2HB       SER   2   2.236 -19.129   0.415
   12   2HB   SER   2          1HB       SER   2   3.550 -20.300   0.519
   13    HG   SER   2           HG       SER   2   1.372 -19.957   2.149
   14    H    ASP   3           H        ASP   3   1.872 -17.076   1.000
   15    HA   ASP   3           HA       ASP   3   0.458 -15.612   2.002
   16   1HB   ASP   3          2HB       ASP   3   0.274 -17.607   3.620
   17   2HB   ASP   3          1HB       ASP   3   1.316 -16.669   4.686
   18    H    VAL   4           H        VAL   4   1.467 -13.738   1.468
   19    HA   VAL   4           HA       VAL   4   3.682 -12.712   3.003
   20    HB   VAL   4           HB       VAL   4   2.053 -11.226   0.937
   21   1HG1  VAL   4          1HG1      VAL   4   4.807 -10.845   2.093
   22   2HG1  VAL   4          2HG1      VAL   4   3.435  -9.740   2.168
   23   3HG1  VAL   4          3HG1      VAL   4   4.250 -10.030   0.632
   24   1HG2  VAL   4          1HG2      VAL   4   4.475 -12.981   0.524
   25   2HG2  VAL   4          2HG2      VAL   4   3.748 -11.940  -0.699
   26   3HG2  VAL   4          3HG2      VAL   4   2.839 -13.305  -0.050
   27    H    ARG   5           H        ARG   5   3.548 -11.505   4.778
   28    HA   ARG   5           HA       ARG   5   0.935 -10.433   5.565
   29   1HB   ARG   5          2HB       ARG   5   2.589 -11.926   7.031
   30   2HB   ARG   5          1HB       ARG   5   3.279 -10.351   7.402
   31   1HG   ARG   5          2HG       ARG   5   0.639  -9.856   7.773
   32   2HG   ARG   5          1HG       ARG   5   0.742 -11.551   8.253
   33   1HD   ARG   5          2HD       ARG   5   2.937  -9.989   9.323
   34   2HD   ARG   5          1HD       ARG   5   1.374  -9.335   9.807
   35    HE   ARG   5           HE       ARG   5   1.027 -11.188  11.112
   36   1HH1  ARG   5          1HH1      ARG   5   3.751 -11.804   8.992
   37   2HH1  ARG   5          2HH1      ARG   5   4.202 -13.267   9.794
   38   1HH2  ARG   5          1HH2      ARG   5   1.631 -13.120  12.166
   39   2HH2  ARG   5          2HH2      ARG   5   3.001 -14.015  11.598
   40    H    ILE   6           H        ILE   6   0.553  -8.368   5.107
   41    HA   ILE   6           HA       ILE   6   2.827  -6.497   5.007
   42    HB   ILE   6           HB       ILE   6   0.114  -6.103   3.733
   43   1HG1  ILE   6          2HG1      ILE   6   1.599  -6.471   1.593
   44   2HG1  ILE   6          1HG1      ILE   6   2.624  -7.383   2.698
   45   1HG2  ILE   6          1HG2      ILE   6   0.945  -4.189   2.758
   46   2HG2  ILE   6          2HG2      ILE   6   2.624  -4.699   2.924
   47   3HG2  ILE   6          3HG2      ILE   6   1.727  -4.144   4.337
   48   1HD1  ILE   6          1HD1      ILE   6   1.309  -9.138   2.458
   49   2HD1  ILE   6          2HD1      ILE   6   0.281  -8.220   1.358
   50   3HD1  ILE   6          3HD1      ILE   6  -0.058  -8.220   3.088
   51    H    LYS   7           H        LYS   7   2.880  -4.763   6.316
   52    HA   LYS   7           HA       LYS   7   0.674  -4.449   8.226
   53   1HB   LYS   7          2HB       LYS   7   3.423  -4.576   8.600
   54   2HB   LYS   7          1HB       LYS   7   3.069  -2.861   8.744
   55   1HG   LYS   7          2HG       LYS   7   2.636  -3.340  10.880
   56   2HG   LYS   7          1HG       LYS   7   1.095  -3.946  10.270
   57   1HD   LYS   7          2HD       LYS   7   1.653  -6.102  10.632
   58   2HD   LYS   7          1HD       LYS   7   3.331  -5.857  10.146
   59   1HE   LYS   7          2HE       LYS   7   3.181  -4.429  12.480
   60   2HE   LYS   7          1HE       LYS   7   2.111  -5.793  12.805
   61   1HZ   LYS   7          1HZ       LYS   7   4.145  -7.096  11.774
   62   2HZ   LYS   7          2HZ       LYS   7   4.077  -6.706  13.418
   63   3HZ   LYS   7          3HZ       LYS   7   4.998  -5.759  12.361
   64    H    PHE   8           H        PHE   8  -0.755  -2.923   7.785
   65    HA   PHE   8           HA       PHE   8   0.077  -0.572   6.228
   66   1HB   PHE   8          2HB       PHE   8  -2.652  -1.768   6.755
   67   2HB   PHE   8          1HB       PHE   8  -2.403  -0.235   5.926
   68    HD1  PHE   8           HD2      PHE   8  -0.613  -0.414   3.931
   69    HD2  PHE   8           HD1      PHE   8  -2.966  -3.618   5.449
   70    HE1  PHE   8           HE2      PHE   8  -0.354  -1.609   1.799
   71    HE2  PHE   8           HE1      PHE   8  -2.710  -4.820   3.318
   72    HZ   PHE   8           HZ       PHE   8  -1.403  -3.816   1.488
   73    H    GLU   9           H        GLU   9   0.232   1.361   7.171
   74    HA   GLU   9           HA       GLU   9  -1.050   1.736   9.799
   75   1HB   GLU   9          2HB       GLU   9   1.617   1.646   9.453
   76   2HB   GLU   9          1HB       GLU   9   1.349   3.353   9.127
   77   1HG   GLU   9          2HG       GLU   9   0.045   3.366  11.336
   78   2HG   GLU   9          1HG       GLU   9   0.823   1.816  11.644
   79    H    HIS  10           H        HIS  10  -2.500   3.306   9.892
   80    HA   HIS  10           HA       HIS  10  -2.227   5.640   8.144
   81   1HB   HIS  10          2HB       HIS  10  -3.811   3.882   7.160
   82   2HB   HIS  10          1HB       HIS  10  -4.886   4.262   8.501
   83    HD1  HIS  10           HD1      HIS  10  -6.694   5.231   6.974
   84    HD2  HIS  10           HD2      HIS  10  -3.032   7.166   6.659
   85    HE1  HIS  10           HE1      HIS  10  -7.152   7.325   5.659
   86    HE2  HIS  10           HE2      HIS  10  -4.943   8.534   5.579
   87    H    ASN  11           H        ASN  11  -2.200   7.360   9.426
   88    HA   ASN  11           HA       ASN  11  -2.607   8.805  11.132
   89   1HB   ASN  11          2HB       ASN  11  -5.056   8.064  10.199
   90   2HB   ASN  11          1HB       ASN  11  -5.200   7.618  11.896
   91   1HD2  ASN  11          1HD2      ASN  11  -5.684  10.045   9.740
   92   2HD2  ASN  11          2HD2      ASN  11  -5.653  11.396  10.814
   93    H    GLY  12           H        GLY  12  -1.263   6.271  11.723
   94   1HA   GLY  12          2HA       GLY  12  -0.259   5.646  13.764
   95   2HA   GLY  12          1HA       GLY  12  -1.643   6.305  14.624
   96    H    GLU  13           H        GLU  13  -3.551   4.864  12.838
   97    HA   GLU  13           HA       GLU  13  -3.880   2.532  14.392
   98   1HB   GLU  13          2HB       GLU  13  -5.517   3.979  12.809
   99   2HB   GLU  13          1HB       GLU  13  -5.178   2.636  11.727
  100   1HG   GLU  13          2HG       GLU  13  -6.133   1.072  13.177
  101   2HG   GLU  13          1HG       GLU  13  -6.084   2.179  14.546
  102    H    ARG  14           H        ARG  14  -3.358   0.435  14.057
  103    HA   ARG  14           HA       ARG  14  -1.657  -0.157  11.728
  104   1HB   ARG  14          2HB       ARG  14  -1.673  -1.253  14.537
  105   2HB   ARG  14          1HB       ARG  14  -0.853  -2.084  13.221
  106   1HG   ARG  14          2HG       ARG  14   0.872  -0.669  13.249
  107   2HG   ARG  14          1HG       ARG  14  -0.170   0.746  13.409
  108   1HD   ARG  14          2HD       ARG  14  -0.438  -0.449  15.855
  109   2HD   ARG  14          1HD       ARG  14   1.244  -0.798  15.454
  110    HE   ARG  14           HE       ARG  14   0.531   1.947  15.025
  111   1HH1  ARG  14          1HH1      ARG  14   1.565  -0.367  17.448
  112   2HH1  ARG  14          2HH1      ARG  14   2.285   0.834  18.463
  113   1HH2  ARG  14          1HH2      ARG  14   1.479   3.524  16.373
  114   2HH2  ARG  14          2HH2      ARG  14   2.237   3.043  17.854
  115    H    ARG  15           H        ARG  15  -2.147  -1.819  10.393
  116    HA   ARG  15           HA       ARG  15  -4.400  -3.567  11.125
  117   1HB   ARG  15          2HB       ARG  15  -3.983  -2.522   8.328
  118   2HB   ARG  15          1HB       ARG  15  -5.389  -3.349   8.980
  119   1HG   ARG  15          2HG       ARG  15  -5.147  -1.096  10.572
  120   2HG   ARG  15          1HG       ARG  15  -4.742  -0.529   8.951
  121   1HD   ARG  15          2HD       ARG  15  -6.977  -0.308   8.769
  122   2HD   ARG  15          1HD       ARG  15  -6.901  -2.027   8.387
  123    HE   ARG  15           HE       ARG  15  -7.159  -2.021  11.073
  124   1HH1  ARG  15          1HH1      ARG  15  -8.971  -0.453   8.517
  125   2HH1  ARG  15          2HH1      ARG  15 -10.459  -0.457   9.401
  126   1HH2  ARG  15          1HH2      ARG  15  -9.127  -2.027  12.232
  127   2HH2  ARG  15          2HH2      ARG  15 -10.547  -1.349  11.510
  128    H    ILE  16           H        ILE  16  -4.169  -5.689  10.637
  129    HA   ILE  16           HA       ILE  16  -1.703  -6.485   9.226
  130    HB   ILE  16           HB       ILE  16  -3.195  -8.147  11.261
  131   1HG1  ILE  16          2HG1      ILE  16  -0.874  -7.467  12.508
  132   2HG1  ILE  16          1HG1      ILE  16  -1.211  -5.982  11.621
  133   1HG2  ILE  16          1HG2      ILE  16  -0.347  -8.433  10.342
  134   2HG2  ILE  16          2HG2      ILE  16  -1.692  -9.248   9.543
  135   3HG2  ILE  16          3HG2      ILE  16  -1.333  -9.590  11.236
  136   1HD1  ILE  16          1HD1      ILE  16  -2.103  -6.234  14.016
  137   2HD1  ILE  16          2HD1      ILE  16  -3.325  -7.276  13.290
  138   3HD1  ILE  16          3HD1      ILE  16  -3.181  -5.596  12.777
  139    H    ILE  17           H        ILE  17  -2.063  -7.330   7.274
  140    HA   ILE  17           HA       ILE  17  -4.439  -9.022   6.881
  141    HB   ILE  17           HB       ILE  17  -3.419  -7.089   4.796
  142   1HG1  ILE  17          2HG1      ILE  17  -6.015  -6.796   6.294
  143   2HG1  ILE  17          1HG1      ILE  17  -4.530  -6.079   6.908
  144   1HG2  ILE  17          1HG2      ILE  17  -5.914  -7.683   4.036
  145   2HG2  ILE  17          2HG2      ILE  17  -5.508  -9.182   4.873
  146   3HG2  ILE  17          3HG2      ILE  17  -4.508  -8.622   3.533
  147   1HD1  ILE  17          1HD1      ILE  17  -4.771  -5.366   4.181
  148   2HD1  ILE  17          2HD1      ILE  17  -4.846  -4.329   5.606
  149   3HD1  ILE  17          3HD1      ILE  17  -6.319  -5.062   4.969
  150    H    ALA  18           H        ALA  18  -4.123 -10.869   5.752
  151    HA   ALA  18           HA       ALA  18  -1.375 -11.456   4.898
  152   1HB   ALA  18          1HB       ALA  18  -3.584 -13.063   6.033
  153   2HB   ALA  18          2HB       ALA  18  -1.844 -13.172   6.300
  154   3HB   ALA  18          3HB       ALA  18  -2.557 -13.861   4.842
  155    H    PHE  19           H        PHE  19  -0.876 -11.864   2.823
  156    HA   PHE  19           HA       PHE  19  -3.084 -12.172   0.892
  157   1HB   PHE  19          2HB       PHE  19  -0.700 -10.366   0.820
  158   2HB   PHE  19          1HB       PHE  19  -1.330 -11.003  -0.695
  159    HD1  PHE  19           HD1      PHE  19  -3.649 -10.467  -1.385
  160    HD2  PHE  19           HD2      PHE  19  -1.828  -8.652   2.007
  161    HE1  PHE  19           HE1      PHE  19  -5.362  -8.702  -1.417
  162    HE2  PHE  19           HE2      PHE  19  -3.538  -6.883   1.982
  163    HZ   PHE  19           HZ       PHE  19  -5.309  -6.908   0.270
  164    H    SER  20           H        SER  20  -2.973 -13.940  -0.333
  165    HA   SER  20           HA       SER  20  -0.804 -15.781  -0.075
  166   1HB   SER  20          2HB       SER  20  -3.164 -15.822  -1.971
  167   2HB   SER  20          1HB       SER  20  -2.084 -17.178  -1.648
  168    HG   SER  20           HG       SER  20  -3.962 -15.959   0.071
  169    H    ARG  21           H        ARG  21   0.530 -16.615  -1.773
  170    HA   ARG  21           HA       ARG  21   1.301 -14.551  -3.694
  171   1HB   ARG  21          2HB       ARG  21   2.680 -16.837  -2.390
  172   2HB   ARG  21          1HB       ARG  21   3.206 -16.413  -4.013
  173   1HG   ARG  21          2HG       ARG  21   3.493 -14.055  -3.188
  174   2HG   ARG  21          1HG       ARG  21   3.223 -14.678  -1.560
  175   1HD   ARG  21          2HD       ARG  21   5.099 -16.369  -2.190
  176   2HD   ARG  21          1HD       ARG  21   5.502 -15.183  -3.431
  177    HE   ARG  21           HE       ARG  21   5.368 -13.687  -1.190
  178   1HH1  ARG  21          1HH1      ARG  21   7.101 -16.624  -1.976
  179   2HH1  ARG  21          2HH1      ARG  21   8.402 -16.293  -0.882
  180   1HH2  ARG  21          1HH2      ARG  21   7.082 -13.256   0.246
  181   2HH2  ARG  21          2HH2      ARG  21   8.391 -14.381   0.380
  182    HA   PRO  22           HA       PRO  22   2.610 -14.462  -5.477
  183   1HB   PRO  22          2HB       PRO  22   2.131 -13.547  -7.957
  184   2HB   PRO  22          1HB       PRO  22   3.104 -14.995  -7.670
  185   1HG   PRO  22          2HG       PRO  22   0.244 -14.770  -8.514
  186   2HG   PRO  22          1HG       PRO  22   1.498 -15.884  -9.089
  187   1HD   PRO  22          2HD       PRO  22  -0.429 -16.550  -7.247
  188   2HD   PRO  22          1HD       PRO  22   1.151 -17.348  -7.366
  189    H    VAL  23           H        VAL  23   2.100 -12.631  -4.441
  190    HA   VAL  23           HA       VAL  23  -0.553 -11.621  -4.324
  191    HB   VAL  23           HB       VAL  23   1.015 -11.360  -2.450
  192   1HG1  VAL  23          1HG1      VAL  23   2.884 -10.659  -4.265
  193   2HG1  VAL  23          2HG1      VAL  23   3.005 -10.304  -2.542
  194   3HG1  VAL  23          3HG1      VAL  23   2.421  -9.069  -3.657
  195   1HG2  VAL  23          1HG2      VAL  23   0.170  -8.670  -3.513
  196   2HG2  VAL  23          2HG2      VAL  23   0.393  -9.133  -1.826
  197   3HG2  VAL  23          3HG2      VAL  23  -0.927  -9.830  -2.766
  198    H    LYS  24           H        LYS  24  -1.573 -10.222  -5.601
  199    HA   LYS  24           HA       LYS  24  -0.026  -8.868  -7.699
  200   1HB   LYS  24          2HB       LYS  24  -3.026  -9.164  -7.592
  201   2HB   LYS  24          1HB       LYS  24  -2.032  -8.750  -8.981
  202   1HG   LYS  24          2HG       LYS  24  -2.165 -11.421  -7.595
  203   2HG   LYS  24          1HG       LYS  24  -2.822 -11.015  -9.181
  204   1HD   LYS  24          2HD       LYS  24   0.103 -10.695  -8.582
  205   2HD   LYS  24          1HD       LYS  24  -0.565 -12.253  -9.068
  206   1HE   LYS  24          2HE       LYS  24  -1.593 -10.956 -11.041
  207   2HE   LYS  24          1HE       LYS  24  -0.442  -9.689 -10.620
  208   1HZ   LYS  24          1HZ       LYS  24   0.611 -12.398 -10.909
  209   2HZ   LYS  24          2HZ       LYS  24   1.310 -10.915 -11.327
  210   3HZ   LYS  24          3HZ       LYS  24   0.133 -11.605 -12.326
  211    H    TYR  25           H        TYR  25  -0.289  -6.675  -8.141
  212    HA   TYR  25           HA       TYR  25  -0.580  -4.957  -5.938
  213   1HB   TYR  25          2HB       TYR  25   0.744  -4.397  -7.945
  214   2HB   TYR  25          1HB       TYR  25  -0.735  -4.295  -8.891
  215    HD1  TYR  25           HD2      TYR  25  -2.400  -2.468  -8.340
  216    HD2  TYR  25           HD1      TYR  25   1.531  -2.546  -6.709
  217    HE1  TYR  25           HE2      TYR  25  -2.583  -0.078  -7.802
  218    HE2  TYR  25           HE1      TYR  25   1.357  -0.153  -6.170
  219    HH   TYR  25           HH       TYR  25  -0.487   1.515  -5.736
  220    H    GLU  26           H        GLU  26  -2.824  -5.856  -8.523
  221    HA   GLU  26           HA       GLU  26  -4.871  -4.028  -7.925
  222   1HB   GLU  26          2HB       GLU  26  -4.472  -5.920  -9.861
  223   2HB   GLU  26          1HB       GLU  26  -5.748  -6.664  -8.907
  224   1HG   GLU  26          2HG       GLU  26  -7.173  -4.762  -9.226
  225   2HG   GLU  26          1HG       GLU  26  -5.880  -3.876 -10.030
  226    H    ASP  27           H        ASP  27  -4.316  -7.358  -6.789
  227    HA   ASP  27           HA       ASP  27  -6.683  -7.589  -5.282
  228   1HB   ASP  27          2HB       ASP  27  -4.620  -9.287  -5.902
  229   2HB   ASP  27          1HB       ASP  27  -4.355  -9.015  -4.182
  230    H    VAL  28           H        VAL  28  -3.427  -6.508  -4.369
  231    HA   VAL  28           HA       VAL  28  -3.995  -6.125  -1.622
  232    HB   VAL  28           HB       VAL  28  -1.913  -4.661  -3.260
  233   1HG1  VAL  28          1HG1      VAL  28  -1.414  -5.380  -0.444
  234   2HG1  VAL  28          2HG1      VAL  28  -2.638  -4.139  -0.712
  235   3HG1  VAL  28          3HG1      VAL  28  -1.004  -3.914  -1.334
  236   1HG2  VAL  28          1HG2      VAL  28  -0.595  -6.474  -3.299
  237   2HG2  VAL  28          2HG2      VAL  28  -2.082  -7.378  -3.025
  238   3HG2  VAL  28          3HG2      VAL  28  -1.043  -6.957  -1.665
  239    H    GLU  29           H        GLU  29  -3.974  -3.901  -4.396
  240    HA   GLU  29           HA       GLU  29  -4.677  -1.578  -2.974
  241   1HB   GLU  29          2HB       GLU  29  -3.743  -1.680  -5.311
  242   2HB   GLU  29          1HB       GLU  29  -5.335  -2.182  -5.862
  243   1HG   GLU  29          2HG       GLU  29  -6.026   0.031  -4.540
  244   2HG   GLU  29          1HG       GLU  29  -4.377   0.468  -4.979
  245    H    HIS  30           H        HIS  30  -6.674  -4.026  -4.605
  246    HA   HIS  30           HA       HIS  30  -9.147  -2.767  -4.400
  247   1HB   HIS  30          2HB       HIS  30  -8.424  -5.031  -5.526
  248   2HB   HIS  30          1HB       HIS  30  -8.958  -5.727  -4.001
  249    HD1  HIS  30           HD1      HIS  30 -11.043  -6.874  -4.843
  250    HD2  HIS  30           HD2      HIS  30 -10.907  -2.841  -5.837
  251    HE1  HIS  30           HE1      HIS  30 -13.313  -6.337  -5.782
  252    HE2  HIS  30           HE2      HIS  30 -13.168  -3.920  -6.481
  253    H    LYS  31           H        LYS  31  -7.480  -4.823  -2.032
  254    HA   LYS  31           HA       LYS  31  -9.606  -4.802  -0.137
  255   1HB   LYS  31          2HB       LYS  31  -6.726  -5.611  -0.088
  256   2HB   LYS  31          1HB       LYS  31  -7.576  -5.421   1.438
  257   1HG   LYS  31          2HG       LYS  31  -9.284  -6.945  -0.154
  258   2HG   LYS  31          1HG       LYS  31  -7.667  -7.583  -0.461
  259   1HD   LYS  31          2HD       LYS  31  -7.308  -7.898   1.918
  260   2HD   LYS  31          1HD       LYS  31  -8.874  -7.167   2.276
  261   1HE   LYS  31          2HE       LYS  31  -9.616  -9.286   2.289
  262   2HE   LYS  31          1HE       LYS  31  -9.593  -9.124   0.535
  263   1HZ   LYS  31          1HZ       LYS  31  -7.825 -10.639   2.283
  264   2HZ   LYS  31          2HZ       LYS  31  -7.089  -9.880   0.962
  265   3HZ   LYS  31          3HZ       LYS  31  -8.348 -10.981   0.712
  266    H    VAL  32           H        VAL  32  -6.528  -2.998  -0.331
  267    HA   VAL  32           HA       VAL  32  -6.914  -1.480   2.008
  268    HB   VAL  32           HB       VAL  32  -5.345  -0.637  -0.435
  269   1HG1  VAL  32          1HG1      VAL  32  -4.567   0.075   2.345
  270   2HG1  VAL  32          2HG1      VAL  32  -5.912   0.946   1.610
  271   3HG1  VAL  32          3HG1      VAL  32  -4.326   0.961   0.840
  272   1HG2  VAL  32          1HG2      VAL  32  -3.710  -2.083   0.071
  273   2HG2  VAL  32          2HG2      VAL  32  -4.943  -2.940   0.996
  274   3HG2  VAL  32          3HG2      VAL  32  -3.869  -1.802   1.804
  275    H    THR  33           H        THR  33  -7.807  -0.845  -1.362
  276    HA   THR  33           HA       THR  33  -8.673   1.805  -1.026
  277    HB   THR  33           HB       THR  33  -9.506  -0.305  -3.022
  278    HG1  THR  33           HG1      THR  33  -7.418   0.236  -3.337
  279   1HG2  THR  33          1HG2      THR  33 -10.743   2.209  -2.594
  280   2HG2  THR  33          2HG2      THR  33 -11.023   1.045  -3.887
  281   3HG2  THR  33          3HG2      THR  33  -9.802   2.301  -4.083
  282    H    THR  34           H        THR  34 -10.447  -1.273  -0.732
  283    HA   THR  34           HA       THR  34 -12.954  -0.002  -0.221
  284    HB   THR  34           HB       THR  34 -12.114  -2.836   0.421
  285    HG1  THR  34           HG1      THR  34 -12.132  -3.060  -1.655
  286   1HG2  THR  34          1HG2      THR  34 -14.657  -3.141  -0.096
  287   2HG2  THR  34          2HG2      THR  34 -14.747  -1.456   0.418
  288   3HG2  THR  34          3HG2      THR  34 -14.113  -2.679   1.518
  289    H    VAL  35           H        VAL  35 -10.476  -1.464   1.868
  290    HA   VAL  35           HA       VAL  35 -11.877  -1.180   4.293
  291    HB   VAL  35           HB       VAL  35  -8.883  -1.220   3.871
  292   1HG1  VAL  35          1HG1      VAL  35  -8.960  -0.573   6.046
  293   2HG1  VAL  35          2HG1      VAL  35  -9.201  -2.303   6.289
  294   3HG1  VAL  35          3HG1      VAL  35 -10.586  -1.211   6.296
  295   1HG2  VAL  35          1HG2      VAL  35  -8.948  -3.463   3.709
  296   2HG2  VAL  35          2HG2      VAL  35 -10.615  -3.195   3.198
  297   3HG2  VAL  35          3HG2      VAL  35 -10.264  -3.616   4.875
  298    H    PHE  36           H        PHE  36  -9.430   0.955   2.795
  299    HA   PHE  36           HA       PHE  36 -10.053   2.992   4.813
  300   1HB   PHE  36          2HB       PHE  36  -7.776   2.901   2.832
  301   2HB   PHE  36          1HB       PHE  36  -7.981   4.077   4.124
  302    HD1  PHE  36           HD1      PHE  36  -7.577   3.471   6.433
  303    HD2  PHE  36           HD2      PHE  36  -7.050   0.642   3.297
  304    HE1  PHE  36           HE1      PHE  36  -6.322   2.013   7.964
  305    HE2  PHE  36           HE2      PHE  36  -5.795  -0.821   4.823
  306    HZ   PHE  36           HZ       PHE  36  -5.431  -0.137   7.158
  307    H    GLY  37           H        GLY  37 -11.437   2.282   2.004
  308   1HA   GLY  37          2HA       GLY  37 -12.749   3.538   0.593
  309   2HA   GLY  37          1HA       GLY  37 -12.337   4.950   1.552
  310    H    GLN  38           H        GLN  38 -12.570   5.409  -1.046
  311    HA   GLN  38           HA       GLN  38  -9.785   5.676  -1.968
  312   1HB   GLN  38          2HB       GLN  38 -10.771   5.572  -4.332
  313   2HB   GLN  38          1HB       GLN  38 -10.632   4.063  -3.448
  314   1HG   GLN  38          2HG       GLN  38 -12.845   3.730  -3.416
  315   2HG   GLN  38          1HG       GLN  38 -13.200   5.429  -3.107
  316   1HE2  GLN  38          1HE2      GLN  38 -12.333   6.783  -5.170
  317   2HE2  GLN  38          2HE2      GLN  38 -13.026   6.238  -6.654
  318    HA   PRO  39           HA       PRO  39  -9.088   6.453  -3.963
  319   1HB   PRO  39          2HB       PRO  39  -7.620   8.435  -4.974
  320   2HB   PRO  39          1HB       PRO  39  -9.195   8.021  -5.663
  321   1HG   PRO  39          2HG       PRO  39  -8.436  10.300  -3.905
  322   2HG   PRO  39          1HG       PRO  39  -9.621  10.240  -5.219
  323   1HD   PRO  39          2HD       PRO  39 -10.157  10.035  -2.460
  324   2HD   PRO  39          1HD       PRO  39 -11.286   9.685  -3.782
  325    H    LEU  40           H        LEU  40  -6.930   5.939  -3.511
  326    HA   LEU  40           HA       LEU  40  -5.566   7.458  -1.405
  327   1HB   LEU  40          2HB       LEU  40  -6.231   4.526  -1.351
  328   2HB   LEU  40          1HB       LEU  40  -4.886   5.177  -0.435
  329    HG   LEU  40           HG       LEU  40  -7.717   6.158  -0.106
  330   1HD1  LEU  40          1HD1      LEU  40  -6.263   4.106   1.554
  331   2HD1  LEU  40          2HD1      LEU  40  -7.555   3.752   0.406
  332   3HD1  LEU  40          3HD1      LEU  40  -7.887   4.736   1.832
  333   1HD2  LEU  40          1HD2      LEU  40  -5.782   7.601   0.619
  334   2HD2  LEU  40          2HD2      LEU  40  -5.383   6.340   1.786
  335   3HD2  LEU  40          3HD2      LEU  40  -6.933   7.176   1.884
  336    H    ASP  41           H        ASP  41  -3.262   6.955  -1.233
  337    HA   ASP  41           HA       ASP  41  -2.157   5.967  -3.782
  338   1HB   ASP  41          2HB       ASP  41  -1.690   8.415  -2.324
  339   2HB   ASP  41          1HB       ASP  41  -0.191   7.503  -2.453
  340    H    LEU  42           H        LEU  42  -0.651   4.368  -3.740
  341    HA   LEU  42           HA       LEU  42  -0.083   3.147  -1.148
  342   1HB   LEU  42          2HB       LEU  42   0.305   2.181  -3.979
  343   2HB   LEU  42          1HB       LEU  42   0.875   1.292  -2.581
  344    HG   LEU  42           HG       LEU  42  -1.999   1.928  -3.252
  345   1HD1  LEU  42          1HD1      LEU  42  -1.682   0.107  -4.537
  346   2HD1  LEU  42          2HD1      LEU  42  -1.834  -0.756  -3.007
  347   3HD1  LEU  42          3HD1      LEU  42  -0.236  -0.393  -3.660
  348   1HD2  LEU  42          1HD2      LEU  42  -2.184   1.923  -0.992
  349   2HD2  LEU  42          2HD2      LEU  42  -0.707   0.986  -0.760
  350   3HD2  LEU  42          3HD2      LEU  42  -2.196   0.178  -1.248
  351    H    HIS  43           H        HIS  43   1.628   3.974  -0.124
  352    HA   HIS  43           HA       HIS  43   4.069   4.508  -1.683
  353   1HB   HIS  43          2HB       HIS  43   2.996   6.473  -0.541
  354   2HB   HIS  43          1HB       HIS  43   3.328   5.690   0.999
  355    HD1  HIS  43           HD1      HIS  43   5.917   5.502  -1.679
  356    HD2  HIS  43           HD2      HIS  43   5.075   7.784   1.691
  357    HE1  HIS  43           HE1      HIS  43   8.012   6.803  -1.208
  358    HE2  HIS  43           HE2      HIS  43   7.476   8.193   0.824
  359    H    TYR  44           H        TYR  44   5.849   3.362  -1.253
  360    HA   TYR  44           HA       TYR  44   5.830   1.592   1.096
  361   1HB   TYR  44          2HB       TYR  44   5.919   0.314  -0.922
  362   2HB   TYR  44          1HB       TYR  44   7.156   1.357  -1.608
  363    HD1  TYR  44           HD1      TYR  44   9.473   1.287  -0.647
  364    HD2  TYR  44           HD2      TYR  44   6.494  -1.555   0.407
  365    HE1  TYR  44           HE1      TYR  44  11.225  -0.232   0.179
  366    HE2  TYR  44           HE2      TYR  44   8.231  -3.081   1.240
  367    HH   TYR  44           HH       TYR  44  11.270  -2.997   0.479
  368    H    MET  45           H        MET  45   7.226   2.012   2.683
  369    HA   MET  45           HA       MET  45   9.655   3.556   2.055
  370   1HB   MET  45          2HB       MET  45   9.458   4.733   4.177
  371   2HB   MET  45          1HB       MET  45   8.026   4.997   3.194
  372   1HG   MET  45          2HG       MET  45   7.253   2.855   4.666
  373   2HG   MET  45          1HG       MET  45   8.320   3.684   5.798
  374   1HE   MET  45          1HE       MET  45   7.057   7.051   6.258
  375   2HE   MET  45          2HE       MET  45   6.999   7.129   4.497
  376   3HE   MET  45          3HE       MET  45   8.346   6.323   5.299
  377    H    ASN  46           H        ASN  46  11.514   2.710   2.756
  378    HA   ASN  46           HA       ASN  46  11.404   0.201   4.228
  379   1HB   ASN  46          2HB       ASN  46  12.968   1.083   2.129
  380   2HB   ASN  46          1HB       ASN  46  14.066   1.175   3.501
  381   1HD2  ASN  46          1HD2      ASN  46  13.086  -0.764   1.081
  382   2HD2  ASN  46          2HD2      ASN  46  13.426  -2.310   1.775
  383    H    ASN  47           H        ASN  47  13.699   2.936   4.442
  384    HA   ASN  47           HA       ASN  47  13.276   3.049   7.332
  385   1HB   ASN  47          2HB       ASN  47  15.981   2.622   6.037
  386   2HB   ASN  47          1HB       ASN  47  15.746   3.058   7.726
  387   1HD2  ASN  47          1HD2      ASN  47  15.259   0.566   5.316
  388   2HD2  ASN  47          2HD2      ASN  47  15.055  -0.738   6.430
  389    H    GLU  48           H        GLU  48  15.698   4.398   5.082
  390    HA   GLU  48           HA       GLU  48  14.743   7.090   5.815
  391   1HB   GLU  48          2HB       GLU  48  17.556   6.336   5.006
  392   2HB   GLU  48          1HB       GLU  48  17.005   7.907   5.566
  393   1HG   GLU  48          2HG       GLU  48  16.313   6.597   7.706
  394   2HG   GLU  48          1HG       GLU  48  17.466   5.402   7.112
  395    H    LEU  49           H        LEU  49  14.178   5.129   3.470
  396    HA   LEU  49           HA       LEU  49  14.534   7.141   1.359
  397   1HB   LEU  49          2HB       LEU  49  15.561   4.432   1.435
  398   2HB   LEU  49          1HB       LEU  49  14.490   4.665   0.066
  399    HG   LEU  49           HG       LEU  49  16.837   6.464   0.662
  400   1HD1  LEU  49          1HD1      LEU  49  17.674   4.242   0.240
  401   2HD1  LEU  49          2HD1      LEU  49  17.977   5.264  -1.165
  402   3HD1  LEU  49          3HD1      LEU  49  16.655   4.096  -1.193
  403   1HD2  LEU  49          1HD2      LEU  49  16.398   6.708  -1.960
  404   2HD2  LEU  49          2HD2      LEU  49  15.598   7.725  -0.762
  405   3HD2  LEU  49          3HD2      LEU  49  14.754   6.333  -1.442
  406    H    SER  50           H        SER  50  12.845   7.367  -0.081
  407    HA   SER  50           HA       SER  50  10.381   5.919   0.627
  408   1HB   SER  50          2HB       SER  50   9.430   8.040  -0.729
  409   2HB   SER  50          1HB       SER  50   9.737   8.083   1.006
  410    HG   SER  50           HG       SER  50  11.496   9.284   0.686
  411    H    ILE  51           H        ILE  51   9.498   4.615  -0.847
  412    HA   ILE  51           HA       ILE  51  10.299   4.939  -3.668
  413    HB   ILE  51           HB       ILE  51   9.663   2.296  -2.356
  414   1HG1  ILE  51          2HG1      ILE  51  12.289   2.082  -2.872
  415   2HG1  ILE  51          1HG1      ILE  51  12.218   3.811  -2.548
  416   1HG2  ILE  51          1HG2      ILE  51   9.392   2.662  -4.877
  417   2HG2  ILE  51          2HG2      ILE  51  10.348   1.280  -4.342
  418   3HG2  ILE  51          3HG2      ILE  51  11.155   2.738  -4.920
  419   1HD1  ILE  51          1HD1      ILE  51  12.565   3.157  -0.435
  420   2HD1  ILE  51          2HD1      ILE  51  11.953   1.528  -0.726
  421   3HD1  ILE  51          3HD1      ILE  51  10.827   2.858  -0.443
  422    H    LEU  52           H        LEU  52   8.706   5.024  -5.140
  423    HA   LEU  52           HA       LEU  52   5.946   4.692  -4.191
  424   1HB   LEU  52          2HB       LEU  52   7.011   6.823  -5.414
  425   2HB   LEU  52          1HB       LEU  52   6.525   5.916  -6.836
  426    HG   LEU  52           HG       LEU  52   4.557   6.438  -4.632
  427   1HD1  LEU  52          1HD1      LEU  52   4.128   8.569  -5.247
  428   2HD1  LEU  52          2HD1      LEU  52   4.592   8.297  -6.926
  429   3HD1  LEU  52          3HD1      LEU  52   5.834   8.536  -5.697
  430   1HD2  LEU  52          1HD2      LEU  52   4.386   4.942  -6.886
  431   2HD2  LEU  52          2HD2      LEU  52   3.779   6.492  -7.465
  432   3HD2  LEU  52          3HD2      LEU  52   3.010   5.703  -6.088
  433    H    LEU  53           H        LEU  53   4.578   3.232  -5.080
  434    HA   LEU  53           HA       LEU  53   5.682   1.487  -7.180
  435   1HB   LEU  53          2HB       LEU  53   3.371   0.713  -5.434
  436   2HB   LEU  53          1HB       LEU  53   4.507  -0.316  -6.283
  437    HG   LEU  53           HG       LEU  53   6.216   0.830  -4.572
  438   1HD1  LEU  53          1HD1      LEU  53   3.537   1.364  -3.496
  439   2HD1  LEU  53          2HD1      LEU  53   5.081   2.140  -3.148
  440   3HD1  LEU  53          3HD1      LEU  53   4.663   0.619  -2.361
  441   1HD2  LEU  53          1HD2      LEU  53   5.695  -1.143  -3.037
  442   2HD2  LEU  53          2HD2      LEU  53   6.101  -1.507  -4.714
  443   3HD2  LEU  53          3HD2      LEU  53   4.418  -1.544  -4.185
  444    H    LYS  54           H        LYS  54   4.911   2.003  -9.120
  445    HA   LYS  54           HA       LYS  54   2.151   2.967  -9.365
  446   1HB   LYS  54          2HB       LYS  54   4.640   3.421 -10.861
  447   2HB   LYS  54          1HB       LYS  54   3.223   3.183 -11.875
  448   1HG   LYS  54          2HG       LYS  54   2.501   4.966  -9.795
  449   2HG   LYS  54          1HG       LYS  54   4.037   5.511 -10.472
  450   1HD   LYS  54          2HD       LYS  54   2.610   4.881 -12.722
  451   2HD   LYS  54          1HD       LYS  54   1.353   5.500 -11.650
  452   1HE   LYS  54          2HE       LYS  54   2.041   7.450 -12.631
  453   2HE   LYS  54          1HE       LYS  54   3.109   7.414 -11.229
  454   1HZ   LYS  54          1HZ       LYS  54   4.694   6.183 -12.841
  455   2HZ   LYS  54          2HZ       LYS  54   4.554   7.865 -12.945
  456   3HZ   LYS  54          3HZ       LYS  54   3.742   6.879 -14.055
  457    H    ASN  55           H        ASN  55   4.319   0.419 -10.473
  458    HA   ASN  55           HA       ASN  55   1.979  -1.026 -11.524
  459   1HB   ASN  55          2HB       ASN  55   3.822  -0.002 -13.188
  460   2HB   ASN  55          1HB       ASN  55   4.621  -1.523 -12.803
  461   1HD2  ASN  55          1HD2      ASN  55   4.125  -3.188 -14.043
  462   2HD2  ASN  55          2HD2      ASN  55   2.692  -3.352 -14.995
  463    H    GLN  56           H        GLN  56   2.618  -3.443 -11.891
  464    HA   GLN  56           HA       GLN  56   3.130  -4.608  -9.416
  465   1HB   GLN  56          2HB       GLN  56   1.949  -5.746 -11.259
  466   2HB   GLN  56          1HB       GLN  56   3.459  -5.857 -12.154
  467   1HG   GLN  56          2HG       GLN  56   3.386  -7.937 -11.245
  468   2HG   GLN  56          1HG       GLN  56   4.276  -7.088  -9.983
  469   1HE2  GLN  56          1HE2      GLN  56   3.127  -6.432  -8.088
  470   2HE2  GLN  56          2HE2      GLN  56   1.712  -7.286  -7.589
  471    H    ASP  57           H        ASP  57   5.324  -3.775 -12.036
  472    HA   ASP  57           HA       ASP  57   7.581  -5.234 -11.341
  473   1HB   ASP  57          2HB       ASP  57   7.548  -2.408 -12.431
  474   2HB   ASP  57          1HB       ASP  57   8.876  -3.556 -12.548
  475    H    ASP  58           H        ASP  58   6.550  -2.035 -10.164
  476    HA   ASP  58           HA       ASP  58   8.765  -1.530  -8.501
  477   1HB   ASP  58          2HB       ASP  58   5.908  -0.546  -8.407
  478   2HB   ASP  58          1HB       ASP  58   7.139   0.012  -7.278
  479    H    LEU  59           H        LEU  59   5.642  -3.086  -7.847
  480    HA   LEU  59           HA       LEU  59   6.108  -3.504  -5.078
  481   1HB   LEU  59          2HB       LEU  59   3.871  -3.493  -6.192
  482   2HB   LEU  59          1HB       LEU  59   4.266  -5.047  -6.902
  483    HG   LEU  59           HG       LEU  59   4.546  -5.918  -4.532
  484   1HD1  LEU  59          1HD1      LEU  59   3.477  -4.692  -2.749
  485   2HD1  LEU  59          2HD1      LEU  59   3.064  -3.382  -3.856
  486   3HD1  LEU  59          3HD1      LEU  59   4.752  -3.704  -3.464
  487   1HD2  LEU  59          1HD2      LEU  59   2.188  -6.320  -4.271
  488   2HD2  LEU  59          2HD2      LEU  59   2.591  -6.355  -5.986
  489   3HD2  LEU  59          3HD2      LEU  59   1.799  -4.938  -5.297
  490    H    ASP  60           H        ASP  60   6.695  -5.465  -7.964
  491    HA   ASP  60           HA       ASP  60   7.331  -7.882  -6.677
  492   1HB   ASP  60          2HB       ASP  60   7.080  -7.144  -9.269
  493   2HB   ASP  60          1HB       ASP  60   8.834  -7.227  -9.147
  494    H    LYS  61           H        LYS  61   9.363  -5.127  -7.604
  495    HA   LYS  61           HA       LYS  61  11.813  -6.285  -6.775
  496   1HB   LYS  61          2HB       LYS  61  11.220  -4.124  -8.238
  497   2HB   LYS  61          1HB       LYS  61  11.478  -3.329  -6.692
  498   1HG   LYS  61          2HG       LYS  61  13.589  -3.234  -7.509
  499   2HG   LYS  61          1HG       LYS  61  13.671  -4.804  -6.710
  500   1HD   LYS  61          2HD       LYS  61  12.683  -4.879  -9.477
  501   2HD   LYS  61          1HD       LYS  61  14.355  -4.342  -9.305
  502   1HE   LYS  61          2HE       LYS  61  14.524  -6.429  -7.715
  503   2HE   LYS  61          1HE       LYS  61  13.119  -6.975  -8.630
  504   1HZ   LYS  61          1HZ       LYS  61  15.599  -7.471  -9.384
  505   2HZ   LYS  61          2HZ       LYS  61  15.389  -5.992 -10.175
  506   3HZ   LYS  61          3HZ       LYS  61  14.337  -7.277 -10.494
  507    H    ALA  62           H        ALA  62   9.331  -4.422  -5.116
  508    HA   ALA  62           HA       ALA  62  10.778  -3.754  -2.798
  509   1HB   ALA  62          1HB       ALA  62   8.364  -3.803  -1.771
  510   2HB   ALA  62          2HB       ALA  62   7.878  -3.981  -3.456
  511   3HB   ALA  62          3HB       ALA  62   8.814  -2.574  -2.952
  512    H    ILE  63           H        ILE  63   9.015  -6.678  -3.701
  513    HA   ILE  63           HA       ILE  63   9.029  -7.904  -1.146
  514    HB   ILE  63           HB       ILE  63   9.016  -9.304  -3.829
  515   1HG1  ILE  63          2HG1      ILE  63   6.528  -8.739  -2.261
  516   2HG1  ILE  63          1HG1      ILE  63   7.211  -7.457  -3.254
  517   1HG2  ILE  63          1HG2      ILE  63   7.546 -10.427  -1.537
  518   2HG2  ILE  63          2HG2      ILE  63   9.304 -10.438  -1.389
  519   3HG2  ILE  63          3HG2      ILE  63   8.531 -11.227  -2.762
  520   1HD1  ILE  63          1HD1      ILE  63   7.200  -9.432  -5.052
  521   2HD1  ILE  63          2HD1      ILE  63   5.833  -8.349  -4.792
  522   3HD1  ILE  63          3HD1      ILE  63   5.849  -9.947  -4.043
  523    H    ASP  64           H        ASP  64  11.234  -8.101  -3.926
  524    HA   ASP  64           HA       ASP  64  12.986 -10.027  -2.902
  525   1HB   ASP  64          2HB       ASP  64  12.818  -8.741  -5.259
  526   2HB   ASP  64          1HB       ASP  64  14.154  -7.843  -4.543
  527    H    ILE  65           H        ILE  65  12.960  -6.502  -2.541
  528    HA   ILE  65           HA       ILE  65  15.418  -6.315  -1.137
  529    HB   ILE  65           HB       ILE  65  13.093  -4.390  -0.965
  530   1HG1  ILE  65          2HG1      ILE  65  15.419  -3.945  -2.792
  531   2HG1  ILE  65          1HG1      ILE  65  14.153  -5.051  -3.314
  532   1HG2  ILE  65          1HG2      ILE  65  16.038  -3.861  -0.606
  533   2HG2  ILE  65          2HG2      ILE  65  14.922  -4.167   0.725
  534   3HG2  ILE  65          3HG2      ILE  65  14.699  -2.753  -0.304
  535   1HD1  ILE  65          1HD1      ILE  65  13.306  -3.155  -4.189
  536   2HD1  ILE  65          2HD1      ILE  65  14.103  -2.120  -3.002
  537   3HD1  ILE  65          3HD1      ILE  65  12.632  -2.990  -2.568
  538    H    LEU  66           H        LEU  66  12.043  -6.609  -0.073
  539    HA   LEU  66           HA       LEU  66  12.467  -6.263   2.673
  540   1HB   LEU  66          2HB       LEU  66  10.271  -6.516   1.230
  541   2HB   LEU  66          1HB       LEU  66  10.410  -8.197   1.707
  542    HG   LEU  66           HG       LEU  66  10.653  -7.105   4.124
  543   1HD1  LEU  66          1HD1      LEU  66  10.571  -4.812   3.424
  544   2HD1  LEU  66          2HD1      LEU  66   9.090  -5.187   4.304
  545   3HD1  LEU  66          3HD1      LEU  66   9.067  -5.087   2.543
  546   1HD2  LEU  66          1HD2      LEU  66   7.855  -7.128   3.196
  547   2HD2  LEU  66          2HD2      LEU  66   8.622  -8.002   4.520
  548   3HD2  LEU  66          3HD2      LEU  66   8.787  -8.588   2.865
  549    H    ASP  67           H        ASP  67  12.439  -9.239   0.714
  550    HA   ASP  67           HA       ASP  67  12.986 -10.991   2.882
  551   1HB   ASP  67          2HB       ASP  67  12.052 -11.570   0.546
  552   2HB   ASP  67          1HB       ASP  67  13.732 -11.572   0.021
  553    H    ARG  68           H        ARG  68  15.015  -9.230   0.604
  554    HA   ARG  68           HA       ARG  68  17.472 -10.477   1.243
  555   1HB   ARG  68          2HB       ARG  68  16.604  -8.057  -0.217
  556   2HB   ARG  68          1HB       ARG  68  18.238  -8.007   0.427
  557   1HG   ARG  68          2HG       ARG  68  17.474 -10.452  -1.048
  558   2HG   ARG  68          1HG       ARG  68  17.644  -8.967  -1.988
  559   1HD   ARG  68          2HD       ARG  68  19.883  -8.692  -0.748
  560   2HD   ARG  68          1HD       ARG  68  19.698 -10.396  -0.333
  561    HE   ARG  68           HE       ARG  68  19.368  -9.991  -3.123
  562   1HH1  ARG  68          1HH1      ARG  68  21.834 -10.153  -0.636
  563   2HH1  ARG  68          2HH1      ARG  68  23.075 -10.664  -1.729
  564   1HH2  ARG  68          1HH2      ARG  68  21.012 -10.664  -4.555
  565   2HH2  ARG  68          2HH2      ARG  68  22.608 -10.954  -3.952
  566    H    SER  69           H        SER  69  15.638  -7.941   2.801
  567    HA   SER  69           HA       SER  69  17.650  -6.671   4.260
  568   1HB   SER  69          2HB       SER  69  15.427  -5.729   4.163
  569   2HB   SER  69          1HB       SER  69  14.747  -7.142   4.970
  570    HG   SER  69           HG       SER  69  16.507  -5.201   6.060
  571    H    SER  70           H        SER  70  18.449  -6.927   6.349
  572    HA   SER  70           HA       SER  70  18.829  -9.622   7.195
  573   1HB   SER  70          2HB       SER  70  19.934  -8.408   9.214
  574   2HB   SER  70          1HB       SER  70  20.671  -8.251   7.620
  575    HG   SER  70           HG       SER  70  19.126  -6.370   9.050
  576    H    SER  71           H        SER  71  16.685  -7.019   8.195
  577    HA   SER  71           HA       SER  71  15.281  -8.891   9.927
  578   1HB   SER  71          2HB       SER  71  16.585  -7.860  11.588
  579   2HB   SER  71          1HB       SER  71  16.494  -6.280  10.811
  580    HG   SER  71           HG       SER  71  14.235  -6.291  11.348
  581    H    MET  72           H        MET  72  13.698  -8.872   8.285
  582    HA   MET  72           HA       MET  72  11.645  -6.961   8.637
  583   1HB   MET  72          2HB       MET  72  13.374  -5.785   7.097
  584   2HB   MET  72          1HB       MET  72  12.767  -6.871   5.853
  585   1HG   MET  72          2HG       MET  72  10.758  -5.828   5.723
  586   2HG   MET  72          1HG       MET  72  10.774  -5.340   7.416
  587   1HE   MET  72          1HE       MET  72  10.393  -2.324   4.926
  588   2HE   MET  72          2HE       MET  72  10.130  -2.336   6.670
  589   3HE   MET  72          3HE       MET  72   9.565  -3.684   5.683
  590    H    LYS  73           H        LYS  73  10.190  -8.572   8.842
  591    HA   LYS  73           HA       LYS  73  10.009 -10.596   6.728
  592   1HB   LYS  73          2HB       LYS  73   8.345 -11.677   8.320
  593   2HB   LYS  73          1HB       LYS  73  10.024 -11.646   8.834
  594   1HG   LYS  73          2HG       LYS  73   9.571 -10.399  10.633
  595   2HG   LYS  73          1HG       LYS  73   8.473  -9.341   9.744
  596   1HD   LYS  73          2HD       LYS  73   7.535 -12.101  10.244
  597   2HD   LYS  73          1HD       LYS  73   7.657 -11.043  11.651
  598   1HE   LYS  73          2HE       LYS  73   6.273 -10.156   9.141
  599   2HE   LYS  73          1HE       LYS  73   5.435 -11.112  10.360
  600   1HZ   LYS  73          1HZ       LYS  73   6.774  -8.512  10.877
  601   2HZ   LYS  73          2HZ       LYS  73   5.869  -9.414  11.988
  602   3HZ   LYS  73          3HZ       LYS  73   5.110  -8.715  10.646
  603    H    SER  74           H        SER  74   8.166  -7.996   8.235
  604    HA   SER  74           HA       SER  74   5.915  -8.494   6.426
  605   1HB   SER  74          2HB       SER  74   6.225  -7.239   9.059
  606   2HB   SER  74          1HB       SER  74   5.216  -6.306   7.954
  607    HG   SER  74           HG       SER  74   3.898  -8.103   7.688
  608    H    LEU  75           H        LEU  75   4.973  -6.664   5.246
  609    HA   LEU  75           HA       LEU  75   7.080  -4.997   4.109
  610   1HB   LEU  75          2HB       LEU  75   4.575  -6.131   3.161
  611   2HB   LEU  75          1HB       LEU  75   4.706  -4.428   2.768
  612    HG   LEU  75           HG       LEU  75   7.191  -5.603   2.095
  613   1HD1  LEU  75          1HD1      LEU  75   6.302  -7.215   0.337
  614   2HD1  LEU  75          2HD1      LEU  75   4.814  -7.247   1.283
  615   3HD1  LEU  75          3HD1      LEU  75   6.331  -7.783   2.005
  616   1HD2  LEU  75          1HD2      LEU  75   4.916  -4.762   0.304
  617   2HD2  LEU  75          2HD2      LEU  75   6.622  -4.865  -0.129
  618   3HD2  LEU  75          3HD2      LEU  75   6.080  -3.661   1.040
  619    H    ARG  76           H        ARG  76   7.326  -2.905   4.575
  620    HA   ARG  76           HA       ARG  76   5.424  -1.620   6.350
  621   1HB   ARG  76          2HB       ARG  76   8.196  -1.479   6.028
  622   2HB   ARG  76          1HB       ARG  76   7.610   0.074   5.451
  623   1HG   ARG  76          2HG       ARG  76   6.196  -0.208   7.755
  624   2HG   ARG  76          1HG       ARG  76   7.709  -1.015   8.164
  625   1HD   ARG  76          2HD       ARG  76   8.972   0.902   7.843
  626   2HD   ARG  76          1HD       ARG  76   7.748   1.658   6.823
  627    HE   ARG  76           HE       ARG  76   6.724   2.476   8.699
  628   1HH1  ARG  76          1HH1      ARG  76   9.033   0.021   9.665
  629   2HH1  ARG  76          2HH1      ARG  76   8.878   0.362  11.354
  630   1HH2  ARG  76          1HH2      ARG  76   6.520   2.919  10.930
  631   2HH2  ARG  76          2HH2      ARG  76   7.448   2.008  12.074
  632    H    ILE  77           H        ILE  77   3.642  -1.336   4.965
  633    HA   ILE  77           HA       ILE  77   4.020   0.531   2.727
  634    HB   ILE  77           HB       ILE  77   1.547  -1.087   3.343
  635   1HG1  ILE  77          2HG1      ILE  77   3.432  -2.596   2.890
  636   2HG1  ILE  77          1HG1      ILE  77   2.266  -2.624   1.570
  637   1HG2  ILE  77          1HG2      ILE  77   0.741   0.458   1.906
  638   2HG2  ILE  77          2HG2      ILE  77   1.454  -0.616   0.706
  639   3HG2  ILE  77          3HG2      ILE  77   2.329   0.822   1.230
  640   1HD1  ILE  77          1HD1      ILE  77   4.384  -2.614   0.566
  641   2HD1  ILE  77          2HD1      ILE  77   4.975  -1.340   1.633
  642   3HD1  ILE  77          3HD1      ILE  77   3.776  -0.967   0.395
  643    H    LEU  78           H        LEU  78   3.322   2.562   2.858
  644    HA   LEU  78           HA       LEU  78   1.538   3.280   5.089
  645   1HB   LEU  78          2HB       LEU  78   3.844   4.196   5.235
  646   2HB   LEU  78          1HB       LEU  78   3.581   5.029   3.714
  647    HG   LEU  78           HG       LEU  78   1.465   5.718   5.518
  648   1HD1  LEU  78          1HD1      LEU  78   3.983   6.721   6.683
  649   2HD1  LEU  78          2HD1      LEU  78   3.565   5.047   7.047
  650   3HD1  LEU  78          3HD1      LEU  78   2.441   6.344   7.451
  651   1HD2  LEU  78          1HD2      LEU  78   2.297   7.001   3.563
  652   2HD2  LEU  78          2HD2      LEU  78   3.757   7.378   4.478
  653   3HD2  LEU  78          3HD2      LEU  78   2.190   7.959   5.040
  654    H    LEU  79           H        LEU  79  -0.430   3.842   4.491
  655    HA   LEU  79           HA       LEU  79  -0.846   4.911   1.781
  656   1HB   LEU  79          2HB       LEU  79  -3.298   4.282   2.307
  657   2HB   LEU  79          1HB       LEU  79  -2.164   3.015   1.884
  658    HG   LEU  79           HG       LEU  79  -2.407   3.531   4.775
  659   1HD1  LEU  79          1HD1      LEU  79  -4.642   1.964   3.612
  660   2HD1  LEU  79          2HD1      LEU  79  -4.769   3.723   3.595
  661   3HD1  LEU  79          3HD1      LEU  79  -4.555   2.870   5.123
  662   1HD2  LEU  79          1HD2      LEU  79  -1.941   1.302   2.910
  663   2HD2  LEU  79          2HD2      LEU  79  -2.826   0.896   4.380
  664   3HD2  LEU  79          3HD2      LEU  79  -1.229   1.634   4.489
  665    H    LEU  80           H        LEU  80  -1.638   6.910   1.510
  666    HA   LEU  80           HA       LEU  80  -2.682   8.320   3.876
  667   1HB   LEU  80          2HB       LEU  80  -1.633  10.390   2.975
  668   2HB   LEU  80          1HB       LEU  80  -0.488   9.177   3.512
  669    HG   LEU  80           HG       LEU  80  -0.591   8.539   0.900
  670   1HD1  LEU  80          1HD1      LEU  80  -0.989  11.526   0.951
  671   2HD1  LEU  80          2HD1      LEU  80  -2.197  10.356   0.419
  672   3HD1  LEU  80          3HD1      LEU  80  -0.681  10.522  -0.465
  673   1HD2  LEU  80          1HD2      LEU  80   1.148  10.847   1.537
  674   2HD2  LEU  80          2HD2      LEU  80   1.551   9.279   0.838
  675   3HD2  LEU  80          3HD2      LEU  80   1.287   9.428   2.576
  676    H    SER  81           H        SER  81  -4.252   9.933   3.500
  677    HA   SER  81           HA       SER  81  -6.122   9.318   1.472
  678   1HB   SER  81          2HB       SER  81  -7.039  11.685   2.294
  679   2HB   SER  81          1HB       SER  81  -7.195  10.236   3.284
  680    HG   SER  81           HG       SER  81  -5.952  11.136   4.711
  681    H    GLN  82           H        GLN  82  -6.761  10.473  -0.358
  682    HA   GLN  82           HA       GLN  82  -4.636  11.929  -1.642
  683   1HB   GLN  82          2HB       GLN  82  -6.269  10.156  -2.678
  684   2HB   GLN  82          1HB       GLN  82  -7.317  11.549  -2.905
  685   1HG   GLN  82          2HG       GLN  82  -6.186  11.362  -4.920
  686   2HG   GLN  82          1HG       GLN  82  -5.314  12.635  -4.069
  687   1HE2  GLN  82          1HE2      GLN  82  -3.264  12.163  -3.187
  688   2HE2  GLN  82          2HE2      GLN  82  -2.329  10.828  -3.758
  689    H    ASP  83           H        ASP  83  -6.724  12.959   0.511
  690    HA   ASP  83           HA       ASP  83  -7.582  15.395  -0.833
  691   1HB   ASP  83          2HB       ASP  83  -8.254  14.067   1.757
  692   2HB   ASP  83          1HB       ASP  83  -8.500  15.804   1.620
  693    H    ARG  84           H        ARG  84  -4.910  15.397  -0.831
  694    HA   ARG  84           HA       ARG  84  -4.115  17.190   1.365
  695   1HB   ARG  84          2HB       ARG  84  -2.806  15.095   1.227
  696   2HB   ARG  84          1HB       ARG  84  -2.360  15.485  -0.428
  697   1HG   ARG  84          2HG       ARG  84  -0.907  17.144   0.207
  698   2HG   ARG  84          1HG       ARG  84  -1.734  17.430   1.739
  699   1HD   ARG  84          2HD       ARG  84  -0.450  15.954   2.812
  700   2HD   ARG  84          1HD       ARG  84  -0.677  14.734   1.560
  701    HE   ARG  84           HE       ARG  84   1.342  15.321   0.667
  702   1HH1  ARG  84          1HH1      ARG  84   0.322  17.879   2.842
  703   2HH1  ARG  84          2HH1      ARG  84   1.832  18.720   2.756
  704   1HH2  ARG  84          1HH2      ARG  84   3.325  16.442   0.554
  705   2HH2  ARG  84          2HH2      ARG  84   3.538  17.904   1.455
  706    H    ASN  85           H        ASN  85  -5.530  18.544  -0.308
  707    HA   ASN  85           HA       ASN  85  -4.173  19.466  -2.646
  708   1HB   ASN  85          2HB       ASN  85  -6.752  19.535  -1.906
  709   2HB   ASN  85          1HB       ASN  85  -6.282  21.159  -1.409
  710   1HD2  ASN  85          1HD2      ASN  85  -5.737  22.673  -2.958
  711   2HD2  ASN  85          2HD2      ASN  85  -6.016  22.425  -4.645
  712    H    LEU  86           H        LEU  86  -2.259  20.424  -2.351
  713    HA   LEU  86           HA       LEU  86  -2.131  22.686  -0.467
  714   1HB   LEU  86          2HB       LEU  86  -0.484  20.377  -0.660
  715   2HB   LEU  86          1HB       LEU  86   0.482  21.759  -1.144
  716    HG   LEU  86           HG       LEU  86  -0.475  22.825   1.060
  717   1HD1  LEU  86          1HD1      LEU  86  -1.928  21.361   2.002
  718   2HD1  LEU  86          2HD1      LEU  86  -0.443  20.757   2.736
  719   3HD1  LEU  86          3HD1      LEU  86  -1.122  19.946   1.325
  720   1HD2  LEU  86          1HD2      LEU  86   1.541  20.756   1.666
  721   2HD2  LEU  86          2HD2      LEU  86   1.581  22.498   1.938
  722   3HD2  LEU  86          3HD2      LEU  86   1.912  21.846   0.334
  723    H    GLU  87           H        GLU  87  -0.786  21.421  -3.525
  724    HA   GLU  87           HA       GLU  87   0.016  24.099  -4.333
  725   1HB   GLU  87          2HB       GLU  87   1.547  22.235  -4.762
  726   2HB   GLU  87          1HB       GLU  87   0.320  21.434  -5.734
  727   1HG   GLU  87          2HG       GLU  87   0.779  22.657  -7.542
  728   2HG   GLU  87          1HG       GLU  87   0.910  24.152  -6.618
  729    H    HIS  88           H        HIS  88  -0.968  25.319  -5.864
  730    HA   HIS  88           HA       HIS  88  -3.421  24.222  -7.073
  731   1HB   HIS  88          2HB       HIS  88  -3.235  26.390  -5.411
  732   2HB   HIS  88          1HB       HIS  88  -3.143  27.154  -6.995
  733    HD1  HIS  88           HD1      HIS  88  -5.534  26.137  -4.562
  734    HD2  HIS  88           HD2      HIS  88  -5.423  26.156  -8.717
  735    HE1  HIS  88           HE1      HIS  88  -7.934  25.993  -5.300
  736    HE2  HIS  88           HE2      HIS  88  -7.834  25.906  -7.815
  737    H    HIS  89           H        HIS  89  -3.070  23.703  -9.130
  738    HA   HIS  89           HA       HIS  89  -1.255  25.366 -10.736
  739   1HB   HIS  89          2HB       HIS  89  -2.102  22.499 -10.877
  740   2HB   HIS  89          1HB       HIS  89  -1.587  23.308 -12.352
  741    HD1  HIS  89           HD1      HIS  89   0.032  20.962 -11.186
  742    HD2  HIS  89           HD2      HIS  89   0.822  24.964 -10.393
  743    HE1  HIS  89           HE1      HIS  89   2.453  21.048 -10.510
  744    HE2  HIS  89           HE2      HIS  89   2.899  23.474  -9.995
  745    H    HIS  90           H        HIS  90  -1.895  26.317 -12.627
  746    HA   HIS  90           HA       HIS  90  -4.430  25.780 -13.847
  747   1HB   HIS  90          2HB       HIS  90  -4.417  27.668 -11.746
  748   2HB   HIS  90          1HB       HIS  90  -4.520  28.598 -13.235
  749    HD1  HIS  90           HD1      HIS  90  -6.962  29.196 -12.302
  750    HD2  HIS  90           HD2      HIS  90  -6.376  25.260 -13.494
  751    HE1  HIS  90           HE1      HIS  90  -9.266  28.227 -12.578
  752    HE2  HIS  90           HE2      HIS  90  -8.884  25.880 -13.407
  753    H    HIS  91           H        HIS  91  -3.136  25.477 -15.682
  754    HA   HIS  91           HA       HIS  91  -1.742  27.846 -16.718
  755   1HB   HIS  91          2HB       HIS  91  -0.966  25.186 -16.603
  756   2HB   HIS  91          1HB       HIS  91  -1.457  25.393 -18.281
  757    HD1  HIS  91           HD1      HIS  91   0.314  27.989 -16.158
  758    HD2  HIS  91           HD2      HIS  91   1.012  25.546 -19.448
  759    HE1  HIS  91           HE1      HIS  91   2.547  28.704 -17.065
  760    HE2  HIS  91           HE2      HIS  91   2.916  27.262 -19.098
  761    H    HIS  92           H        HIS  92  -4.620  27.681 -16.754
  762    HA   HIS  92           HA       HIS  92  -5.044  28.169 -19.573
  763   1HB   HIS  92          2HB       HIS  92  -5.519  25.710 -19.212
  764   2HB   HIS  92          1HB       HIS  92  -6.836  26.191 -18.147
  765    HD1  HIS  92           HD1      HIS  92  -8.836  27.521 -19.304
  766    HD2  HIS  92           HD2      HIS  92  -6.106  25.753 -21.893
  767    HE1  HIS  92           HE1      HIS  92  -9.971  27.469 -21.547
  768    HE2  HIS  92           HE2      HIS  92  -8.250  26.519 -23.121
  769    H    HIS  93           H        HIS  93  -5.526  30.282 -19.121
  770    HA   HIS  93           HA       HIS  93  -7.702  30.822 -17.225
  771   1HB   HIS  93          2HB       HIS  93  -5.311  32.026 -17.330
  772   2HB   HIS  93          1HB       HIS  93  -6.170  33.050 -18.473
  773    HD1  HIS  93           HD1      HIS  93  -5.266  33.157 -15.137
  774    HD2  HIS  93           HD2      HIS  93  -8.909  33.678 -17.066
  775    HE1  HIS  93           HE1      HIS  93  -6.686  34.484 -13.542
  776    HE2  HIS  93           HE2      HIS  93  -8.864  34.844 -14.758
  Start of MODEL   13
    1    H    GLN   1           H        GLN   1   7.914 -19.321  -0.555
    2    HA   GLN   1           HA       GLN   1   8.283 -19.635   2.343
    3   1HB   GLN   1          2HB       GLN   1   9.696 -17.861   1.104
    4   2HB   GLN   1          1HB       GLN   1   8.169 -17.031   0.839
    5   1HG   GLN   1          2HG       GLN   1   8.168 -16.203   2.897
    6   2HG   GLN   1          1HG       GLN   1   8.468 -17.789   3.607
    7   1HE2  GLN   1          1HE2      GLN   1   9.985 -14.958   2.197
    8   2HE2  GLN   1          2HE2      GLN   1  11.534 -15.190   2.923
    9    H    SER   2           H        SER   2   6.498 -17.672  -0.038
   10    HA   SER   2           HA       SER   2   4.287 -17.223  -0.311
   11   1HB   SER   2          2HB       SER   2   3.750 -19.545   1.552
   12   2HB   SER   2          1HB       SER   2   2.625 -18.826   0.404
   13    HG   SER   2           HG       SER   2   4.683 -20.621  -0.013
   14    H    ASP   3           H        ASP   3   2.221 -16.716   1.048
   15    HA   ASP   3           HA       ASP   3   1.212 -15.473   2.657
   16   1HB   ASP   3          2HB       ASP   3   3.469 -16.239   4.512
   17   2HB   ASP   3          1HB       ASP   3   1.842 -15.731   4.952
   18    H    VAL   4           H        VAL   4   1.312 -13.402   2.045
   19    HA   VAL   4           HA       VAL   4   3.793 -11.903   2.584
   20    HB   VAL   4           HB       VAL   4   1.580 -11.089   0.693
   21   1HG1  VAL   4          1HG1      VAL   4   4.163  -9.931   1.539
   22   2HG1  VAL   4          2HG1      VAL   4   2.680  -9.138   1.006
   23   3HG1  VAL   4          3HG1      VAL   4   3.783  -9.834  -0.182
   24   1HG2  VAL   4          1HG2      VAL   4   2.766 -13.242   0.069
   25   2HG2  VAL   4          2HG2      VAL   4   4.229 -12.271  -0.106
   26   3HG2  VAL   4          3HG2      VAL   4   2.826 -11.943  -1.123
   27    H    ARG   5           H        ARG   5   3.527 -11.120   4.618
   28    HA   ARG   5           HA       ARG   5   0.990  -9.940   5.423
   29   1HB   ARG   5          2HB       ARG   5   3.583 -10.282   6.947
   30   2HB   ARG   5          1HB       ARG   5   2.085  -9.661   7.626
   31   1HG   ARG   5          2HG       ARG   5   1.027 -11.864   6.969
   32   2HG   ARG   5          1HG       ARG   5   2.664 -12.441   6.649
   33   1HD   ARG   5          2HD       ARG   5   3.109 -12.695   8.826
   34   2HD   ARG   5          1HD       ARG   5   2.431 -11.118   9.228
   35    HE   ARG   5           HE       ARG   5   0.420 -13.074   8.659
   36   1HH1  ARG   5          1HH1      ARG   5   2.553 -11.866  11.160
   37   2HH1  ARG   5          2HH1      ARG   5   1.541 -12.413  12.455
   38   1HH2  ARG   5          1HH2      ARG   5  -0.905 -13.791  10.369
   39   2HH2  ARG   5          2HH2      ARG   5  -0.420 -13.504  12.007
   40    H    ILE   6           H        ILE   6   0.602  -7.938   4.716
   41    HA   ILE   6           HA       ILE   6   2.820  -6.006   4.615
   42    HB   ILE   6           HB       ILE   6   0.111  -5.740   3.305
   43   1HG1  ILE   6          2HG1      ILE   6   2.562  -6.303   1.706
   44   2HG1  ILE   6          1HG1      ILE   6   1.838  -7.652   2.573
   45   1HG2  ILE   6          1HG2      ILE   6   0.997  -3.905   2.133
   46   2HG2  ILE   6          2HG2      ILE   6   2.650  -4.291   2.610
   47   3HG2  ILE   6          3HG2      ILE   6   1.509  -3.676   3.805
   48   1HD1  ILE   6          1HD1      ILE   6   1.121  -6.677   0.078
   49   2HD1  ILE   6          2HD1      ILE   6  -0.165  -6.140   1.158
   50   3HD1  ILE   6          3HD1      ILE   6   0.242  -7.854   1.053
   51    H    LYS   7           H        LYS   7   2.813  -4.204   5.841
   52    HA   LYS   7           HA       LYS   7   0.562  -3.849   7.695
   53   1HB   LYS   7          2HB       LYS   7   3.327  -2.651   7.916
   54   2HB   LYS   7          1HB       LYS   7   2.082  -2.690   9.155
   55   1HG   LYS   7          2HG       LYS   7   2.661  -5.359   8.290
   56   2HG   LYS   7          1HG       LYS   7   4.155  -4.528   8.729
   57   1HD   LYS   7          2HD       LYS   7   2.728  -3.777  10.812
   58   2HD   LYS   7          1HD       LYS   7   1.797  -5.220  10.411
   59   1HE   LYS   7          2HE       LYS   7   4.070  -6.420  10.355
   60   2HE   LYS   7          1HE       LYS   7   4.681  -5.002  11.209
   61   1HZ   LYS   7          1HZ       LYS   7   2.630  -6.934  12.116
   62   2HZ   LYS   7          2HZ       LYS   7   2.833  -5.427  12.858
   63   3HZ   LYS   7          3HZ       LYS   7   4.100  -6.547  12.856
   64    H    PHE   8           H        PHE   8  -0.801  -2.241   7.355
   65    HA   PHE   8           HA       PHE   8   0.058   0.029   5.683
   66   1HB   PHE   8          2HB       PHE   8  -2.717  -1.074   6.195
   67   2HB   PHE   8          1HB       PHE   8  -2.366   0.357   5.229
   68    HD1  PHE   8           HD2      PHE   8  -2.010  -3.304   5.408
   69    HD2  PHE   8           HD1      PHE   8  -1.564   0.176   2.995
   70    HE1  PHE   8           HE2      PHE   8  -1.713  -4.724   3.420
   71    HE2  PHE   8           HE1      PHE   8  -1.265  -1.239   1.005
   72    HZ   PHE   8           HZ       PHE   8  -1.338  -3.691   1.215
   73    H    GLU   9           H        GLU   9  -0.152   2.098   6.403
   74    HA   GLU   9           HA       GLU   9  -1.197   2.449   9.137
   75   1HB   GLU   9          2HB       GLU   9   1.394   2.758   8.454
   76   2HB   GLU   9          1HB       GLU   9   0.806   4.383   8.124
   77   1HG   GLU   9          2HG       GLU   9  -0.261   4.121  10.515
   78   2HG   GLU   9          1HG       GLU   9   1.023   2.929  10.703
   79    H    HIS  10           H        HIS  10  -2.827   3.815   9.361
   80    HA   HIS  10           HA       HIS  10  -3.172   5.998   7.434
   81   1HB   HIS  10          2HB       HIS  10  -4.603   4.007   6.807
   82   2HB   HIS  10          1HB       HIS  10  -5.461   4.239   8.327
   83    HD1  HIS  10           HD1      HIS  10  -7.657   5.194   7.729
   84    HD2  HIS  10           HD2      HIS  10  -4.570   6.964   5.583
   85    HE1  HIS  10           HE1      HIS  10  -8.741   7.006   6.365
   86    HE2  HIS  10           HE2      HIS  10  -6.841   8.122   5.142
   87    H    ASN  11           H        ASN  11  -3.354   7.853   8.496
   88    HA   ASN  11           HA       ASN  11  -3.745   9.398  10.118
   89   1HB   ASN  11          2HB       ASN  11  -6.102   8.137   9.754
   90   2HB   ASN  11          1HB       ASN  11  -5.837   7.776  11.457
   91   1HD2  ASN  11          1HD2      ASN  11  -7.952   9.337  10.532
   92   2HD2  ASN  11          2HD2      ASN  11  -7.734  10.955  11.100
   93    H    GLY  12           H        GLY  12  -1.798   7.278  10.642
   94   1HA   GLY  12          2HA       GLY  12  -0.331   7.120  12.485
   95   2HA   GLY  12          1HA       GLY  12  -1.646   7.613  13.544
   96    H    GLU  13           H        GLU  13  -3.564   5.697  12.545
   97    HA   GLU  13           HA       GLU  13  -2.941   3.500  14.216
   98   1HB   GLU  13          2HB       GLU  13  -5.239   4.531  13.166
   99   2HB   GLU  13          1HB       GLU  13  -5.037   3.088  12.183
  100   1HG   GLU  13          2HG       GLU  13  -5.251   1.663  14.001
  101   2HG   GLU  13          1HG       GLU  13  -4.849   2.928  15.163
  102    H    ARG  14           H        ARG  14  -2.465   1.358  13.726
  103    HA   ARG  14           HA       ARG  14  -1.367   0.916  11.026
  104   1HB   ARG  14          2HB       ARG  14  -0.546  -0.559  13.527
  105   2HB   ARG  14          1HB       ARG  14   0.263  -0.549  11.968
  106   1HG   ARG  14          2HG       ARG  14   0.835   1.815  12.292
  107   2HG   ARG  14          1HG       ARG  14   0.049   1.777  13.871
  108   1HD   ARG  14          2HD       ARG  14   2.302  -0.071  13.116
  109   2HD   ARG  14          1HD       ARG  14   2.566   1.501  13.863
  110    HE   ARG  14           HE       ARG  14   1.684   0.693  15.859
  111   1HH1  ARG  14          1HH1      ARG  14   1.489  -1.750  13.347
  112   2HH1  ARG  14          2HH1      ARG  14   1.147  -3.036  14.454
  113   1HH2  ARG  14          1HH2      ARG  14   1.233  -1.013  17.309
  114   2HH2  ARG  14          2HH2      ARG  14   1.001  -2.619  16.700
  115    H    ARG  15           H        ARG  15  -1.721  -1.062   9.990
  116    HA   ARG  15           HA       ARG  15  -3.609  -2.922  11.258
  117   1HB   ARG  15          2HB       ARG  15  -4.275  -1.130   9.168
  118   2HB   ARG  15          1HB       ARG  15  -4.196  -2.735   8.454
  119   1HG   ARG  15          2HG       ARG  15  -5.622  -2.722  10.984
  120   2HG   ARG  15          1HG       ARG  15  -6.340  -1.637   9.793
  121   1HD   ARG  15          2HD       ARG  15  -7.118  -3.338   8.572
  122   2HD   ARG  15          1HD       ARG  15  -5.576  -4.188   8.633
  123    HE   ARG  15           HE       ARG  15  -6.730  -4.514  11.121
  124   1HH1  ARG  15          1HH1      ARG  15  -7.551  -5.337   7.817
  125   2HH1  ARG  15          2HH1      ARG  15  -8.462  -6.740   8.264
  126   1HH2  ARG  15          1HH2      ARG  15  -7.929  -6.368  11.699
  127   2HH2  ARG  15          2HH2      ARG  15  -8.675  -7.324  10.464
  128    H    ILE  16           H        ILE  16  -3.226  -5.036  10.862
  129    HA   ILE  16           HA       ILE  16  -1.067  -5.691   8.963
  130    HB   ILE  16           HB       ILE  16  -1.774  -7.280  11.432
  131   1HG1  ILE  16          2HG1      ILE  16   0.656  -6.221  12.003
  132   2HG1  ILE  16          1HG1      ILE  16  -0.055  -4.889  11.097
  133   1HG2  ILE  16          1HG2      ILE  16  -0.587  -8.347   9.439
  134   2HG2  ILE  16          2HG2      ILE  16   0.163  -8.530  11.024
  135   3HG2  ILE  16          3HG2      ILE  16   0.796  -7.345   9.883
  136   1HD1  ILE  16          1HD1      ILE  16  -1.086  -6.158  13.616
  137   2HD1  ILE  16          2HD1      ILE  16  -2.017  -5.015  12.649
  138   3HD1  ILE  16          3HD1      ILE  16  -0.500  -4.510  13.389
  139    H    ILE  17           H        ILE  17  -1.749  -6.807   7.245
  140    HA   ILE  17           HA       ILE  17  -3.965  -8.720   7.595
  141    HB   ILE  17           HB       ILE  17  -3.539  -7.034   5.124
  142   1HG1  ILE  17          2HG1      ILE  17  -5.986  -6.644   6.723
  143   2HG1  ILE  17          1HG1      ILE  17  -4.509  -6.081   7.496
  144   1HG2  ILE  17          1HG2      ILE  17  -4.646  -8.878   4.346
  145   2HG2  ILE  17          2HG2      ILE  17  -6.014  -7.883   4.842
  146   3HG2  ILE  17          3HG2      ILE  17  -5.448  -9.186   5.886
  147   1HD1  ILE  17          1HD1      ILE  17  -4.478  -5.192   4.806
  148   2HD1  ILE  17          2HD1      ILE  17  -4.583  -4.238   6.285
  149   3HD1  ILE  17          3HD1      ILE  17  -6.054  -4.811   5.500
  150    H    ALA  18           H        ALA  18  -3.704 -10.701   6.694
  151    HA   ALA  18           HA       ALA  18  -1.099 -11.310   5.533
  152   1HB   ALA  18          1HB       ALA  18  -1.424 -13.490   6.182
  153   2HB   ALA  18          2HB       ALA  18  -3.178 -13.394   6.017
  154   3HB   ALA  18          3HB       ALA  18  -2.380 -12.640   7.397
  155    H    PHE  19           H        PHE  19  -0.775 -12.208   3.512
  156    HA   PHE  19           HA       PHE  19  -3.110 -12.376   1.726
  157   1HB   PHE  19          2HB       PHE  19  -0.597 -10.798   1.388
  158   2HB   PHE  19          1HB       PHE  19  -1.324 -11.524  -0.041
  159    HD1  PHE  19           HD2      PHE  19  -2.073  -9.297   2.836
  160    HD2  PHE  19           HD1      PHE  19  -3.091 -10.475  -1.127
  161    HE1  PHE  19           HE2      PHE  19  -3.646  -7.411   2.682
  162    HE2  PHE  19           HE1      PHE  19  -4.665  -8.592  -1.286
  163    HZ   PHE  19           HZ       PHE  19  -4.946  -7.057   0.619
  164    H    SER  20           H        SER  20  -3.179 -14.132   0.438
  165    HA   SER  20           HA       SER  20  -1.047 -16.099   0.711
  166   1HB   SER  20          2HB       SER  20  -3.732 -16.396   0.733
  167   2HB   SER  20          1HB       SER  20  -3.413 -16.702  -0.974
  168    HG   SER  20           HG       SER  20  -2.836 -18.616  -0.354
  169    H    ARG  21           H        ARG  21   0.361 -16.653  -0.856
  170    HA   ARG  21           HA       ARG  21   0.453 -15.057  -3.253
  171   1HB   ARG  21          2HB       ARG  21   2.254 -17.070  -1.969
  172   2HB   ARG  21          1HB       ARG  21   2.493 -16.673  -3.666
  173   1HG   ARG  21          2HG       ARG  21   2.583 -14.247  -2.941
  174   2HG   ARG  21          1HG       ARG  21   2.693 -14.855  -1.286
  175   1HD   ARG  21          2HD       ARG  21   4.684 -16.169  -1.951
  176   2HD   ARG  21          1HD       ARG  21   4.597 -15.439  -3.555
  177    HE   ARG  21           HE       ARG  21   4.692 -13.285  -1.954
  178   1HH1  ARG  21          1HH1      ARG  21   6.684 -16.159  -2.126
  179   2HH1  ARG  21          2HH1      ARG  21   8.092 -15.367  -1.508
  180   1HH2  ARG  21          1HH2      ARG  21   6.546 -12.249  -1.141
  181   2HH2  ARG  21          2HH2      ARG  21   8.014 -13.147  -0.945
  182    HA   PRO  22           HA       PRO  22   1.773 -15.454  -5.265
  183   1HB   PRO  22          2HB       PRO  22   0.290 -15.202  -7.765
  184   2HB   PRO  22          1HB       PRO  22   1.965 -15.697  -7.509
  185   1HG   PRO  22          2HG       PRO  22   0.046 -17.413  -8.345
  186   2HG   PRO  22          1HG       PRO  22   1.419 -17.922  -7.349
  187   1HD   PRO  22          2HD       PRO  22  -1.406 -17.344  -6.527
  188   2HD   PRO  22          1HD       PRO  22  -0.330 -18.662  -6.012
  189    H    VAL  23           H        VAL  23   1.510 -13.444  -4.533
  190    HA   VAL  23           HA       VAL  23  -1.072 -12.280  -4.182
  191    HB   VAL  23           HB       VAL  23   0.766 -11.850  -2.601
  192   1HG1  VAL  23          1HG1      VAL  23   2.621 -11.753  -4.174
  193   2HG1  VAL  23          2HG1      VAL  23   2.565 -10.297  -3.184
  194   3HG1  VAL  23          3HG1      VAL  23   1.987 -10.255  -4.849
  195   1HG2  VAL  23          1HG2      VAL  23  -0.038  -9.253  -3.887
  196   2HG2  VAL  23          2HG2      VAL  23   0.260  -9.584  -2.180
  197   3HG2  VAL  23          3HG2      VAL  23  -1.168 -10.252  -2.972
  198    H    LYS  24           H        LYS  24  -2.049 -10.601  -5.256
  199    HA   LYS  24           HA       LYS  24  -0.793  -9.770  -7.792
  200   1HB   LYS  24          2HB       LYS  24  -3.714 -10.246  -7.168
  201   2HB   LYS  24          1HB       LYS  24  -3.134  -9.503  -8.653
  202   1HG   LYS  24          2HG       LYS  24  -2.446 -12.282  -7.714
  203   2HG   LYS  24          1HG       LYS  24  -3.662 -11.882  -8.930
  204   1HD   LYS  24          2HD       LYS  24  -1.961 -10.941 -10.372
  205   2HD   LYS  24          1HD       LYS  24  -0.728 -11.207  -9.139
  206   1HE   LYS  24          2HE       LYS  24  -0.381 -13.262  -9.902
  207   2HE   LYS  24          1HE       LYS  24  -2.070 -13.672  -9.607
  208   1HZ   LYS  24          1HZ       LYS  24  -1.001 -13.761 -12.006
  209   2HZ   LYS  24          2HZ       LYS  24  -1.472 -12.138 -12.022
  210   3HZ   LYS  24          3HZ       LYS  24  -2.623 -13.348 -11.766
  211    H    TYR  25           H        TYR  25  -0.490  -7.654  -8.086
  212    HA   TYR  25           HA       TYR  25  -0.903  -5.767  -6.069
  213   1HB   TYR  25          2HB       TYR  25   0.768  -5.435  -7.816
  214   2HB   TYR  25          1HB       TYR  25  -0.493  -5.338  -9.037
  215    HD1  TYR  25           HD1      TYR  25   0.730  -3.625  -5.954
  216    HD2  TYR  25           HD2      TYR  25  -1.377  -3.269  -9.634
  217    HE1  TYR  25           HE1      TYR  25   0.620  -1.189  -5.652
  218    HE2  TYR  25           HE2      TYR  25  -1.492  -0.831  -9.338
  219    HH   TYR  25           HH       TYR  25  -0.634   0.711  -6.388
  220    H    GLU  26           H        GLU  26  -2.916  -6.650  -8.833
  221    HA   GLU  26           HA       GLU  26  -4.733  -4.506  -8.672
  222   1HB   GLU  26          2HB       GLU  26  -4.542  -7.029 -10.095
  223   2HB   GLU  26          1HB       GLU  26  -6.196  -6.703  -9.593
  224   1HG   GLU  26          2HG       GLU  26  -6.175  -5.677 -11.626
  225   2HG   GLU  26          1HG       GLU  26  -5.705  -4.331 -10.590
  226    H    ASP  27           H        ASP  27  -4.782  -7.734  -7.190
  227    HA   ASP  27           HA       ASP  27  -7.299  -7.400  -5.920
  228   1HB   ASP  27          2HB       ASP  27  -5.029  -9.337  -5.623
  229   2HB   ASP  27          1HB       ASP  27  -6.324  -9.324  -4.430
  230    H    VAL  28           H        VAL  28  -3.948  -6.991  -4.797
  231    HA   VAL  28           HA       VAL  28  -4.622  -6.361  -2.120
  232    HB   VAL  28           HB       VAL  28  -2.146  -5.480  -3.613
  233   1HG1  VAL  28          1HG1      VAL  28  -1.190  -5.688  -1.242
  234   2HG1  VAL  28          2HG1      VAL  28  -2.870  -5.659  -0.707
  235   3HG1  VAL  28          3HG1      VAL  28  -2.206  -4.292  -1.602
  236   1HG2  VAL  28          1HG2      VAL  28  -1.277  -7.540  -3.474
  237   2HG2  VAL  28          2HG2      VAL  28  -2.944  -8.076  -3.280
  238   3HG2  VAL  28          3HG2      VAL  28  -1.935  -7.811  -1.860
  239    H    GLU  29           H        GLU  29  -3.878  -4.301  -4.930
  240    HA   GLU  29           HA       GLU  29  -4.121  -1.838  -3.606
  241   1HB   GLU  29          2HB       GLU  29  -3.081  -2.101  -5.825
  242   2HB   GLU  29          1HB       GLU  29  -4.659  -2.457  -6.516
  243   1HG   GLU  29          2HG       GLU  29  -5.325  -0.147  -5.541
  244   2HG   GLU  29          1HG       GLU  29  -3.585   0.130  -5.489
  245    H    HIS  30           H        HIS  30  -6.532  -3.748  -5.400
  246    HA   HIS  30           HA       HIS  30  -8.648  -1.909  -5.148
  247   1HB   HIS  30          2HB       HIS  30  -8.393  -4.777  -5.849
  248   2HB   HIS  30          1HB       HIS  30  -9.974  -4.261  -5.283
  249    HD1  HIS  30           HD1      HIS  30  -8.599  -4.949  -8.309
  250    HD2  HIS  30           HD2      HIS  30 -10.345  -1.473  -6.845
  251    HE1  HIS  30           HE1      HIS  30  -9.353  -3.672 -10.339
  252    HE2  HIS  30           HE2      HIS  30 -10.389  -1.559  -9.431
  253    H    LYS  31           H        LYS  31  -7.686  -4.672  -3.124
  254    HA   LYS  31           HA       LYS  31  -9.812  -4.491  -1.289
  255   1HB   LYS  31          2HB       LYS  31  -7.882  -6.304  -1.663
  256   2HB   LYS  31          1HB       LYS  31  -7.160  -5.429  -0.321
  257   1HG   LYS  31          2HG       LYS  31  -9.596  -5.756   0.692
  258   2HG   LYS  31          1HG       LYS  31  -9.569  -7.145  -0.397
  259   1HD   LYS  31          2HD       LYS  31  -7.532  -7.953   0.640
  260   2HD   LYS  31          1HD       LYS  31  -7.470  -6.532   1.684
  261   1HE   LYS  31          2HE       LYS  31  -8.720  -7.599   3.178
  262   2HE   LYS  31          1HE       LYS  31 -10.031  -7.672   2.002
  263   1HZ   LYS  31          1HZ       LYS  31  -9.759  -9.872   2.363
  264   2HZ   LYS  31          2HZ       LYS  31  -8.131  -9.736   2.795
  265   3HZ   LYS  31          3HZ       LYS  31  -8.575  -9.707   1.164
  266    H    VAL  32           H        VAL  32  -6.493  -3.176  -1.118
  267    HA   VAL  32           HA       VAL  32  -6.770  -1.968   1.401
  268    HB   VAL  32           HB       VAL  32  -5.003  -1.030  -0.865
  269   1HG1  VAL  32          1HG1      VAL  32  -5.167  -0.355   2.041
  270   2HG1  VAL  32          2HG1      VAL  32  -4.923   0.706   0.655
  271   3HG1  VAL  32          3HG1      VAL  32  -3.604  -0.319   1.225
  272   1HG2  VAL  32          1HG2      VAL  32  -3.535  -2.669  -0.401
  273   2HG2  VAL  32          2HG2      VAL  32  -4.933  -3.492   0.289
  274   3HG2  VAL  32          3HG2      VAL  32  -3.837  -2.589   1.334
  275    H    THR  33           H        THR  33  -7.400  -0.687  -1.854
  276    HA   THR  33           HA       THR  33  -7.962   1.953  -1.074
  277    HB   THR  33           HB       THR  33  -9.022   0.401  -3.451
  278    HG1  THR  33           HG1      THR  33  -7.144   0.766  -4.286
  279   1HG2  THR  33          1HG2      THR  33 -10.379   2.256  -3.490
  280   2HG2  THR  33          2HG2      THR  33  -8.990   2.801  -4.431
  281   3HG2  THR  33          3HG2      THR  33  -9.162   3.294  -2.746
  282    H    THR  34           H        THR  34 -10.057  -0.913  -1.290
  283    HA   THR  34           HA       THR  34 -12.456   0.538  -0.731
  284    HB   THR  34           HB       THR  34 -12.053  -2.417  -0.269
  285    HG1  THR  34           HG1      THR  34 -12.416  -1.001  -2.680
  286   1HG2  THR  34          1HG2      THR  34 -14.198  -1.360   0.458
  287   2HG2  THR  34          2HG2      THR  34 -14.359  -2.655  -0.730
  288   3HG2  THR  34          3HG2      THR  34 -14.497  -0.968  -1.232
  289    H    VAL  35           H        VAL  35 -10.190  -1.326   1.269
  290    HA   VAL  35           HA       VAL  35 -11.682  -1.297   3.638
  291    HB   VAL  35           HB       VAL  35  -8.667  -1.237   3.415
  292   1HG1  VAL  35          1HG1      VAL  35  -9.690  -0.732   5.666
  293   2HG1  VAL  35          2HG1      VAL  35  -8.598  -2.115   5.617
  294   3HG1  VAL  35          3HG1      VAL  35 -10.343  -2.369   5.645
  295   1HG2  VAL  35          1HG2      VAL  35  -8.686  -3.362   2.751
  296   2HG2  VAL  35          2HG2      VAL  35 -10.416  -3.181   2.456
  297   3HG2  VAL  35          3HG2      VAL  35  -9.845  -3.812   4.002
  298    H    PHE  36           H        PHE  36  -9.098   0.957   2.599
  299    HA   PHE  36           HA       PHE  36  -9.728   2.722   4.817
  300   1HB   PHE  36          2HB       PHE  36  -7.659   2.970   2.628
  301   2HB   PHE  36          1HB       PHE  36  -7.819   4.064   3.995
  302    HD1  PHE  36           HD1      PHE  36  -7.564   3.061   6.341
  303    HD2  PHE  36           HD2      PHE  36  -6.339   1.059   2.790
  304    HE1  PHE  36           HE1      PHE  36  -6.075   1.622   7.670
  305    HE2  PHE  36           HE2      PHE  36  -4.849  -0.384   4.114
  306    HZ   PHE  36           HZ       PHE  36  -4.716  -0.103   6.556
  307    H    GLY  37           H        GLY  37 -10.489   2.518   1.424
  308   1HA   GLY  37          2HA       GLY  37 -12.342   3.786   0.568
  309   2HA   GLY  37          1HA       GLY  37 -11.904   5.092   1.658
  310    H    GLN  38           H        GLN  38 -12.268   6.125  -0.622
  311    HA   GLN  38           HA       GLN  38  -9.599   6.498  -1.780
  312   1HB   GLN  38          2HB       GLN  38 -10.756   6.699  -4.062
  313   2HB   GLN  38          1HB       GLN  38 -10.507   5.086  -3.417
  314   1HG   GLN  38          2HG       GLN  38 -12.651   4.875  -4.106
  315   2HG   GLN  38          1HG       GLN  38 -12.947   5.473  -2.476
  316   1HE2  GLN  38          1HE2      GLN  38 -15.026   5.889  -3.817
  317   2HE2  GLN  38          2HE2      GLN  38 -15.159   7.475  -4.489
  318    HA   PRO  39           HA       PRO  39  -9.047   7.572  -3.689
  319   1HB   PRO  39          2HB       PRO  39  -7.586   9.699  -4.365
  320   2HB   PRO  39          1HB       PRO  39  -9.179   9.420  -5.078
  321   1HG   PRO  39          2HG       PRO  39  -8.375  11.315  -2.918
  322   2HG   PRO  39          1HG       PRO  39  -9.539  11.542  -4.235
  323   1HD   PRO  39          2HD       PRO  39 -10.170  10.861  -1.601
  324   2HD   PRO  39          1HD       PRO  39 -11.242  10.672  -3.002
  325    H    LEU  40           H        LEU  40  -7.121   6.684  -3.123
  326    HA   LEU  40           HA       LEU  40  -5.505   7.978  -1.048
  327   1HB   LEU  40          2HB       LEU  40  -6.692   5.229  -0.955
  328   2HB   LEU  40          1HB       LEU  40  -5.146   5.530  -0.184
  329    HG   LEU  40           HG       LEU  40  -7.661   7.074   0.452
  330   1HD1  LEU  40          1HD1      LEU  40  -6.686   4.462   1.388
  331   2HD1  LEU  40          2HD1      LEU  40  -8.313   5.140   1.397
  332   3HD1  LEU  40          3HD1      LEU  40  -7.165   5.592   2.655
  333   1HD2  LEU  40          1HD2      LEU  40  -5.340   6.834   2.289
  334   2HD2  LEU  40          2HD2      LEU  40  -6.474   8.165   2.063
  335   3HD2  LEU  40          3HD2      LEU  40  -5.181   7.901   0.895
  336    H    ASP  41           H        ASP  41  -3.323   7.743  -1.290
  337    HA   ASP  41           HA       ASP  41  -2.434   6.283  -3.688
  338   1HB   ASP  41          2HB       ASP  41  -1.608   8.827  -2.404
  339   2HB   ASP  41          1HB       ASP  41  -0.314   7.847  -3.086
  340    H    LEU  42           H        LEU  42  -0.890   4.728  -3.576
  341    HA   LEU  42           HA       LEU  42  -0.184   3.739  -0.937
  342   1HB   LEU  42          2HB       LEU  42   0.445   2.618  -3.673
  343   2HB   LEU  42          1HB       LEU  42   0.738   1.807  -2.146
  344    HG   LEU  42           HG       LEU  42  -2.005   2.586  -3.140
  345   1HD1  LEU  42          1HD1      LEU  42  -1.721   0.911  -4.598
  346   2HD1  LEU  42          2HD1      LEU  42  -1.905  -0.138  -3.195
  347   3HD1  LEU  42          3HD1      LEU  42  -0.295   0.296  -3.767
  348   1HD2  LEU  42          1HD2      LEU  42  -2.788   1.065  -1.398
  349   2HD2  LEU  42          2HD2      LEU  42  -1.826   2.376  -0.713
  350   3HD2  LEU  42          3HD2      LEU  42  -1.123   0.769  -0.898
  351    H    HIS  43           H        HIS  43   1.501   4.664   0.045
  352    HA   HIS  43           HA       HIS  43   3.894   5.303  -1.556
  353   1HB   HIS  43          2HB       HIS  43   2.447   6.789   0.456
  354   2HB   HIS  43          1HB       HIS  43   4.113   6.546   0.964
  355    HD1  HIS  43           HD1      HIS  43   5.313   6.748  -1.986
  356    HD2  HIS  43           HD2      HIS  43   2.739   9.461  -0.169
  357    HE1  HIS  43           HE1      HIS  43   5.686   8.930  -3.177
  358    HE2  HIS  43           HE2      HIS  43   4.039  10.527  -2.135
  359    H    TYR  44           H        TYR  44   5.575   3.976  -1.274
  360    HA   TYR  44           HA       TYR  44   5.736   2.410   1.210
  361   1HB   TYR  44          2HB       TYR  44   5.623   0.959  -0.677
  362   2HB   TYR  44          1HB       TYR  44   6.788   1.922  -1.576
  363    HD1  TYR  44           HD1      TYR  44   9.196   1.908  -0.851
  364    HD2  TYR  44           HD2      TYR  44   6.330  -0.809   0.727
  365    HE1  TYR  44           HE1      TYR  44  11.018   0.446  -0.078
  366    HE2  TYR  44           HE2      TYR  44   8.141  -2.276   1.506
  367    HH   TYR  44           HH       TYR  44  10.636  -1.950   2.146
  368    H    MET  45           H        MET  45   7.390   2.726   2.590
  369    HA   MET  45           HA       MET  45   9.756   4.179   1.619
  370   1HB   MET  45          2HB       MET  45   9.856   5.427   3.748
  371   2HB   MET  45          1HB       MET  45   8.420   5.810   2.809
  372   1HG   MET  45          2HG       MET  45   7.306   5.504   4.707
  373   2HG   MET  45          1HG       MET  45   7.543   3.782   4.423
  374   1HE   MET  45          1HE       MET  45   9.401   6.822   5.363
  375   2HE   MET  45          2HE       MET  45  10.723   6.220   6.363
  376   3HE   MET  45          3HE       MET  45   9.221   6.756   7.117
  377    H    ASN  46           H        ASN  46  11.564   3.112   1.980
  378    HA   ASN  46           HA       ASN  46  11.589   0.752   3.637
  379   1HB   ASN  46          2HB       ASN  46  12.802   1.028   1.414
  380   2HB   ASN  46          1HB       ASN  46  13.956   2.042   2.274
  381   1HD2  ASN  46          1HD2      ASN  46  15.350   0.272   1.355
  382   2HD2  ASN  46          2HD2      ASN  46  15.617  -1.108   2.362
  383    H    ASN  47           H        ASN  47  13.033   3.974   3.712
  384    HA   ASN  47           HA       ASN  47  13.129   4.054   6.534
  385   1HB   ASN  47          2HB       ASN  47  15.187   2.573   5.723
  386   2HB   ASN  47          1HB       ASN  47  15.912   4.155   5.454
  387   1HD2  ASN  47          1HD2      ASN  47  16.238   1.877   7.493
  388   2HD2  ASN  47          2HD2      ASN  47  16.269   2.707   9.008
  389    H    GLU  48           H        GLU  48  15.239   5.333   3.952
  390    HA   GLU  48           HA       GLU  48  14.396   8.046   4.735
  391   1HB   GLU  48          2HB       GLU  48  16.973   7.041   3.538
  392   2HB   GLU  48          1HB       GLU  48  16.557   8.748   3.605
  393   1HG   GLU  48          2HG       GLU  48  16.589   8.760   5.967
  394   2HG   GLU  48          1HG       GLU  48  16.647   7.000   6.044
  395    H    LEU  49           H        LEU  49  14.574   5.780   2.094
  396    HA   LEU  49           HA       LEU  49  13.764   7.867   0.192
  397   1HB   LEU  49          2HB       LEU  49  15.688   5.974  -0.078
  398   2HB   LEU  49          1HB       LEU  49  14.323   5.138  -0.789
  399    HG   LEU  49           HG       LEU  49  15.726   6.313  -2.453
  400   1HD1  LEU  49          1HD1      LEU  49  13.070   6.044  -2.460
  401   2HD1  LEU  49          2HD1      LEU  49  13.963   6.801  -3.778
  402   3HD1  LEU  49          3HD1      LEU  49  13.176   7.800  -2.557
  403   1HD2  LEU  49          1HD2      LEU  49  16.081   8.272  -0.741
  404   2HD2  LEU  49          2HD2      LEU  49  14.652   8.934  -1.534
  405   3HD2  LEU  49          3HD2      LEU  49  16.096   8.573  -2.479
  406    H    SER  50           H        SER  50  11.833   7.792  -0.862
  407    HA   SER  50           HA       SER  50   9.958   5.678  -0.037
  408   1HB   SER  50          2HB       SER  50   9.395   8.028   0.660
  409   2HB   SER  50          1HB       SER  50   9.257   8.447  -1.047
  410    HG   SER  50           HG       SER  50   7.231   7.907  -0.500
  411    H    ILE  51           H        ILE  51   9.063   4.401  -1.539
  412    HA   ILE  51           HA       ILE  51   9.542   5.060  -4.375
  413    HB   ILE  51           HB       ILE  51   9.141   2.299  -3.212
  414   1HG1  ILE  51          2HG1      ILE  51  11.782   2.995  -4.314
  415   2HG1  ILE  51          1HG1      ILE  51  11.377   3.839  -2.823
  416   1HG2  ILE  51          1HG2      ILE  51   8.504   2.273  -5.476
  417   2HG2  ILE  51          2HG2      ILE  51  10.153   1.649  -5.450
  418   3HG2  ILE  51          3HG2      ILE  51   9.846   3.312  -5.949
  419   1HD1  ILE  51          1HD1      ILE  51  12.217   2.036  -1.823
  420   2HD1  ILE  51          2HD1      ILE  51  12.068   1.042  -3.273
  421   3HD1  ILE  51          3HD1      ILE  51  10.674   1.282  -2.221
  422    H    LEU  52           H        LEU  52   7.836   5.144  -5.735
  423    HA   LEU  52           HA       LEU  52   5.180   4.987  -4.594
  424   1HB   LEU  52          2HB       LEU  52   6.421   6.197  -6.955
  425   2HB   LEU  52          1HB       LEU  52   4.844   5.503  -7.279
  426    HG   LEU  52           HG       LEU  52   5.399   7.536  -5.112
  427   1HD1  LEU  52          1HD1      LEU  52   4.024   7.987  -7.753
  428   2HD1  LEU  52          2HD1      LEU  52   5.720   8.375  -7.455
  429   3HD1  LEU  52          3HD1      LEU  52   4.455   9.189  -6.535
  430   1HD2  LEU  52          1HD2      LEU  52   2.971   7.736  -5.010
  431   2HD2  LEU  52          2HD2      LEU  52   3.481   6.086  -4.655
  432   3HD2  LEU  52          3HD2      LEU  52   2.806   6.479  -6.234
  433    H    LEU  53           H        LEU  53   4.025   3.182  -4.583
  434    HA   LEU  53           HA       LEU  53   4.721   0.961  -6.324
  435   1HB   LEU  53          2HB       LEU  53   2.892   1.324  -3.975
  436   2HB   LEU  53          1HB       LEU  53   2.709  -0.073  -5.015
  437    HG   LEU  53           HG       LEU  53   4.078  -0.438  -2.937
  438   1HD1  LEU  53          1HD1      LEU  53   4.849  -1.116  -5.698
  439   2HD1  LEU  53          2HD1      LEU  53   4.495  -2.162  -4.326
  440   3HD1  LEU  53          3HD1      LEU  53   6.076  -1.394  -4.463
  441   1HD2  LEU  53          1HD2      LEU  53   6.102   1.233  -4.423
  442   2HD2  LEU  53          2HD2      LEU  53   6.378   0.349  -2.922
  443   3HD2  LEU  53          3HD2      LEU  53   5.256   1.709  -2.952
  444    H    LYS  54           H        LYS  54   4.040   1.334  -8.366
  445    HA   LYS  54           HA       LYS  54   1.145   1.622  -8.765
  446   1HB   LYS  54          2HB       LYS  54   3.188   3.534  -9.502
  447   2HB   LYS  54          1HB       LYS  54   2.356   2.944 -10.934
  448   1HG   LYS  54          2HG       LYS  54   0.260   3.695 -10.140
  449   2HG   LYS  54          1HG       LYS  54   0.898   3.993  -8.523
  450   1HD   LYS  54          2HD       LYS  54   1.819   5.979  -9.107
  451   2HD   LYS  54          1HD       LYS  54   2.227   5.436 -10.735
  452   1HE   LYS  54          2HE       LYS  54   0.282   6.165 -11.605
  453   2HE   LYS  54          1HE       LYS  54  -0.651   5.666 -10.197
  454   1HZ   LYS  54          1HZ       LYS  54   0.645   7.704  -9.146
  455   2HZ   LYS  54          2HZ       LYS  54  -0.817   7.899  -9.971
  456   3HZ   LYS  54          3HZ       LYS  54   0.645   8.221 -10.757
  457    H    ASN  55           H        ASN  55   3.096  -0.643  -8.886
  458    HA   ASN  55           HA       ASN  55   2.080  -1.949 -11.167
  459   1HB   ASN  55          2HB       ASN  55   4.376  -0.345 -11.680
  460   2HB   ASN  55          1HB       ASN  55   4.890  -2.028 -11.735
  461   1HD2  ASN  55          1HD2      ASN  55   3.334   0.481 -13.383
  462   2HD2  ASN  55          2HD2      ASN  55   2.779  -0.430 -14.743
  463    H    GLN  56           H        GLN  56   2.846  -4.173 -11.338
  464    HA   GLN  56           HA       GLN  56   3.272  -5.385  -8.839
  465   1HB   GLN  56          2HB       GLN  56   2.244  -6.460 -10.886
  466   2HB   GLN  56          1HB       GLN  56   3.873  -6.636 -11.523
  467   1HG   GLN  56          2HG       GLN  56   3.862  -8.626 -10.537
  468   2HG   GLN  56          1HG       GLN  56   4.108  -7.740  -9.034
  469   1HE2  GLN  56          1HE2      GLN  56   2.847  -8.480  -7.490
  470   2HE2  GLN  56          2HE2      GLN  56   1.212  -9.009  -7.668
  471    H    ASP  57           H        ASP  57   5.494  -4.317 -11.335
  472    HA   ASP  57           HA       ASP  57   7.799  -5.694 -10.589
  473   1HB   ASP  57          2HB       ASP  57   7.189  -3.780 -12.468
  474   2HB   ASP  57          1HB       ASP  57   8.268  -2.905 -11.386
  475    H    ASP  58           H        ASP  58   6.543  -2.576  -9.406
  476    HA   ASP  58           HA       ASP  58   8.663  -1.963  -7.677
  477   1HB   ASP  58          2HB       ASP  58   5.735  -1.212  -7.514
  478   2HB   ASP  58          1HB       ASP  58   6.992  -0.511  -6.498
  479    H    LEU  59           H        LEU  59   5.690  -3.809  -7.146
  480    HA   LEU  59           HA       LEU  59   6.071  -4.226  -4.371
  481   1HB   LEU  59          2HB       LEU  59   3.950  -4.535  -5.799
  482   2HB   LEU  59          1HB       LEU  59   4.601  -6.115  -6.191
  483    HG   LEU  59           HG       LEU  59   4.678  -6.582  -3.705
  484   1HD1  LEU  59          1HD1      LEU  59   3.336  -5.230  -2.236
  485   2HD1  LEU  59          2HD1      LEU  59   2.884  -4.163  -3.567
  486   3HD1  LEU  59          3HD1      LEU  59   4.555  -4.212  -3.003
  487   1HD2  LEU  59          1HD2      LEU  59   2.372  -7.223  -3.610
  488   2HD2  LEU  59          2HD2      LEU  59   2.927  -7.417  -5.272
  489   3HD2  LEU  59          3HD2      LEU  59   1.937  -6.026  -4.832
  490    H    ASP  60           H        ASP  60   6.935  -6.123  -7.242
  491    HA   ASP  60           HA       ASP  60   7.927  -8.395  -5.902
  492   1HB   ASP  60          2HB       ASP  60   7.630  -7.606  -8.562
  493   2HB   ASP  60          1HB       ASP  60   9.365  -7.830  -8.364
  494    H    LYS  61           H        LYS  61   9.492  -5.371  -6.859
  495    HA   LYS  61           HA       LYS  61  12.141  -6.129  -6.292
  496   1HB   LYS  61          2HB       LYS  61  10.947  -3.891  -7.320
  497   2HB   LYS  61          1HB       LYS  61  11.463  -3.317  -5.741
  498   1HG   LYS  61          2HG       LYS  61  13.378  -4.772  -7.520
  499   2HG   LYS  61          1HG       LYS  61  13.042  -3.058  -7.767
  500   1HD   LYS  61          2HD       LYS  61  13.531  -3.627  -4.977
  501   2HD   LYS  61          1HD       LYS  61  14.873  -4.183  -5.979
  502   1HE   LYS  61          2HE       LYS  61  14.358  -1.732  -7.056
  503   2HE   LYS  61          1HE       LYS  61  13.973  -1.457  -5.358
  504   1HZ   LYS  61          1HZ       LYS  61  16.272  -2.703  -5.070
  505   2HZ   LYS  61          2HZ       LYS  61  16.185  -1.032  -5.310
  506   3HZ   LYS  61          3HZ       LYS  61  16.544  -2.052  -6.610
  507    H    ALA  62           H        ALA  62   9.599  -4.733  -4.259
  508    HA   ALA  62           HA       ALA  62  11.181  -4.249  -1.979
  509   1HB   ALA  62          1HB       ALA  62   9.193  -3.183  -1.744
  510   2HB   ALA  62          2HB       ALA  62   8.797  -4.651  -0.853
  511   3HB   ALA  62          3HB       ALA  62   8.279  -4.469  -2.530
  512    H    ILE  63           H        ILE  63   9.489  -7.125  -3.116
  513    HA   ILE  63           HA       ILE  63   9.751  -8.664  -0.758
  514    HB   ILE  63           HB       ILE  63   9.601  -9.692  -3.599
  515   1HG1  ILE  63          2HG1      ILE  63   7.231  -9.527  -1.781
  516   2HG1  ILE  63          1HG1      ILE  63   7.755  -8.069  -2.613
  517   1HG2  ILE  63          1HG2      ILE  63  10.311 -11.319  -1.847
  518   2HG2  ILE  63          2HG2      ILE  63   8.803 -11.742  -2.656
  519   3HG2  ILE  63          3HG2      ILE  63   8.769 -11.044  -1.037
  520   1HD1  ILE  63          1HD1      ILE  63   6.465  -8.743  -4.284
  521   2HD1  ILE  63          2HD1      ILE  63   6.317 -10.370  -3.623
  522   3HD1  ILE  63          3HD1      ILE  63   7.709  -9.948  -4.619
  523    H    ASP  64           H        ASP  64  11.784  -8.374  -3.662
  524    HA   ASP  64           HA       ASP  64  13.655 -10.346  -3.087
  525   1HB   ASP  64          2HB       ASP  64  13.391  -8.809  -5.176
  526   2HB   ASP  64          1HB       ASP  64  14.495  -7.739  -4.317
  527    H    ILE  65           H        ILE  65  13.636  -6.930  -2.105
  528    HA   ILE  65           HA       ILE  65  16.104  -7.023  -0.712
  529    HB   ILE  65           HB       ILE  65  13.818  -5.118  -0.191
  530   1HG1  ILE  65          2HG1      ILE  65  16.115  -4.424  -1.976
  531   2HG1  ILE  65          1HG1      ILE  65  14.812  -5.405  -2.636
  532   1HG2  ILE  65          1HG2      ILE  65  15.230  -3.861   1.044
  533   2HG2  ILE  65          2HG2      ILE  65  16.631  -4.259   0.049
  534   3HG2  ILE  65          3HG2      ILE  65  16.062  -5.400   1.266
  535   1HD1  ILE  65          1HD1      ILE  65  14.866  -2.705  -2.649
  536   2HD1  ILE  65          2HD1      ILE  65  13.931  -3.017  -1.187
  537   3HD1  ILE  65          3HD1      ILE  65  13.396  -3.675  -2.732
  538    H    LEU  66           H        LEU  66  12.740  -7.488   0.283
  539    HA   LEU  66           HA       LEU  66  13.210  -7.656   3.059
  540   1HB   LEU  66          2HB       LEU  66  10.989  -7.474   1.665
  541   2HB   LEU  66          1HB       LEU  66  11.032  -9.225   1.743
  542    HG   LEU  66           HG       LEU  66  11.426  -8.527   4.372
  543   1HD1  LEU  66          1HD1      LEU  66  11.002  -6.181   3.941
  544   2HD1  LEU  66          2HD1      LEU  66   9.687  -6.871   4.893
  545   3HD1  LEU  66          3HD1      LEU  66   9.466  -6.576   3.168
  546   1HD2  LEU  66          1HD2      LEU  66   9.824 -10.170   3.135
  547   2HD2  LEU  66          2HD2      LEU  66   8.654  -8.864   3.314
  548   3HD2  LEU  66          3HD2      LEU  66   9.408  -9.575   4.741
  549    H    ASP  67           H        ASP  67  13.081 -10.150   0.524
  550    HA   ASP  67           HA       ASP  67  13.335 -12.418   2.132
  551   1HB   ASP  67          2HB       ASP  67  13.930 -11.779  -0.713
  552   2HB   ASP  67          1HB       ASP  67  14.648 -13.245  -0.055
  553    H    ARG  68           H        ARG  68  15.776 -10.171   0.973
  554    HA   ARG  68           HA       ARG  68  18.024 -11.760   1.746
  555   1HB   ARG  68          2HB       ARG  68  17.561  -9.048   0.671
  556   2HB   ARG  68          1HB       ARG  68  19.019  -9.239   1.635
  557   1HG   ARG  68          2HG       ARG  68  20.065 -10.353   0.020
  558   2HG   ARG  68          1HG       ARG  68  18.671 -11.388  -0.289
  559   1HD   ARG  68          2HD       ARG  68  19.340  -9.983  -2.230
  560   2HD   ARG  68          1HD       ARG  68  17.675  -9.740  -1.707
  561    HE   ARG  68           HE       ARG  68  18.191  -7.575  -1.181
  562   1HH1  ARG  68          1HH1      ARG  68  21.181  -9.359  -1.562
  563   2HH1  ARG  68          2HH1      ARG  68  22.178  -7.948  -1.475
  564   1HH2  ARG  68          1HH2      ARG  68  19.512  -5.715  -1.069
  565   2HH2  ARG  68          2HH2      ARG  68  21.233  -5.878  -1.193
  566    H    SER  69           H        SER  69  16.038  -9.346   3.334
  567    HA   SER  69           HA       SER  69  17.848  -9.263   5.627
  568   1HB   SER  69          2HB       SER  69  16.754  -7.187   4.591
  569   2HB   SER  69          1HB       SER  69  15.261  -7.743   5.349
  570    HG   SER  69           HG       SER  69  16.418  -7.699   7.367
  571    H    SER  70           H        SER  70  17.602 -11.091   6.824
  572    HA   SER  70           HA       SER  70  15.227 -12.531   7.207
  573   1HB   SER  70          2HB       SER  70  17.550 -13.368   7.688
  574   2HB   SER  70          1HB       SER  70  17.539 -12.389   9.154
  575    HG   SER  70           HG       SER  70  16.478 -14.815   8.754
  576    H    SER  71           H        SER  71  16.639  -9.863   9.049
  577    HA   SER  71           HA       SER  71  14.963  -9.940  11.288
  578   1HB   SER  71          2HB       SER  71  15.536  -7.518  11.546
  579   2HB   SER  71          1HB       SER  71  16.943  -8.549  11.293
  580    HG   SER  71           HG       SER  71  15.830  -6.612   9.637
  581    H    MET  72           H        MET  72  14.484  -8.522   8.104
  582    HA   MET  72           HA       MET  72  12.028  -7.205   8.832
  583   1HB   MET  72          2HB       MET  72  13.867  -6.997   6.734
  584   2HB   MET  72          1HB       MET  72  12.397  -7.598   5.981
  585   1HG   MET  72          2HG       MET  72  11.165  -5.718   6.612
  586   2HG   MET  72          1HG       MET  72  12.354  -5.235   7.820
  587   1HE   MET  72          1HE       MET  72  12.339  -2.306   5.586
  588   2HE   MET  72          2HE       MET  72  11.123  -3.332   6.342
  589   3HE   MET  72          3HE       MET  72  11.293  -3.313   4.586
  590    H    LYS  73           H        LYS  73   9.944  -7.742   8.121
  591    HA   LYS  73           HA       LYS  73   9.530 -10.366   6.911
  592   1HB   LYS  73          2HB       LYS  73   8.784  -9.616   9.689
  593   2HB   LYS  73          1HB       LYS  73   7.618 -10.556   8.772
  594   1HG   LYS  73          2HG       LYS  73   9.064 -12.374   8.562
  595   2HG   LYS  73          1HG       LYS  73  10.482 -11.410   8.983
  596   1HD   LYS  73          2HD       LYS  73   9.767 -11.242  11.265
  597   2HD   LYS  73          1HD       LYS  73   8.218 -11.995  10.886
  598   1HE   LYS  73          2HE       LYS  73   9.370 -13.774  11.776
  599   2HE   LYS  73          1HE       LYS  73   9.708 -13.974  10.058
  600   1HZ   LYS  73          1HZ       LYS  73  11.748 -12.431  10.755
  601   2HZ   LYS  73          2HZ       LYS  73  11.811 -14.119  10.826
  602   3HZ   LYS  73          3HZ       LYS  73  11.498 -13.226  12.227
  603    H    SER  74           H        SER  74   7.949  -7.455   8.229
  604    HA   SER  74           HA       SER  74   5.843  -7.736   6.206
  605   1HB   SER  74          2HB       SER  74   4.561  -6.143   7.538
  606   2HB   SER  74          1HB       SER  74   5.122  -7.464   8.561
  607    HG   SER  74           HG       SER  74   6.426  -6.132   9.599
  608    H    LEU  75           H        LEU  75   5.037  -5.610   5.269
  609    HA   LEU  75           HA       LEU  75   7.372  -4.040   4.415
  610   1HB   LEU  75          2HB       LEU  75   4.693  -4.496   3.103
  611   2HB   LEU  75          1HB       LEU  75   5.885  -3.358   2.504
  612    HG   LEU  75           HG       LEU  75   6.827  -6.137   2.904
  613   1HD1  LEU  75          1HD1      LEU  75   5.035  -5.426   0.589
  614   2HD1  LEU  75          2HD1      LEU  75   4.555  -6.428   1.958
  615   3HD1  LEU  75          3HD1      LEU  75   5.841  -6.966   0.880
  616   1HD2  LEU  75          1HD2      LEU  75   7.162  -4.117   0.688
  617   2HD2  LEU  75          2HD2      LEU  75   8.016  -5.654   0.828
  618   3HD2  LEU  75          3HD2      LEU  75   8.284  -4.382   2.021
  619    H    ARG  76           H        ARG  76   7.530  -1.927   4.873
  620    HA   ARG  76           HA       ARG  76   5.461  -0.707   6.501
  621   1HB   ARG  76          2HB       ARG  76   8.272   0.054   5.757
  622   2HB   ARG  76          1HB       ARG  76   7.194   1.222   6.508
  623   1HG   ARG  76          2HG       ARG  76   7.007  -1.096   8.067
  624   2HG   ARG  76          1HG       ARG  76   8.721  -0.882   7.710
  625   1HD   ARG  76          2HD       ARG  76   8.884   0.941   9.005
  626   2HD   ARG  76          1HD       ARG  76   7.351   1.596   8.431
  627    HE   ARG  76           HE       ARG  76   7.789   0.020  10.797
  628   1HH1  ARG  76          1HH1      ARG  76   5.417   1.032   8.426
  629   2HH1  ARG  76          2HH1      ARG  76   4.072   0.798   9.491
  630   1HH2  ARG  76          1HH2      ARG  76   6.013  -0.294  12.193
  631   2HH2  ARG  76          2HH2      ARG  76   4.411   0.045  11.632
  632    H    ILE  77           H        ILE  77   3.841  -0.542   4.844
  633    HA   ILE  77           HA       ILE  77   4.368   1.479   2.781
  634    HB   ILE  77           HB       ILE  77   1.940  -0.303   2.999
  635   1HG1  ILE  77          2HG1      ILE  77   4.466  -0.720   1.377
  636   2HG1  ILE  77          1HG1      ILE  77   3.952  -1.689   2.754
  637   1HG2  ILE  77          1HG2      ILE  77   1.239   0.562   1.030
  638   2HG2  ILE  77          2HG2      ILE  77   2.877   0.786   0.416
  639   3HG2  ILE  77          3HG2      ILE  77   2.197   1.946   1.559
  640   1HD1  ILE  77          1HD1      ILE  77   2.774  -1.557   0.007
  641   2HD1  ILE  77          2HD1      ILE  77   1.856  -2.189   1.374
  642   3HD1  ILE  77          3HD1      ILE  77   3.370  -2.959   0.897
  643    H    LEU  78           H        LEU  78   3.792   3.486   3.236
  644    HA   LEU  78           HA       LEU  78   1.661   3.965   5.195
  645   1HB   LEU  78          2HB       LEU  78   3.678   5.919   4.087
  646   2HB   LEU  78          1HB       LEU  78   2.572   6.203   5.416
  647    HG   LEU  78           HG       LEU  78   4.801   4.165   5.472
  648   1HD1  LEU  78          1HD1      LEU  78   6.101   5.693   6.706
  649   2HD1  LEU  78          2HD1      LEU  78   4.753   6.815   6.889
  650   3HD1  LEU  78          3HD1      LEU  78   5.508   6.595   5.311
  651   1HD2  LEU  78          1HD2      LEU  78   2.590   4.138   6.986
  652   2HD2  LEU  78          2HD2      LEU  78   3.572   5.255   7.931
  653   3HD2  LEU  78          3HD2      LEU  78   4.170   3.634   7.582
  654    H    LEU  79           H        LEU  79  -0.291   4.418   4.419
  655    HA   LEU  79           HA       LEU  79  -0.513   5.555   1.722
  656   1HB   LEU  79          2HB       LEU  79  -2.844   4.807   1.772
  657   2HB   LEU  79          1HB       LEU  79  -1.722   3.486   2.029
  658    HG   LEU  79           HG       LEU  79  -2.335   4.295   4.604
  659   1HD1  LEU  79          1HD1      LEU  79  -4.769   4.518   2.848
  660   2HD1  LEU  79          2HD1      LEU  79  -4.120   5.720   3.962
  661   3HD1  LEU  79          3HD1      LEU  79  -4.845   4.240   4.588
  662   1HD2  LEU  79          1HD2      LEU  79  -3.765   2.214   4.579
  663   2HD2  LEU  79          2HD2      LEU  79  -2.103   2.016   4.027
  664   3HD2  LEU  79          3HD2      LEU  79  -3.417   2.102   2.853
  665    H    LEU  80           H        LEU  80  -1.288   7.546   1.373
  666    HA   LEU  80           HA       LEU  80  -2.547   8.970   3.624
  667   1HB   LEU  80          2HB       LEU  80  -0.552  10.159   1.694
  668   2HB   LEU  80          1HB       LEU  80  -1.325  10.986   3.033
  669    HG   LEU  80           HG       LEU  80  -0.152   9.009   4.408
  670   1HD1  LEU  80          1HD1      LEU  80   2.105   8.624   3.492
  671   2HD1  LEU  80          2HD1      LEU  80   1.612   9.422   2.000
  672   3HD1  LEU  80          3HD1      LEU  80   0.833   7.920   2.494
  673   1HD2  LEU  80          1HD2      LEU  80   0.073  11.526   4.614
  674   2HD2  LEU  80          2HD2      LEU  80   1.444  11.394   3.512
  675   3HD2  LEU  80          3HD2      LEU  80   1.484  10.571   5.072
  676    H    SER  81           H        SER  81  -3.948  10.714   3.034
  677    HA   SER  81           HA       SER  81  -5.628  10.124   0.840
  678   1HB   SER  81          2HB       SER  81  -6.441  12.601   1.487
  679   2HB   SER  81          1HB       SER  81  -6.849  11.187   2.457
  680    HG   SER  81           HG       SER  81  -5.728  12.010   4.028
  681    H    GLN  82           H        GLN  82  -5.983  11.216  -1.095
  682    HA   GLN  82           HA       GLN  82  -3.647  12.503  -2.181
  683   1HB   GLN  82          2HB       GLN  82  -5.777  10.975  -3.239
  684   2HB   GLN  82          1HB       GLN  82  -5.853  12.552  -4.013
  685   1HG   GLN  82          2HG       GLN  82  -3.239  11.128  -3.843
  686   2HG   GLN  82          1HG       GLN  82  -4.428  10.634  -5.047
  687   1HE2  GLN  82          1HE2      GLN  82  -2.296  13.172  -3.990
  688   2HE2  GLN  82          2HE2      GLN  82  -2.362  14.107  -5.441
  689    H    ASP  83           H        ASP  83  -5.910  13.718  -0.317
  690    HA   ASP  83           HA       ASP  83  -6.182  16.235  -1.802
  691   1HB   ASP  83          2HB       ASP  83  -8.246  14.943  -0.903
  692   2HB   ASP  83          1HB       ASP  83  -7.759  15.570   0.670
  693    H    ARG  84           H        ARG  84  -4.123  17.057  -1.275
  694    HA   ARG  84           HA       ARG  84  -3.582  17.511   1.572
  695   1HB   ARG  84          2HB       ARG  84  -1.893  17.306  -0.861
  696   2HB   ARG  84          1HB       ARG  84  -1.352  18.429   0.377
  697   1HG   ARG  84          2HG       ARG  84  -1.876  16.278   1.904
  698   2HG   ARG  84          1HG       ARG  84  -1.433  15.485   0.391
  699   1HD   ARG  84          2HD       ARG  84   0.221  17.526   1.877
  700   2HD   ARG  84          1HD       ARG  84   0.508  15.787   1.848
  701    HE   ARG  84           HE       ARG  84   1.160  17.694  -0.209
  702   1HH1  ARG  84          1HH1      ARG  84   0.529  14.316   0.469
  703   2HH1  ARG  84          2HH1      ARG  84   1.424  13.747  -0.900
  704   1HH2  ARG  84          1HH2      ARG  84   2.338  16.939  -2.012
  705   2HH2  ARG  84          2HH2      ARG  84   2.451  15.237  -2.308
  706    H    ASN  85           H        ASN  85  -5.644  19.035   0.280
  707    HA   ASN  85           HA       ASN  85  -4.481  21.710   0.599
  708   1HB   ASN  85          2HB       ASN  85  -6.118  22.488  -1.205
  709   2HB   ASN  85          1HB       ASN  85  -4.706  21.590  -1.747
  710   1HD2  ASN  85          1HD2      ASN  85  -4.965  19.455  -2.477
  711   2HD2  ASN  85          2HD2      ASN  85  -6.504  18.860  -2.984
  712    H    LEU  86           H        LEU  86  -5.532  20.728   2.755
  713    HA   LEU  86           HA       LEU  86  -7.957  22.272   3.122
  714   1HB   LEU  86          2HB       LEU  86  -8.627  19.919   2.412
  715   2HB   LEU  86          1HB       LEU  86  -7.971  19.371   3.942
  716    HG   LEU  86           HG       LEU  86  -9.627  21.234   4.891
  717   1HD1  LEU  86          1HD1      LEU  86 -11.038  20.304   2.396
  718   2HD1  LEU  86          2HD1      LEU  86 -10.337  21.908   2.612
  719   3HD1  LEU  86          3HD1      LEU  86 -11.666  21.383   3.643
  720   1HD2  LEU  86          1HD2      LEU  86 -11.343  19.420   5.105
  721   2HD2  LEU  86          2HD2      LEU  86  -9.717  18.972   5.619
  722   3HD2  LEU  86          3HD2      LEU  86 -10.329  18.427   4.058
  723    H    GLU  87           H        GLU  87  -5.187  22.410   4.075
  724    HA   GLU  87           HA       GLU  87  -5.699  22.961   6.818
  725   1HB   GLU  87          2HB       GLU  87  -4.974  20.308   6.295
  726   2HB   GLU  87          1HB       GLU  87  -3.502  21.069   6.880
  727   1HG   GLU  87          2HG       GLU  87  -5.357  21.985   8.658
  728   2HG   GLU  87          1HG       GLU  87  -5.956  20.367   8.301
  729    H    HIS  88           H        HIS  88  -4.707  24.445   4.621
  730    HA   HIS  88           HA       HIS  88  -1.848  24.680   4.862
  731   1HB   HIS  88          2HB       HIS  88  -3.683  25.351   2.915
  732   2HB   HIS  88          1HB       HIS  88  -3.233  26.917   3.580
  733    HD1  HIS  88           HD1      HIS  88  -0.196  25.664   4.136
  734    HD2  HIS  88           HD2      HIS  88  -2.270  26.076   0.560
  735    HE1  HIS  88           HE1      HIS  88   1.561  25.697   2.340
  736    HE2  HIS  88           HE2      HIS  88   0.290  26.061   0.198
  737    H    HIS  89           H        HIS  89  -0.757  25.877   6.267
  738    HA   HIS  89           HA       HIS  89  -2.219  27.885   7.842
  739   1HB   HIS  89          2HB       HIS  89  -0.450  27.596   9.542
  740   2HB   HIS  89          1HB       HIS  89  -1.269  26.080   9.190
  741    HD1  HIS  89           HD1      HIS  89   1.991  27.867   8.538
  742    HD2  HIS  89           HD2      HIS  89   0.358  24.057   8.275
  743    HE1  HIS  89           HE1      HIS  89   3.924  26.342   8.041
  744    HE2  HIS  89           HE2      HIS  89   2.918  24.035   7.912
  745    H    HIS  90           H        HIS  90  -1.595  29.976   7.854
  746    HA   HIS  90           HA       HIS  90  -0.562  31.911   7.265
  747   1HB   HIS  90          2HB       HIS  90   1.806  30.056   7.373
  748   2HB   HIS  90          1HB       HIS  90   1.990  31.750   6.939
  749    HD1  HIS  90           HD1      HIS  90   2.132  29.607   9.776
  750    HD2  HIS  90           HD2      HIS  90   0.778  33.475   9.100
  751    HE1  HIS  90           HE1      HIS  90   2.040  30.690  12.042
  752    HE2  HIS  90           HE2      HIS  90   1.149  33.008  11.617
  753    H    HIS  91           H        HIS  91   1.019  32.885   5.489
  754    HA   HIS  91           HA       HIS  91   0.775  31.462   2.954
  755   1HB   HIS  91          2HB       HIS  91  -0.499  34.137   3.520
  756   2HB   HIS  91          1HB       HIS  91  -0.146  33.583   1.887
  757    HD1  HIS  91           HD1      HIS  91  -2.854  33.718   4.138
  758    HD2  HIS  91           HD2      HIS  91  -1.396  30.792   1.571
  759    HE1  HIS  91           HE1      HIS  91  -4.778  32.144   3.750
  760    HE2  HIS  91           HE2      HIS  91  -3.873  30.384   2.191
  761    H    HIS  92           H        HIS  92   1.788  34.546   4.463
  762    HA   HIS  92           HA       HIS  92   4.340  34.317   3.022
  763   1HB   HIS  92          2HB       HIS  92   4.302  36.803   2.675
  764   2HB   HIS  92          1HB       HIS  92   3.102  35.921   1.738
  765    HD1  HIS  92           HD1      HIS  92   1.079  37.328   1.600
  766    HD2  HIS  92           HD2      HIS  92   2.812  37.504   5.374
  767    HE1  HIS  92           HE1      HIS  92  -0.443  38.785   2.972
  768    HE2  HIS  92           HE2      HIS  92   0.593  38.826   5.270
  769    H    HIS  93           H        HIS  93   3.520  33.747   5.793
  770    HA   HIS  93           HA       HIS  93   4.440  33.884   7.854
  771   1HB   HIS  93          2HB       HIS  93   6.567  34.344   6.373
  772   2HB   HIS  93          1HB       HIS  93   6.403  35.980   7.000
  773    HD1  HIS  93           HD1      HIS  93   7.503  32.577   7.927
  774    HD2  HIS  93           HD2      HIS  93   6.764  36.194   9.834
  775    HE1  HIS  93           HE1      HIS  93   8.544  32.362  10.205
  776    HE2  HIS  93           HE2      HIS  93   8.164  34.595  11.307
  Start of MODEL   14
    1    H    GLN   1           H        GLN   1   8.595 -19.470   4.146
    2    HA   GLN   1           HA       GLN   1   7.772 -19.281   1.863
    3   1HB   GLN   1          2HB       GLN   1   7.976 -21.511   3.602
    4   2HB   GLN   1          1HB       GLN   1   6.569 -21.798   2.586
    5   1HG   GLN   1          2HG       GLN   1   8.879 -20.836   1.096
    6   2HG   GLN   1          1HG       GLN   1   9.171 -22.358   1.936
    7   1HE2  GLN   1          1HE2      GLN   1   9.078 -23.848   0.374
    8   2HE2  GLN   1          2HE2      GLN   1   7.759 -24.063  -0.720
    9    H    SER   2           H        SER   2   6.149 -18.109   1.024
   10    HA   SER   2           HA       SER   2   4.074 -17.556   0.280
   11   1HB   SER   2          2HB       SER   2   2.884 -19.974   1.617
   12   2HB   SER   2          1HB       SER   2   2.388 -19.179   0.125
   13    HG   SER   2           HG       SER   2   4.297 -21.111   0.543
   14    H    ASP   3           H        ASP   3   1.883 -16.876   1.058
   15    HA   ASP   3           HA       ASP   3   0.610 -15.642   2.475
   16   1HB   ASP   3          2HB       ASP   3   1.583 -17.844   4.268
   17   2HB   ASP   3          1HB       ASP   3   0.605 -16.536   4.928
   18    H    VAL   4           H        VAL   4   1.652 -13.676   2.360
   19    HA   VAL   4           HA       VAL   4   3.675 -13.129   4.429
   20    HB   VAL   4           HB       VAL   4   3.104 -11.459   1.978
   21   1HG1  VAL   4          1HG1      VAL   4   4.258 -10.011   3.280
   22   2HG1  VAL   4          2HG1      VAL   4   5.638 -10.908   2.647
   23   3HG1  VAL   4          3HG1      VAL   4   4.994 -11.292   4.245
   24   1HG2  VAL   4          1HG2      VAL   4   4.784 -13.870   2.343
   25   2HG2  VAL   4          2HG2      VAL   4   5.491 -12.537   1.431
   26   3HG2  VAL   4          3HG2      VAL   4   3.972 -13.259   0.900
   27    H    ARG   5           H        ARG   5   3.213 -11.793   6.056
   28    HA   ARG   5           HA       ARG   5   0.607 -10.494   6.120
   29   1HB   ARG   5          2HB       ARG   5   2.664 -11.237   8.147
   30   2HB   ARG   5          1HB       ARG   5   1.593  -9.895   8.520
   31   1HG   ARG   5          2HG       ARG   5  -0.241 -11.222   8.711
   32   2HG   ARG   5          1HG       ARG   5   0.351 -12.400   7.535
   33   1HD   ARG   5          2HD       ARG   5   2.184 -12.617   9.563
   34   2HD   ARG   5          1HD       ARG   5   0.685 -12.303  10.439
   35    HE   ARG   5           HE       ARG   5   0.437 -14.336   8.422
   36   1HH1  ARG   5          1HH1      ARG   5   1.335 -13.721  11.753
   37   2HH1  ARG   5          2HH1      ARG   5   1.013 -15.344  12.265
   38   1HH2  ARG   5          1HH2      ARG   5   0.022 -16.469   9.104
   39   2HH2  ARG   5          2HH2      ARG   5   0.269 -16.904  10.763
   40    H    ILE   6           H        ILE   6   0.426  -8.506   5.332
   41    HA   ILE   6           HA       ILE   6   2.731  -6.687   5.466
   42    HB   ILE   6           HB       ILE   6   0.217  -6.354   3.822
   43   1HG1  ILE   6          2HG1      ILE   6   2.641  -6.951   2.330
   44   2HG1  ILE   6          1HG1      ILE   6   2.227  -8.257   3.435
   45   1HG2  ILE   6          1HG2      ILE   6   1.405  -4.276   4.275
   46   2HG2  ILE   6          2HG2      ILE   6   1.536  -4.720   2.575
   47   3HG2  ILE   6          3HG2      ILE   6   2.898  -4.984   3.662
   48   1HD1  ILE   6          1HD1      ILE   6  -0.184  -7.687   2.295
   49   2HD1  ILE   6          2HD1      ILE   6   0.914  -8.968   1.785
   50   3HD1  ILE   6          3HD1      ILE   6   0.939  -7.406   0.966
   51    H    LYS   7           H        LYS   7   2.677  -4.845   6.630
   52    HA   LYS   7           HA       LYS   7   0.314  -4.363   8.278
   53   1HB   LYS   7          2HB       LYS   7   3.092  -4.210   8.753
   54   2HB   LYS   7          1HB       LYS   7   2.494  -2.559   8.826
   55   1HG   LYS   7          2HG       LYS   7   2.051  -3.052  10.960
   56   2HG   LYS   7          1HG       LYS   7   0.622  -3.849  10.302
   57   1HD   LYS   7          2HD       LYS   7   1.472  -5.944  10.622
   58   2HD   LYS   7          1HD       LYS   7   3.142  -5.416  10.409
   59   1HE   LYS   7          2HE       LYS   7   2.622  -4.123  12.667
   60   2HE   LYS   7          1HE       LYS   7   1.436  -5.415  12.844
   61   1HZ   LYS   7          1HZ       LYS   7   3.878  -5.683  13.715
   62   2HZ   LYS   7          2HZ       LYS   7   4.181  -6.145  12.117
   63   3HZ   LYS   7          3HZ       LYS   7   3.048  -6.995  13.041
   64    H    PHE   8           H        PHE   8  -1.037  -2.722   7.961
   65    HA   PHE   8           HA       PHE   8  -0.248  -0.609   6.061
   66   1HB   PHE   8          2HB       PHE   8  -2.968  -1.844   6.549
   67   2HB   PHE   8          1HB       PHE   8  -2.698  -0.421   5.549
   68    HD1  PHE   8           HD1      PHE   8  -1.610  -0.602   3.386
   69    HD2  PHE   8           HD2      PHE   8  -2.296  -4.041   5.799
   70    HE1  PHE   8           HE1      PHE   8  -1.157  -2.048   1.448
   71    HE2  PHE   8           HE2      PHE   8  -1.843  -5.493   3.863
   72    HZ   PHE   8           HZ       PHE   8  -1.272  -4.497   1.685
   73    H    GLU   9           H        GLU   9  -0.376   1.462   6.716
   74    HA   GLU   9           HA       GLU   9  -1.679   1.998   9.306
   75   1HB   GLU   9          2HB       GLU   9   0.901   3.025   8.148
   76   2HB   GLU   9          1HB       GLU   9   0.048   3.925   9.397
   77   1HG   GLU   9          2HG       GLU   9   0.769   2.571  11.004
   78   2HG   GLU   9          1HG       GLU   9   0.353   1.125  10.085
   79    H    HIS  10           H        HIS  10  -3.326   3.368   9.237
   80    HA   HIS  10           HA       HIS  10  -3.420   5.394   7.100
   81   1HB   HIS  10          2HB       HIS  10  -4.955   3.452   6.658
   82   2HB   HIS  10          1HB       HIS  10  -5.810   3.861   8.140
   83    HD1  HIS  10           HD1      HIS  10  -7.995   4.681   7.267
   84    HD2  HIS  10           HD2      HIS  10  -4.768   6.431   5.321
   85    HE1  HIS  10           HE1      HIS  10  -8.987   6.441   5.773
   86    HE2  HIS  10           HE2      HIS  10  -7.005   7.577   4.713
   87    H    ASN  11           H        ASN  11  -3.413   7.361   7.957
   88    HA   ASN  11           HA       ASN  11  -3.703   9.115   9.373
   89   1HB   ASN  11          2HB       ASN  11  -6.200   7.800   9.168
   90   2HB   ASN  11          1HB       ASN  11  -6.009   8.257  10.856
   91   1HD2  ASN  11          1HD2      ASN  11  -5.152   9.742   7.738
   92   2HD2  ASN  11          2HD2      ASN  11  -5.895  11.264   8.072
   93    H    GLY  12           H        GLY  12  -2.034   6.934  10.290
   94   1HA   GLY  12          2HA       GLY  12  -0.738   6.887  12.266
   95   2HA   GLY  12          1HA       GLY  12  -2.101   7.557  13.150
   96    H    GLU  13           H        GLU  13  -3.976   5.565  11.970
   97    HA   GLU  13           HA       GLU  13  -3.799   3.599  13.985
   98   1HB   GLU  13          2HB       GLU  13  -5.897   4.373  12.827
   99   2HB   GLU  13          1HB       GLU  13  -5.401   3.430  11.427
  100   1HG   GLU  13          2HG       GLU  13  -5.309   1.448  13.077
  101   2HG   GLU  13          1HG       GLU  13  -6.280   2.484  14.125
  102    H    ARG  14           H        ARG  14  -3.339   1.384  13.866
  103    HA   ARG  14           HA       ARG  14  -1.720   0.567  11.542
  104   1HB   ARG  14          2HB       ARG  14  -1.325  -0.237  14.432
  105   2HB   ARG  14          1HB       ARG  14  -0.345  -0.766  13.070
  106   1HG   ARG  14          2HG       ARG  14   0.426   1.503  12.707
  107   2HG   ARG  14          1HG       ARG  14  -0.611   2.084  14.010
  108   1HD   ARG  14          2HD       ARG  14   1.208   1.831  15.292
  109   2HD   ARG  14          1HD       ARG  14   0.791   0.119  15.268
  110    HE   ARG  14           HE       ARG  14   2.332   0.419  13.059
  111   1HH1  ARG  14          1HH1      ARG  14   2.794   1.239  16.434
  112   2HH1  ARG  14          2HH1      ARG  14   4.516   1.068  16.367
  113   1HH2  ARG  14          1HH2      ARG  14   4.603   0.189  12.981
  114   2HH2  ARG  14          2HH2      ARG  14   5.543   0.472  14.409
  115    H    ARG  15           H        ARG  15  -2.185  -1.346  10.590
  116    HA   ARG  15           HA       ARG  15  -3.889  -3.277  11.977
  117   1HB   ARG  15          2HB       ARG  15  -4.541  -2.099   9.269
  118   2HB   ARG  15          1HB       ARG  15  -5.364  -3.474   9.990
  119   1HG   ARG  15          2HG       ARG  15  -5.978  -1.965  11.909
  120   2HG   ARG  15          1HG       ARG  15  -5.359  -0.622  10.946
  121   1HD   ARG  15          2HD       ARG  15  -7.733  -0.743  10.650
  122   2HD   ARG  15          1HD       ARG  15  -6.955  -1.245   9.150
  123    HE   ARG  15           HE       ARG  15  -7.385  -3.585  10.453
  124   1HH1  ARG  15          1HH1      ARG  15  -9.466  -0.900   9.604
  125   2HH1  ARG  15          2HH1      ARG  15 -10.876  -1.886   9.430
  126   1HH2  ARG  15          1HH2      ARG  15  -9.252  -4.882  10.222
  127   2HH2  ARG  15          2HH2      ARG  15 -10.756  -4.146   9.782
  128    H    ILE  16           H        ILE  16  -3.760  -5.409  11.178
  129    HA   ILE  16           HA       ILE  16  -1.491  -5.892   9.348
  130    HB   ILE  16           HB       ILE  16  -2.519  -7.794  11.458
  131   1HG1  ILE  16          2HG1      ILE  16   0.118  -6.653  11.939
  132   2HG1  ILE  16          1HG1      ILE  16  -1.139  -5.422  11.938
  133   1HG2  ILE  16          1HG2      ILE  16   0.065  -7.791   9.903
  134   2HG2  ILE  16          2HG2      ILE  16  -1.331  -8.811   9.557
  135   3HG2  ILE  16          3HG2      ILE  16  -0.456  -9.000  11.075
  136   1HD1  ILE  16          1HD1      ILE  16  -2.278  -7.348  13.473
  137   2HD1  ILE  16          2HD1      ILE  16  -1.361  -5.972  14.088
  138   3HD1  ILE  16          3HD1      ILE  16  -0.570  -7.535  13.873
  139    H    ILE  17           H        ILE  17  -1.811  -7.118   7.561
  140    HA   ILE  17           HA       ILE  17  -4.270  -8.708   7.346
  141    HB   ILE  17           HB       ILE  17  -3.340  -6.924   5.096
  142   1HG1  ILE  17          2HG1      ILE  17  -5.680  -6.445   6.954
  143   2HG1  ILE  17          1HG1      ILE  17  -4.136  -5.610   7.083
  144   1HG2  ILE  17          1HG2      ILE  17  -4.691  -9.048   4.666
  145   2HG2  ILE  17          2HG2      ILE  17  -5.306  -7.545   3.980
  146   3HG2  ILE  17          3HG2      ILE  17  -6.033  -8.208   5.443
  147   1HD1  ILE  17          1HD1      ILE  17  -6.121  -5.458   4.834
  148   2HD1  ILE  17          2HD1      ILE  17  -4.493  -4.785   4.750
  149   3HD1  ILE  17          3HD1      ILE  17  -5.638  -4.176   5.946
  150    H    ALA  18           H        ALA  18  -3.953 -10.668   6.477
  151    HA   ALA  18           HA       ALA  18  -1.287 -11.337   5.489
  152   1HB   ALA  18          1HB       ALA  18  -2.870 -12.653   7.215
  153   2HB   ALA  18          2HB       ALA  18  -1.651 -13.447   6.217
  154   3HB   ALA  18          3HB       ALA  18  -3.341 -13.449   5.713
  155    H    PHE  19           H        PHE  19  -0.846 -12.125   3.461
  156    HA   PHE  19           HA       PHE  19  -3.065 -12.391   1.557
  157   1HB   PHE  19          2HB       PHE  19  -0.678 -10.577   1.303
  158   2HB   PHE  19          1HB       PHE  19  -1.499 -11.197  -0.126
  159    HD1  PHE  19           HD1      PHE  19  -3.790 -10.519  -0.635
  160    HD2  PHE  19           HD2      PHE  19  -1.691  -8.916   2.702
  161    HE1  PHE  19           HE1      PHE  19  -5.443  -8.706  -0.471
  162    HE2  PHE  19           HE2      PHE  19  -3.340  -7.099   2.872
  163    HZ   PHE  19           HZ       PHE  19  -5.220  -6.993   1.285
  164    H    SER  20           H        SER  20  -2.872 -14.090   0.216
  165    HA   SER  20           HA       SER  20  -0.566 -15.821   0.487
  166   1HB   SER  20          2HB       SER  20  -3.034 -16.217  -1.221
  167   2HB   SER  20          1HB       SER  20  -1.869 -17.451  -0.745
  168    HG   SER  20           HG       SER  20  -3.159 -17.734   0.888
  169    H    ARG  21           H        ARG  21   1.109 -15.886  -0.876
  170    HA   ARG  21           HA       ARG  21   1.025 -14.285  -3.303
  171   1HB   ARG  21          2HB       ARG  21   3.277 -15.723  -1.891
  172   2HB   ARG  21          1HB       ARG  21   3.481 -14.852  -3.405
  173   1HG   ARG  21          2HG       ARG  21   2.481 -12.847  -2.122
  174   2HG   ARG  21          1HG       ARG  21   2.883 -13.779  -0.679
  175   1HD   ARG  21          2HD       ARG  21   4.846 -13.086  -2.860
  176   2HD   ARG  21          1HD       ARG  21   4.640 -12.152  -1.380
  177    HE   ARG  21           HE       ARG  21   5.120 -14.660  -0.473
  178   1HH1  ARG  21          1HH1      ARG  21   6.801 -12.566  -2.718
  179   2HH1  ARG  21          2HH1      ARG  21   8.363 -13.218  -2.351
  180   1HH2  ARG  21          1HH2      ARG  21   7.190 -15.520   0.003
  181   2HH2  ARG  21          2HH2      ARG  21   8.584 -14.890  -0.808
  182    HA   PRO  22           HA       PRO  22   2.614 -14.240  -5.104
  183   1HB   PRO  22          2HB       PRO  22   1.558 -14.569  -7.793
  184   2HB   PRO  22          1HB       PRO  22   3.239 -14.490  -7.265
  185   1HG   PRO  22          2HG       PRO  22   2.093 -16.756  -8.237
  186   2HG   PRO  22          1HG       PRO  22   3.415 -16.767  -7.056
  187   1HD   PRO  22          2HD       PRO  22   0.474 -17.140  -6.614
  188   2HD   PRO  22          1HD       PRO  22   1.844 -18.007  -5.885
  189    H    VAL  23           H        VAL  23   1.515 -12.489  -4.476
  190    HA   VAL  23           HA       VAL  23  -1.316 -12.241  -5.205
  191    HB   VAL  23           HB       VAL  23  -0.798 -12.100  -2.801
  192   1HG1  VAL  23          1HG1      VAL  23   0.371  -9.418  -2.936
  193   2HG1  VAL  23          2HG1      VAL  23   1.424 -10.701  -3.532
  194   3HG1  VAL  23          3HG1      VAL  23   0.773 -10.784  -1.895
  195   1HG2  VAL  23          1HG2      VAL  23  -1.783  -9.514  -4.000
  196   2HG2  VAL  23          2HG2      VAL  23  -2.040 -10.038  -2.336
  197   3HG2  VAL  23          3HG2      VAL  23  -2.753 -10.947  -3.668
  198    H    LYS  24           H        LYS  24  -2.017 -10.698  -6.569
  199    HA   LYS  24           HA       LYS  24  -0.077  -9.104  -7.977
  200   1HB   LYS  24          2HB       LYS  24  -3.089  -9.010  -8.234
  201   2HB   LYS  24          1HB       LYS  24  -1.913  -8.413  -9.393
  202   1HG   LYS  24          2HG       LYS  24  -2.301 -11.304  -8.638
  203   2HG   LYS  24          1HG       LYS  24  -2.932 -10.527 -10.091
  204   1HD   LYS  24          2HD       LYS  24  -0.950 -10.621 -11.143
  205   2HD   LYS  24          1HD       LYS  24  -0.056 -10.142  -9.700
  206   1HE   LYS  24          2HE       LYS  24   0.700 -12.256  -9.721
  207   2HE   LYS  24          1HE       LYS  24  -0.870 -12.649  -9.022
  208   1HZ   LYS  24          1HZ       LYS  24  -0.033 -12.872 -11.855
  209   2HZ   LYS  24          2HZ       LYS  24  -1.658 -12.927 -11.387
  210   3HZ   LYS  24          3HZ       LYS  24  -0.578 -14.100 -10.825
  211    H    TYR  25           H        TYR  25   0.114  -6.872  -8.015
  212    HA   TYR  25           HA       TYR  25  -0.247  -5.470  -5.628
  213   1HB   TYR  25          2HB       TYR  25   1.377  -4.827  -7.382
  214   2HB   TYR  25          1HB       TYR  25   0.045  -4.322  -8.417
  215    HD1  TYR  25           HD1      TYR  25   1.194  -3.704  -4.906
  216    HD2  TYR  25           HD2      TYR  25  -0.319  -2.049  -8.521
  217    HE1  TYR  25           HE1      TYR  25   1.287  -1.459  -3.911
  218    HE2  TYR  25           HE2      TYR  25  -0.231   0.201  -7.535
  219    HH   TYR  25           HH       TYR  25  -0.256   1.214  -5.251
  220    H    GLU  26           H        GLU  26  -2.273  -5.616  -8.527
  221    HA   GLU  26           HA       GLU  26  -4.099  -3.597  -7.817
  222   1HB   GLU  26          2HB       GLU  26  -3.745  -5.071 -10.039
  223   2HB   GLU  26          1HB       GLU  26  -5.120  -5.924  -9.347
  224   1HG   GLU  26          2HG       GLU  26  -5.697  -3.173  -9.165
  225   2HG   GLU  26          1HG       GLU  26  -5.058  -3.457 -10.783
  226    H    ASP  27           H        ASP  27  -3.958  -7.029  -7.007
  227    HA   ASP  27           HA       ASP  27  -6.558  -7.192  -5.883
  228   1HB   ASP  27          2HB       ASP  27  -4.735  -9.058  -6.536
  229   2HB   ASP  27          1HB       ASP  27  -4.424  -8.961  -4.805
  230    H    VAL  28           H        VAL  28  -3.352  -6.581  -4.474
  231    HA   VAL  28           HA       VAL  28  -4.198  -6.491  -1.784
  232    HB   VAL  28           HB       VAL  28  -1.857  -4.984  -2.966
  233   1HG1  VAL  28          1HG1      VAL  28  -1.716  -6.119  -0.254
  234   2HG1  VAL  28          2HG1      VAL  28  -2.847  -4.782  -0.457
  235   3HG1  VAL  28          3HG1      VAL  28  -1.147  -4.568  -0.870
  236   1HG2  VAL  28          1HG2      VAL  28  -1.321  -7.540  -1.640
  237   2HG2  VAL  28          2HG2      VAL  28  -0.657  -6.872  -3.132
  238   3HG2  VAL  28          3HG2      VAL  28  -2.220  -7.687  -3.151
  239    H    GLU  29           H        GLU  29  -3.733  -3.897  -4.186
  240    HA   GLU  29           HA       GLU  29  -4.497  -1.794  -2.449
  241   1HB   GLU  29          2HB       GLU  29  -4.597  -0.403  -4.429
  242   2HB   GLU  29          1HB       GLU  29  -3.183  -1.445  -4.515
  243   1HG   GLU  29          2HG       GLU  29  -4.407  -2.944  -6.027
  244   2HG   GLU  29          1HG       GLU  29  -5.784  -1.847  -5.975
  245    H    HIS  30           H        HIS  30  -6.313  -3.905  -4.611
  246    HA   HIS  30           HA       HIS  30  -8.727  -2.516  -4.707
  247   1HB   HIS  30          2HB       HIS  30  -8.136  -4.576  -6.028
  248   2HB   HIS  30          1HB       HIS  30  -8.452  -5.525  -4.581
  249    HD1  HIS  30           HD1      HIS  30 -10.924  -5.814  -3.868
  250    HD2  HIS  30           HD2      HIS  30 -10.405  -3.592  -7.343
  251    HE1  HIS  30           HE1      HIS  30 -13.207  -5.650  -4.911
  252    HE2  HIS  30           HE2      HIS  30 -12.877  -4.259  -6.986
  253    H    LYS  31           H        LYS  31  -7.570  -4.873  -2.305
  254    HA   LYS  31           HA       LYS  31  -9.930  -4.825  -0.724
  255   1HB   LYS  31          2HB       LYS  31  -7.135  -5.532   0.195
  256   2HB   LYS  31          1HB       LYS  31  -8.647  -6.006   0.956
  257   1HG   LYS  31          2HG       LYS  31  -8.120  -6.812  -1.867
  258   2HG   LYS  31          1HG       LYS  31  -7.329  -7.682  -0.551
  259   1HD   LYS  31          2HD       LYS  31 -10.303  -7.213  -0.614
  260   2HD   LYS  31          1HD       LYS  31  -9.551  -8.609  -1.391
  261   1HE   LYS  31          2HE       LYS  31  -8.408  -8.700   1.071
  262   2HE   LYS  31          1HE       LYS  31  -9.993  -8.034   1.460
  263   1HZ   LYS  31          1HZ       LYS  31 -11.001  -9.916   0.282
  264   2HZ   LYS  31          2HZ       LYS  31 -10.046 -10.425   1.582
  265   3HZ   LYS  31          3HZ       LYS  31  -9.464 -10.567   0.000
  266    H    VAL  32           H        VAL  32  -6.773  -3.195  -0.365
  267    HA   VAL  32           HA       VAL  32  -7.391  -1.817   2.007
  268    HB   VAL  32           HB       VAL  32  -5.498  -0.885  -0.157
  269   1HG1  VAL  32          1HG1      VAL  32  -4.398   0.365   1.562
  270   2HG1  VAL  32          2HG1      VAL  32  -5.433  -0.337   2.806
  271   3HG1  VAL  32          3HG1      VAL  32  -6.114   0.769   1.614
  272   1HG2  VAL  32          1HG2      VAL  32  -5.363  -3.285   1.169
  273   2HG2  VAL  32          2HG2      VAL  32  -4.355  -2.238   2.166
  274   3HG2  VAL  32          3HG2      VAL  32  -3.998  -2.433   0.450
  275    H    THR  33           H        THR  33  -7.853  -0.911  -1.393
  276    HA   THR  33           HA       THR  33  -8.698   1.741  -0.890
  277    HB   THR  33           HB       THR  33  -9.265  -0.070  -3.250
  278    HG1  THR  33           HG1      THR  33  -7.249   0.324  -3.614
  279   1HG2  THR  33          1HG2      THR  33 -10.353   2.485  -2.698
  280   2HG2  THR  33          2HG2      THR  33 -10.498   1.513  -4.161
  281   3HG2  THR  33          3HG2      THR  33  -9.166   2.656  -3.992
  282    H    THR  34           H        THR  34 -10.502  -1.319  -1.232
  283    HA   THR  34           HA       THR  34 -13.060  -0.053  -1.026
  284    HB   THR  34           HB       THR  34 -12.396  -2.960  -0.515
  285    HG1  THR  34           HG1      THR  34 -12.866  -1.538  -2.907
  286   1HG2  THR  34          1HG2      THR  34 -14.869  -1.525  -0.468
  287   2HG2  THR  34          2HG2      THR  34 -14.555  -3.230  -0.145
  288   3HG2  THR  34          3HG2      THR  34 -14.869  -2.688  -1.794
  289    H    VAL  35           H        VAL  35 -10.975  -1.753   1.303
  290    HA   VAL  35           HA       VAL  35 -12.808  -1.642   3.454
  291    HB   VAL  35           HB       VAL  35  -9.793  -1.806   3.600
  292   1HG1  VAL  35          1HG1      VAL  35 -11.365  -3.090   5.702
  293   2HG1  VAL  35          2HG1      VAL  35 -11.547  -1.336   5.661
  294   3HG1  VAL  35          3HG1      VAL  35  -9.944  -2.053   5.820
  295   1HG2  VAL  35          1HG2      VAL  35  -9.895  -4.012   3.170
  296   2HG2  VAL  35          2HG2      VAL  35 -11.418  -3.606   2.385
  297   3HG2  VAL  35          3HG2      VAL  35 -11.417  -4.219   4.037
  298    H    PHE  36           H        PHE  36 -10.133   0.532   2.524
  299    HA   PHE  36           HA       PHE  36 -10.981   2.376   4.645
  300   1HB   PHE  36          2HB       PHE  36  -8.452   2.439   2.995
  301   2HB   PHE  36          1HB       PHE  36  -8.822   3.457   4.383
  302    HD1  PHE  36           HD1      PHE  36  -9.944   1.484   6.270
  303    HD2  PHE  36           HD2      PHE  36  -6.607   1.211   3.643
  304    HE1  PHE  36           HE1      PHE  36  -8.913  -0.181   7.755
  305    HE2  PHE  36           HE2      PHE  36  -5.572  -0.456   5.124
  306    HZ   PHE  36           HZ       PHE  36  -6.726  -1.155   7.183
  307    H    GLY  37           H        GLY  37 -12.005   1.978   1.649
  308   1HA   GLY  37          2HA       GLY  37 -13.105   3.394   0.206
  309   2HA   GLY  37          1HA       GLY  37 -12.794   4.697   1.340
  310    H    GLN  38           H        GLN  38 -12.716   5.341  -1.259
  311    HA   GLN  38           HA       GLN  38  -9.835   5.578  -1.841
  312   1HB   GLN  38          2HB       GLN  38 -10.737   5.987  -4.275
  313   2HB   GLN  38          1HB       GLN  38 -10.505   4.356  -3.674
  314   1HG   GLN  38          2HG       GLN  38 -12.818   4.039  -3.351
  315   2HG   GLN  38          1HG       GLN  38 -13.158   5.759  -3.548
  316   1HE2  GLN  38          1HE2      GLN  38 -12.688   6.685  -5.690
  317   2HE2  GLN  38          2HE2      GLN  38 -12.947   5.701  -7.086
  318    HA   PRO  39           HA       PRO  39  -8.938   6.568  -3.697
  319   1HB   PRO  39          2HB       PRO  39  -7.250   8.532  -4.312
  320   2HB   PRO  39          1HB       PRO  39  -8.807   8.378  -5.136
  321   1HG   PRO  39          2HG       PRO  39  -7.977  10.270  -2.986
  322   2HG   PRO  39          1HG       PRO  39  -9.047  10.544  -4.371
  323   1HD   PRO  39          2HD       PRO  39  -9.845   9.979  -1.738
  324   2HD   PRO  39          1HD       PRO  39 -10.875   9.915  -3.179
  325    H    LEU  40           H        LEU  40  -6.860   5.804  -3.211
  326    HA   LEU  40           HA       LEU  40  -5.532   6.865  -0.819
  327   1HB   LEU  40          2HB       LEU  40  -6.429   4.030  -1.269
  328   2HB   LEU  40          1HB       LEU  40  -5.089   4.401  -0.201
  329    HG   LEU  40           HG       LEU  40  -7.858   5.548   0.152
  330   1HD1  LEU  40          1HD1      LEU  40  -8.351   3.860   1.697
  331   2HD1  LEU  40          2HD1      LEU  40  -6.683   3.290   1.742
  332   3HD1  LEU  40          3HD1      LEU  40  -7.673   3.011   0.309
  333   1HD2  LEU  40          1HD2      LEU  40  -5.764   6.666   1.150
  334   2HD2  LEU  40          2HD2      LEU  40  -5.714   5.274   2.230
  335   3HD2  LEU  40          3HD2      LEU  40  -7.124   6.332   2.221
  336    H    ASP  41           H        ASP  41  -3.351   6.956  -1.000
  337    HA   ASP  41           HA       ASP  41  -2.145   5.729  -3.389
  338   1HB   ASP  41          2HB       ASP  41  -2.063   8.337  -2.645
  339   2HB   ASP  41          1HB       ASP  41  -0.601   7.745  -1.864
  340    H    LEU  42           H        LEU  42  -0.513   4.278  -3.216
  341    HA   LEU  42           HA       LEU  42   0.180   3.359  -0.529
  342   1HB   LEU  42          2HB       LEU  42   0.183   2.166  -3.249
  343   2HB   LEU  42          1HB       LEU  42   1.382   1.566  -2.120
  344    HG   LEU  42           HG       LEU  42  -1.369   1.691  -1.061
  345   1HD1  LEU  42          1HD1      LEU  42  -0.635  -0.273  -3.229
  346   2HD1  LEU  42          2HD1      LEU  42  -1.857   0.993  -3.339
  347   3HD1  LEU  42          3HD1      LEU  42  -2.077  -0.347  -2.216
  348   1HD2  LEU  42          1HD2      LEU  42   0.935   0.600  -0.218
  349   2HD2  LEU  42          2HD2      LEU  42   0.243  -0.782  -1.067
  350   3HD2  LEU  42          3HD2      LEU  42  -0.655  -0.010   0.240
  351    H    HIS  43           H        HIS  43   1.808   4.545   0.316
  352    HA   HIS  43           HA       HIS  43   4.138   5.165  -1.358
  353   1HB   HIS  43          2HB       HIS  43   2.777   6.830   0.236
  354   2HB   HIS  43          1HB       HIS  43   3.917   6.208   1.423
  355    HD1  HIS  43           HD1      HIS  43   6.110   6.062  -1.137
  356    HD2  HIS  43           HD2      HIS  43   4.168   9.323   0.559
  357    HE1  HIS  43           HE1      HIS  43   7.526   8.054  -1.704
  358    HE2  HIS  43           HE2      HIS  43   6.382  10.005  -0.593
  359    H    TYR  44           H        TYR  44   5.919   3.969  -1.196
  360    HA   TYR  44           HA       TYR  44   6.281   2.258   1.164
  361   1HB   TYR  44          2HB       TYR  44   6.238   0.950  -0.817
  362   2HB   TYR  44          1HB       TYR  44   7.288   2.071  -1.675
  363    HD1  TYR  44           HD2      TYR  44   9.716   2.197  -1.035
  364    HD2  TYR  44           HD1      TYR  44   7.133  -0.842   0.442
  365    HE1  TYR  44           HE2      TYR  44  11.674   0.835  -0.433
  366    HE2  TYR  44           HE1      TYR  44   9.081  -2.213   1.049
  367    HH   TYR  44           HH       TYR  44  12.034  -1.148   1.440
  368    H    MET  45           H        MET  45   7.943   2.588   2.537
  369    HA   MET  45           HA       MET  45  10.013   4.531   1.738
  370   1HB   MET  45          2HB       MET  45   9.020   4.007   4.545
  371   2HB   MET  45          1HB       MET  45  10.162   5.246   4.046
  372   1HG   MET  45          2HG       MET  45   8.175   6.025   2.524
  373   2HG   MET  45          1HG       MET  45   7.209   5.135   3.700
  374   1HE   MET  45          1HE       MET  45   6.196   8.036   3.850
  375   2HE   MET  45          2HE       MET  45   7.527   8.252   2.715
  376   3HE   MET  45          3HE       MET  45   7.428   9.258   4.160
  377    H    ASN  46           H        ASN  46  12.023   3.771   1.637
  378    HA   ASN  46           HA       ASN  46  12.589   1.088   2.581
  379   1HB   ASN  46          2HB       ASN  46  13.433   2.512   0.401
  380   2HB   ASN  46          1HB       ASN  46  14.821   2.658   1.474
  381   1HD2  ASN  46          1HD2      ASN  46  14.142   1.084  -1.069
  382   2HD2  ASN  46          2HD2      ASN  46  14.690  -0.512  -0.704
  383    H    ASN  47           H        ASN  47  14.275   4.221   2.941
  384    HA   ASN  47           HA       ASN  47  14.577   3.904   5.763
  385   1HB   ASN  47          2HB       ASN  47  16.394   2.412   4.516
  386   2HB   ASN  47          1HB       ASN  47  17.230   3.956   4.394
  387   1HD2  ASN  47          1HD2      ASN  47  18.864   3.572   5.806
  388   2HD2  ASN  47          2HD2      ASN  47  18.631   3.285   7.493
  389    H    GLU  48           H        GLU  48  16.446   5.405   3.116
  390    HA   GLU  48           HA       GLU  48  15.992   8.020   4.394
  391   1HB   GLU  48          2HB       GLU  48  18.257   7.203   2.565
  392   2HB   GLU  48          1HB       GLU  48  18.062   8.773   3.331
  393   1HG   GLU  48          2HG       GLU  48  18.090   6.448   5.144
  394   2HG   GLU  48          1HG       GLU  48  19.602   6.803   4.310
  395    H    LEU  49           H        LEU  49  15.264   6.146   1.633
  396    HA   LEU  49           HA       LEU  49  14.487   8.573   0.154
  397   1HB   LEU  49          2HB       LEU  49  16.307   6.853  -0.741
  398   2HB   LEU  49          1HB       LEU  49  14.874   5.990  -1.271
  399    HG   LEU  49           HG       LEU  49  14.241   8.346  -2.296
  400   1HD1  LEU  49          1HD1      LEU  49  15.897   9.808  -1.793
  401   2HD1  LEU  49          2HD1      LEU  49  16.608   9.121  -3.252
  402   3HD1  LEU  49          3HD1      LEU  49  17.125   8.548  -1.666
  403   1HD2  LEU  49          1HD2      LEU  49  14.606   6.173  -3.473
  404   2HD2  LEU  49          2HD2      LEU  49  16.313   6.593  -3.602
  405   3HD2  LEU  49          3HD2      LEU  49  15.097   7.593  -4.396
  406    H    SER  50           H        SER  50  12.457   8.654  -0.773
  407    HA   SER  50           HA       SER  50  10.558   6.632   0.192
  408   1HB   SER  50          2HB       SER  50   9.740   9.250  -1.043
  409   2HB   SER  50          1HB       SER  50   8.883   8.264   0.141
  410    HG   SER  50           HG       SER  50  10.551  10.298   0.571
  411    H    ILE  51           H        ILE  51   9.690   5.218  -1.172
  412    HA   ILE  51           HA       ILE  51   9.777   5.808  -4.063
  413    HB   ILE  51           HB       ILE  51   9.854   3.053  -2.833
  414   1HG1  ILE  51          2HG1      ILE  51  12.194   4.551  -4.027
  415   2HG1  ILE  51          1HG1      ILE  51  11.887   4.471  -2.295
  416   1HG2  ILE  51          1HG2      ILE  51   9.191   2.604  -4.944
  417   2HG2  ILE  51          2HG2      ILE  51  10.914   2.776  -5.281
  418   3HG2  ILE  51          3HG2      ILE  51   9.818   4.123  -5.583
  419   1HD1  ILE  51          1HD1      ILE  51  11.912   1.862  -3.596
  420   2HD1  ILE  51          2HD1      ILE  51  12.726   2.415  -2.132
  421   3HD1  ILE  51          3HD1      ILE  51  13.436   2.738  -3.713
  422    H    LEU  52           H        LEU  52   7.904   5.653  -5.191
  423    HA   LEU  52           HA       LEU  52   5.515   4.820  -3.704
  424   1HB   LEU  52          2HB       LEU  52   5.678   7.148  -4.690
  425   2HB   LEU  52          1HB       LEU  52   5.596   6.392  -6.270
  426    HG   LEU  52           HG       LEU  52   3.397   5.342  -5.450
  427   1HD1  LEU  52          1HD1      LEU  52   3.090   7.667  -3.658
  428   2HD1  LEU  52          2HD1      LEU  52   4.064   6.327  -3.052
  429   3HD1  LEU  52          3HD1      LEU  52   2.397   6.049  -3.556
  430   1HD2  LEU  52          1HD2      LEU  52   2.283   7.738  -5.758
  431   2HD2  LEU  52          2HD2      LEU  52   3.014   6.853  -7.097
  432   3HD2  LEU  52          3HD2      LEU  52   3.917   8.136  -6.291
  433    H    LEU  53           H        LEU  53   4.274   3.162  -4.360
  434    HA   LEU  53           HA       LEU  53   5.287   1.455  -6.475
  435   1HB   LEU  53          2HB       LEU  53   2.872   1.031  -4.712
  436   2HB   LEU  53          1HB       LEU  53   3.702  -0.179  -5.671
  437    HG   LEU  53           HG       LEU  53   5.749   0.568  -4.120
  438   1HD1  LEU  53          1HD1      LEU  53   4.459   0.627  -1.766
  439   2HD1  LEU  53          2HD1      LEU  53   3.320   1.537  -2.758
  440   3HD1  LEU  53          3HD1      LEU  53   4.993   2.074  -2.621
  441   1HD2  LEU  53          1HD2      LEU  53   5.151  -1.697  -4.270
  442   2HD2  LEU  53          2HD2      LEU  53   3.560  -1.412  -3.563
  443   3HD2  LEU  53          3HD2      LEU  53   5.006  -1.301  -2.558
  444    H    LYS  54           H        LYS  54   4.822   2.777  -8.302
  445    HA   LYS  54           HA       LYS  54   2.024   3.340  -8.891
  446   1HB   LYS  54          2HB       LYS  54   4.615   4.065 -10.237
  447   2HB   LYS  54          1HB       LYS  54   3.067   4.320 -11.031
  448   1HG   LYS  54          2HG       LYS  54   2.355   5.772  -9.211
  449   2HG   LYS  54          1HG       LYS  54   3.887   5.492  -8.380
  450   1HD   LYS  54          2HD       LYS  54   5.090   6.501 -10.260
  451   2HD   LYS  54          1HD       LYS  54   3.560   6.777 -11.093
  452   1HE   LYS  54          2HE       LYS  54   4.315   7.948  -8.416
  453   2HE   LYS  54          1HE       LYS  54   4.425   8.797  -9.956
  454   1HZ   LYS  54          1HZ       LYS  54   1.969   7.846  -8.593
  455   2HZ   LYS  54          2HZ       LYS  54   1.982   8.386 -10.195
  456   3HZ   LYS  54          3HZ       LYS  54   2.405   9.441  -8.944
  457    H    ASN  55           H        ASN  55   4.617   1.221  -9.972
  458    HA   ASN  55           HA       ASN  55   2.685  -0.149 -11.729
  459   1HB   ASN  55          2HB       ASN  55   5.497   0.666 -12.182
  460   2HB   ASN  55          1HB       ASN  55   5.070  -0.949 -12.741
  461   1HD2  ASN  55          1HD2      ASN  55   3.676   2.329 -12.770
  462   2HD2  ASN  55          2HD2      ASN  55   3.173   2.276 -14.422
  463    H    GLN  56           H        GLN  56   3.037  -2.485 -11.979
  464    HA   GLN  56           HA       GLN  56   3.255  -3.806  -9.511
  465   1HB   GLN  56          2HB       GLN  56   2.329  -4.513 -11.979
  466   2HB   GLN  56          1HB       GLN  56   3.812  -5.452 -11.894
  467   1HG   GLN  56          2HG       GLN  56   2.034  -5.540  -9.533
  468   2HG   GLN  56          1HG       GLN  56   1.473  -6.347 -10.994
  469   1HE2  GLN  56          1HE2      GLN  56   2.696  -7.108  -8.221
  470   2HE2  GLN  56          2HE2      GLN  56   3.807  -8.361  -8.639
  471    H    ASP  57           H        ASP  57   5.639  -3.168 -12.021
  472    HA   ASP  57           HA       ASP  57   7.633  -4.959 -11.250
  473   1HB   ASP  57          2HB       ASP  57   7.400  -2.981 -13.157
  474   2HB   ASP  57          1HB       ASP  57   8.657  -2.348 -12.099
  475    H    ASP  58           H        ASP  58   6.884  -1.712 -10.034
  476    HA   ASP  58           HA       ASP  58   9.126  -1.377  -8.378
  477   1HB   ASP  58          2HB       ASP  58   6.385  -0.201  -8.504
  478   2HB   ASP  58          1HB       ASP  58   7.319   0.059  -7.037
  479    H    LEU  59           H        LEU  59   5.961  -2.851  -7.750
  480    HA   LEU  59           HA       LEU  59   6.425  -3.363  -4.997
  481   1HB   LEU  59          2HB       LEU  59   4.179  -3.282  -6.030
  482   2HB   LEU  59          1HB       LEU  59   4.541  -4.761  -6.897
  483    HG   LEU  59           HG       LEU  59   5.013  -5.571  -4.356
  484   1HD1  LEU  59          1HD1      LEU  59   4.361  -3.797  -3.076
  485   2HD1  LEU  59          2HD1      LEU  59   2.831  -4.666  -3.201
  486   3HD1  LEU  59          3HD1      LEU  59   3.140  -3.267  -4.230
  487   1HD2  LEU  59          1HD2      LEU  59   3.663  -7.008  -5.453
  488   2HD2  LEU  59          2HD2      LEU  59   2.735  -5.721  -6.223
  489   3HD2  LEU  59          3HD2      LEU  59   2.397  -6.173  -4.553
  490    H    ASP  60           H        ASP  60   6.905  -5.269  -7.948
  491    HA   ASP  60           HA       ASP  60   7.550  -7.713  -6.720
  492   1HB   ASP  60          2HB       ASP  60   7.221  -6.949  -9.289
  493   2HB   ASP  60          1HB       ASP  60   8.979  -7.033  -9.229
  494    H    LYS  61           H        LYS  61   9.602  -4.974  -7.670
  495    HA   LYS  61           HA       LYS  61  12.054  -6.197  -6.925
  496   1HB   LYS  61          2HB       LYS  61  11.365  -3.900  -8.253
  497   2HB   LYS  61          1HB       LYS  61  11.942  -3.265  -6.717
  498   1HG   LYS  61          2HG       LYS  61  14.066  -3.677  -7.233
  499   2HG   LYS  61          1HG       LYS  61  13.700  -5.310  -7.792
  500   1HD   LYS  61          2HD       LYS  61  12.884  -3.020  -9.510
  501   2HD   LYS  61          1HD       LYS  61  14.597  -3.437  -9.439
  502   1HE   LYS  61          2HE       LYS  61  12.445  -5.463 -10.012
  503   2HE   LYS  61          1HE       LYS  61  13.239  -4.533 -11.281
  504   1HZ   LYS  61          1HZ       LYS  61  15.363  -5.467 -10.008
  505   2HZ   LYS  61          2HZ       LYS  61  14.605  -6.316 -11.259
  506   3HZ   LYS  61          3HZ       LYS  61  14.277  -6.714  -9.649
  507    H    ALA  62           H        ALA  62   9.684  -4.243  -5.196
  508    HA   ALA  62           HA       ALA  62  11.200  -3.677  -2.897
  509   1HB   ALA  62          1HB       ALA  62   9.202  -2.976  -1.896
  510   2HB   ALA  62          2HB       ALA  62   8.226  -4.087  -2.856
  511   3HB   ALA  62          3HB       ALA  62   8.962  -2.676  -3.618
  512    H    ILE  63           H        ILE  63   9.135  -6.448  -3.711
  513    HA   ILE  63           HA       ILE  63   9.205  -7.676  -1.167
  514    HB   ILE  63           HB       ILE  63   8.910  -9.062  -3.839
  515   1HG1  ILE  63          2HG1      ILE  63   6.587  -8.357  -2.094
  516   2HG1  ILE  63          1HG1      ILE  63   7.292  -7.094  -3.094
  517   1HG2  ILE  63          1HG2      ILE  63   8.677  -9.931  -1.025
  518   2HG2  ILE  63          2HG2      ILE  63   9.119 -10.847  -2.464
  519   3HG2  ILE  63          3HG2      ILE  63   7.423 -10.502  -2.126
  520   1HD1  ILE  63          1HD1      ILE  63   5.453  -9.123  -3.824
  521   2HD1  ILE  63          2HD1      ILE  63   6.945  -9.369  -4.731
  522   3HD1  ILE  63          3HD1      ILE  63   6.109  -7.817  -4.810
  523    H    ASP  64           H        ASP  64  11.302  -7.974  -4.012
  524    HA   ASP  64           HA       ASP  64  12.870 -10.119  -3.208
  525   1HB   ASP  64          2HB       ASP  64  12.942  -8.986  -5.447
  526   2HB   ASP  64          1HB       ASP  64  13.877  -7.690  -4.704
  527    H    ILE  65           H        ILE  65  13.148  -6.693  -2.360
  528    HA   ILE  65           HA       ILE  65  15.606  -6.921  -0.958
  529    HB   ILE  65           HB       ILE  65  13.458  -4.841  -0.504
  530   1HG1  ILE  65          2HG1      ILE  65  15.778  -4.756  -2.451
  531   2HG1  ILE  65          1HG1      ILE  65  14.099  -5.026  -2.905
  532   1HG2  ILE  65          1HG2      ILE  65  15.793  -3.561  -0.133
  533   2HG2  ILE  65          2HG2      ILE  65  16.251  -5.182   0.389
  534   3HG2  ILE  65          3HG2      ILE  65  14.901  -4.354   1.165
  535   1HD1  ILE  65          1HD1      ILE  65  14.423  -2.629  -1.311
  536   2HD1  ILE  65          2HD1      ILE  65  13.654  -2.853  -2.883
  537   3HD1  ILE  65          3HD1      ILE  65  15.397  -2.602  -2.783
  538    H    LEU  66           H        LEU  66  12.209  -7.063   0.055
  539    HA   LEU  66           HA       LEU  66  12.707  -7.240   2.834
  540   1HB   LEU  66          2HB       LEU  66  10.489  -6.802   1.500
  541   2HB   LEU  66          1HB       LEU  66  10.331  -8.546   1.568
  542    HG   LEU  66           HG       LEU  66  10.769  -8.110   4.162
  543   1HD1  LEU  66          1HD1      LEU  66  11.052  -5.668   3.797
  544   2HD1  LEU  66          2HD1      LEU  66   9.771  -6.074   4.939
  545   3HD1  LEU  66          3HD1      LEU  66   9.363  -5.591   3.293
  546   1HD2  LEU  66          1HD2      LEU  66   8.843  -9.248   3.783
  547   2HD2  LEU  66          2HD2      LEU  66   8.314  -8.155   2.506
  548   3HD2  LEU  66          3HD2      LEU  66   8.134  -7.687   4.196
  549    H    ASP  67           H        ASP  67  12.180  -9.727   0.341
  550    HA   ASP  67           HA       ASP  67  12.243 -11.977   1.994
  551   1HB   ASP  67          2HB       ASP  67  11.921 -11.597  -0.681
  552   2HB   ASP  67          1HB       ASP  67  13.538 -12.294  -0.644
  553    H    ARG  68           H        ARG  68  14.891 -10.165   0.501
  554    HA   ARG  68           HA       ARG  68  16.985 -11.926   1.150
  555   1HB   ARG  68          2HB       ARG  68  16.769  -9.066   0.387
  556   2HB   ARG  68          1HB       ARG  68  18.261  -9.559   1.174
  557   1HG   ARG  68          2HG       ARG  68  17.446 -11.376  -0.948
  558   2HG   ARG  68          1HG       ARG  68  17.710  -9.725  -1.509
  559   1HD   ARG  68          2HD       ARG  68  19.929  -9.717  -0.532
  560   2HD   ARG  68          1HD       ARG  68  19.666 -11.330   0.131
  561    HE   ARG  68           HE       ARG  68  20.361 -10.652  -2.578
  562   1HH1  ARG  68          1HH1      ARG  68  18.902 -13.080  -0.518
  563   2HH1  ARG  68          2HH1      ARG  68  19.219 -14.381  -1.614
  564   1HH2  ARG  68          1HH2      ARG  68  20.778 -12.370  -4.023
  565   2HH2  ARG  68          2HH2      ARG  68  20.286 -13.978  -3.607
  566    H    SER  69           H        SER  69  15.380  -9.411   3.019
  567    HA   SER  69           HA       SER  69  17.286  -9.598   5.191
  568   1HB   SER  69          2HB       SER  69  16.286  -7.425   4.731
  569   2HB   SER  69          1HB       SER  69  14.669  -8.090   4.964
  570    HG   SER  69           HG       SER  69  16.703  -7.706   6.898
  571    H    SER  70           H        SER  70  17.229 -11.460   6.324
  572    HA   SER  70           HA       SER  70  14.893 -13.025   6.706
  573   1HB   SER  70          2HB       SER  70  16.243 -14.396   8.175
  574   2HB   SER  70          1HB       SER  70  17.223 -13.931   6.785
  575    HG   SER  70           HG       SER  70  17.551 -13.335   9.434
  576    H    SER  71           H        SER  71  16.417 -10.460   8.561
  577    HA   SER  71           HA       SER  71  15.035 -10.881  10.993
  578   1HB   SER  71          2HB       SER  71  16.923  -9.542  11.238
  579   2HB   SER  71          1HB       SER  71  16.573  -8.602   9.790
  580    HG   SER  71           HG       SER  71  15.198  -7.378  10.891
  581    H    MET  72           H        MET  72  14.368  -8.836   8.165
  582    HA   MET  72           HA       MET  72  11.940  -7.790   9.324
  583   1HB   MET  72          2HB       MET  72  13.659  -6.974   7.291
  584   2HB   MET  72          1HB       MET  72  12.187  -7.437   6.447
  585   1HG   MET  72          2HG       MET  72  12.013  -5.136   6.928
  586   2HG   MET  72          1HG       MET  72  10.927  -5.970   8.035
  587   1HE   MET  72          1HE       MET  72  13.301  -3.162   7.779
  588   2HE   MET  72          2HE       MET  72  13.139  -2.682   9.468
  589   3HE   MET  72          3HE       MET  72  11.700  -3.009   8.502
  590    H    LYS  73           H        LYS  73  10.055  -8.786   9.323
  591    HA   LYS  73           HA       LYS  73   9.561 -10.903   7.336
  592   1HB   LYS  73          2HB       LYS  73   7.823 -11.702   9.016
  593   2HB   LYS  73          1HB       LYS  73   9.510 -11.910   9.465
  594   1HG   LYS  73          2HG       LYS  73   9.347  -9.850  10.835
  595   2HG   LYS  73          1HG       LYS  73   7.621  -9.787  10.462
  596   1HD   LYS  73          2HD       LYS  73   8.985 -12.134  11.776
  597   2HD   LYS  73          1HD       LYS  73   8.177 -10.842  12.663
  598   1HE   LYS  73          2HE       LYS  73   6.176 -11.752  12.314
  599   2HE   LYS  73          1HE       LYS  73   6.474 -11.885  10.581
  600   1HZ   LYS  73          1HZ       LYS  73   7.406 -13.828  12.628
  601   2HZ   LYS  73          2HZ       LYS  73   7.621 -13.964  10.955
  602   3HZ   LYS  73          3HZ       LYS  73   6.066 -14.044  11.614
  603    H    SER  74           H        SER  74   8.094  -8.123   8.980
  604    HA   SER  74           HA       SER  74   5.748  -8.267   7.256
  605   1HB   SER  74          2HB       SER  74   4.772  -6.605   8.662
  606   2HB   SER  74          1HB       SER  74   5.606  -7.729   9.734
  607    HG   SER  74           HG       SER  74   7.403  -6.173   9.637
  608    H    LEU  75           H        LEU  75   4.976  -6.144   6.274
  609    HA   LEU  75           HA       LEU  75   7.261  -4.843   4.949
  610   1HB   LEU  75          2HB       LEU  75   4.853  -5.987   3.954
  611   2HB   LEU  75          1HB       LEU  75   4.795  -4.264   3.639
  612    HG   LEU  75           HG       LEU  75   7.289  -5.720   2.908
  613   1HD1  LEU  75          1HD1      LEU  75   6.085  -6.073   0.622
  614   2HD1  LEU  75          2HD1      LEU  75   4.625  -6.097   1.611
  615   3HD1  LEU  75          3HD1      LEU  75   5.909  -7.270   1.907
  616   1HD2  LEU  75          1HD2      LEU  75   5.731  -3.584   1.464
  617   2HD2  LEU  75          2HD2      LEU  75   7.400  -4.078   1.183
  618   3HD2  LEU  75          3HD2      LEU  75   6.967  -3.244   2.675
  619    H    ARG  76           H        ARG  76   7.594  -2.710   5.166
  620    HA   ARG  76           HA       ARG  76   5.770  -1.197   6.864
  621   1HB   ARG  76          2HB       ARG  76   8.210  -1.187   7.331
  622   2HB   ARG  76          1HB       ARG  76   8.485  -0.420   5.774
  623   1HG   ARG  76          2HG       ARG  76   7.753   1.606   6.481
  624   2HG   ARG  76          1HG       ARG  76   6.591   0.917   7.615
  625   1HD   ARG  76          2HD       ARG  76   8.060   0.933   9.309
  626   2HD   ARG  76          1HD       ARG  76   9.377   0.347   8.295
  627    HE   ARG  76           HE       ARG  76  10.070   2.506   7.999
  628   1HH1  ARG  76          1HH1      ARG  76   6.804   2.557   9.272
  629   2HH1  ARG  76          2HH1      ARG  76   6.804   4.267   9.544
  630   1HH2  ARG  76          1HH2      ARG  76  10.062   4.762   8.357
  631   2HH2  ARG  76          2HH2      ARG  76   8.656   5.521   9.022
  632    H    ILE  77           H        ILE  77   4.052  -0.868   5.403
  633    HA   ILE  77           HA       ILE  77   4.647   1.002   3.197
  634    HB   ILE  77           HB       ILE  77   2.255  -0.835   3.352
  635   1HG1  ILE  77          2HG1      ILE  77   4.680  -1.216   1.591
  636   2HG1  ILE  77          1HG1      ILE  77   4.486  -2.036   3.136
  637   1HG2  ILE  77          1HG2      ILE  77   2.544  -0.237   0.751
  638   2HG2  ILE  77          2HG2      ILE  77   3.188   1.237   1.471
  639   3HG2  ILE  77          3HG2      ILE  77   1.553   0.706   1.862
  640   1HD1  ILE  77          1HD1      ILE  77   3.137  -2.502   0.557
  641   2HD1  ILE  77          2HD1      ILE  77   2.157  -2.694   2.011
  642   3HD1  ILE  77          3HD1      ILE  77   3.631  -3.643   1.810
  643    H    LEU  78           H        LEU  78   3.722   2.963   3.293
  644    HA   LEU  78           HA       LEU  78   1.604   3.393   5.297
  645   1HB   LEU  78          2HB       LEU  78   4.048   4.583   5.211
  646   2HB   LEU  78          1HB       LEU  78   3.090   5.732   4.297
  647    HG   LEU  78           HG       LEU  78   1.468   5.420   6.416
  648   1HD1  LEU  78          1HD1      LEU  78   4.164   4.540   7.282
  649   2HD1  LEU  78          2HD1      LEU  78   2.569   4.060   7.862
  650   3HD1  LEU  78          3HD1      LEU  78   3.262   5.602   8.363
  651   1HD2  LEU  78          1HD2      LEU  78   2.796   7.449   5.357
  652   2HD2  LEU  78          2HD2      LEU  78   3.765   7.259   6.817
  653   3HD2  LEU  78          3HD2      LEU  78   2.034   7.564   6.942
  654    H    LEU  79           H        LEU  79  -0.341   3.735   4.462
  655    HA   LEU  79           HA       LEU  79  -0.561   4.738   1.718
  656   1HB   LEU  79          2HB       LEU  79  -2.959   4.028   1.920
  657   2HB   LEU  79          1HB       LEU  79  -1.783   2.732   2.000
  658    HG   LEU  79           HG       LEU  79  -2.401   3.681   4.656
  659   1HD1  LEU  79          1HD1      LEU  79  -4.783   2.539   4.426
  660   2HD1  LEU  79          2HD1      LEU  79  -4.675   3.229   2.807
  661   3HD1  LEU  79          3HD1      LEU  79  -4.550   4.276   4.221
  662   1HD2  LEU  79          1HD2      LEU  79  -3.277   1.016   3.758
  663   2HD2  LEU  79          2HD2      LEU  79  -2.281   1.484   5.136
  664   3HD2  LEU  79          3HD2      LEU  79  -1.568   1.384   3.525
  665    H    LEU  80           H        LEU  80  -1.346   6.693   1.239
  666    HA   LEU  80           HA       LEU  80  -2.609   8.242   3.406
  667   1HB   LEU  80          2HB       LEU  80  -1.590  10.278   2.386
  668   2HB   LEU  80          1HB       LEU  80  -0.440   9.176   3.113
  669    HG   LEU  80           HG       LEU  80  -0.427   8.340   0.505
  670   1HD1  LEU  80          1HD1      LEU  80  -0.334  11.311   0.260
  671   2HD1  LEU  80          2HD1      LEU  80  -1.880  10.476   0.134
  672   3HD1  LEU  80          3HD1      LEU  80  -0.575  10.085  -0.985
  673   1HD2  LEU  80          1HD2      LEU  80   1.618   8.548   1.540
  674   2HD2  LEU  80          2HD2      LEU  80   1.281  10.179   2.118
  675   3HD2  LEU  80          3HD2      LEU  80   1.663   9.907   0.417
  676    H    SER  81           H        SER  81  -4.529   9.131   2.957
  677    HA   SER  81           HA       SER  81  -5.767   8.584   0.429
  678   1HB   SER  81          2HB       SER  81  -7.105   8.443   2.447
  679   2HB   SER  81          1HB       SER  81  -6.753  10.126   2.844
  680    HG   SER  81           HG       SER  81  -8.795   9.307   1.519
  681    H    GLN  82           H        GLN  82  -6.158   9.927  -1.239
  682    HA   GLN  82           HA       GLN  82  -4.809  12.485  -1.220
  683   1HB   GLN  82          2HB       GLN  82  -4.697  10.734  -3.107
  684   2HB   GLN  82          1HB       GLN  82  -6.281  11.336  -3.571
  685   1HG   GLN  82          2HG       GLN  82  -4.683  12.454  -4.909
  686   2HG   GLN  82          1HG       GLN  82  -5.272  13.620  -3.724
  687   1HE2  GLN  82          1HE2      GLN  82  -3.821  14.684  -2.550
  688   2HE2  GLN  82          2HE2      GLN  82  -2.143  14.288  -2.426
  689    H    ASP  83           H        ASP  83  -7.657  11.664  -0.119
  690    HA   ASP  83           HA       ASP  83  -9.561  13.278  -1.373
  691   1HB   ASP  83          2HB       ASP  83  -9.294  12.029   1.322
  692   2HB   ASP  83          1HB       ASP  83 -10.519  13.276   1.117
  693    H    ARG  84           H        ARG  84  -8.649  15.280  -1.880
  694    HA   ARG  84           HA       ARG  84  -8.280  17.112   0.402
  695   1HB   ARG  84          2HB       ARG  84  -6.400  16.453  -1.554
  696   2HB   ARG  84          1HB       ARG  84  -7.020  18.022  -2.051
  697   1HG   ARG  84          2HG       ARG  84  -6.561  18.806   0.305
  698   2HG   ARG  84          1HG       ARG  84  -5.676  17.296   0.532
  699   1HD   ARG  84          2HD       ARG  84  -4.033  18.837  -0.083
  700   2HD   ARG  84          1HD       ARG  84  -4.379  17.957  -1.571
  701    HE   ARG  84           HE       ARG  84  -5.175  19.893  -2.492
  702   1HH1  ARG  84          1HH1      ARG  84  -4.957  20.328   0.978
  703   2HH1  ARG  84          2HH1      ARG  84  -5.293  22.024   0.911
  704   1HH2  ARG  84          1HH2      ARG  84  -5.621  22.133  -2.572
  705   2HH2  ARG  84          2HH2      ARG  84  -5.670  23.048  -1.104
  706    H    ASN  85           H        ASN  85  -9.153  16.929  -3.026
  707    HA   ASN  85           HA       ASN  85 -10.758  17.935  -4.266
  708   1HB   ASN  85          2HB       ASN  85 -12.122  17.416  -2.126
  709   2HB   ASN  85          1HB       ASN  85 -11.966  19.138  -1.789
  710   1HD2  ASN  85          1HD2      ASN  85 -13.838  16.826  -3.244
  711   2HD2  ASN  85          2HD2      ASN  85 -14.766  17.841  -4.290
  712    H    LEU  86           H        LEU  86  -9.988  19.504  -5.500
  713    HA   LEU  86           HA       LEU  86  -8.791  21.878  -4.384
  714   1HB   LEU  86          2HB       LEU  86  -8.335  20.467  -6.651
  715   2HB   LEU  86          1HB       LEU  86  -9.333  21.764  -7.281
  716    HG   LEU  86           HG       LEU  86  -7.767  23.425  -6.431
  717   1HD1  LEU  86          1HD1      LEU  86  -5.512  22.500  -5.619
  718   2HD1  LEU  86          2HD1      LEU  86  -6.409  21.022  -5.267
  719   3HD1  LEU  86          3HD1      LEU  86  -6.860  22.536  -4.482
  720   1HD2  LEU  86          1HD2      LEU  86  -7.475  22.276  -8.671
  721   2HD2  LEU  86          2HD2      LEU  86  -6.191  21.337  -7.908
  722   3HD2  LEU  86          3HD2      LEU  86  -6.058  23.093  -8.013
  723    H    GLU  87           H        GLU  87  -9.384  24.054  -5.099
  724    HA   GLU  87           HA       GLU  87 -12.305  24.341  -5.338
  725   1HB   GLU  87          2HB       GLU  87 -10.246  26.127  -4.041
  726   2HB   GLU  87          1HB       GLU  87 -11.904  26.629  -4.338
  727   1HG   GLU  87          2HG       GLU  87 -11.143  24.230  -2.690
  728   2HG   GLU  87          1HG       GLU  87 -11.461  25.834  -2.026
  729    H    HIS  88           H        HIS  88  -9.286  26.043  -6.222
  730    HA   HIS  88           HA       HIS  88 -10.686  27.165  -8.550
  731   1HB   HIS  88          2HB       HIS  88  -8.030  28.037  -7.400
  732   2HB   HIS  88          1HB       HIS  88  -8.975  28.867  -8.628
  733    HD1  HIS  88           HD1      HIS  88 -11.744  28.727  -7.140
  734    HD2  HIS  88           HD2      HIS  88  -8.151  29.949  -5.445
  735    HE1  HIS  88           HE1      HIS  88 -12.378  30.200  -5.205
  736    HE2  HIS  88           HE2      HIS  88 -10.188  30.971  -4.226
  737    H    HIS  89           H        HIS  89  -9.565  27.279 -10.593
  738    HA   HIS  89           HA       HIS  89  -8.429  26.419 -12.352
  739   1HB   HIS  89          2HB       HIS  89  -6.527  26.669 -10.388
  740   2HB   HIS  89          1HB       HIS  89  -6.373  24.974 -10.831
  741    HD1  HIS  89           HD1      HIS  89  -3.977  25.685 -11.764
  742    HD2  HIS  89           HD2      HIS  89  -7.243  27.258 -13.799
  743    HE1  HIS  89           HE1      HIS  89  -3.068  26.521 -13.955
  744    HE2  HIS  89           HE2      HIS  89  -5.042  27.558 -15.124
  745    H    HIS  90           H        HIS  90 -10.062  25.006 -12.946
  746    HA   HIS  90           HA       HIS  90  -9.411  22.181 -12.616
  747   1HB   HIS  90          2HB       HIS  90 -11.713  23.484 -11.369
  748   2HB   HIS  90          1HB       HIS  90 -12.180  22.146 -12.410
  749    HD1  HIS  90           HD1      HIS  90  -8.925  21.777 -10.676
  750    HD2  HIS  90           HD2      HIS  90 -12.902  20.755 -10.028
  751    HE1  HIS  90           HE1      HIS  90  -8.890  20.086  -8.819
  752    HE2  HIS  90           HE2      HIS  90 -11.316  19.615  -8.332
  753    H    HIS  91           H        HIS  91 -11.713  24.493 -14.061
  754    HA   HIS  91           HA       HIS  91 -11.905  22.795 -16.442
  755   1HB   HIS  91          2HB       HIS  91 -13.779  24.364 -17.075
  756   2HB   HIS  91          1HB       HIS  91 -14.052  23.423 -15.614
  757    HD1  HIS  91           HD1      HIS  91 -13.629  26.908 -16.837
  758    HD2  HIS  91           HD2      HIS  91 -14.055  24.920 -13.211
  759    HE1  HIS  91           HE1      HIS  91 -14.125  28.699 -15.141
  760    HE2  HIS  91           HE2      HIS  91 -14.229  27.485 -12.935
  761    H    HIS  92           H        HIS  92 -11.915  23.876 -18.583
  762    HA   HIS  92           HA       HIS  92  -9.753  25.857 -18.709
  763   1HB   HIS  92          2HB       HIS  92 -10.146  23.497 -20.098
  764   2HB   HIS  92          1HB       HIS  92 -10.650  24.725 -21.255
  765    HD1  HIS  92           HD1      HIS  92  -8.832  26.342 -22.137
  766    HD2  HIS  92           HD2      HIS  92  -7.416  23.440 -19.519
  767    HE1  HIS  92           HE1      HIS  92  -6.327  26.400 -22.358
  768    HE2  HIS  92           HE2      HIS  92  -5.498  24.571 -20.834
  769    H    HIS  93           H        HIS  93  -9.884  27.652 -20.153
  770    HA   HIS  93           HA       HIS  93 -12.480  28.894 -20.185
  771   1HB   HIS  93          2HB       HIS  93  -9.972  29.881 -19.944
  772   2HB   HIS  93          1HB       HIS  93 -10.239  30.160 -21.660
  773    HD1  HIS  93           HD1      HIS  93 -10.163  32.211 -19.048
  774    HD2  HIS  93           HD2      HIS  93 -13.362  31.180 -21.490
  775    HE1  HIS  93           HE1      HIS  93 -11.804  34.108 -18.845
  776    HE2  HIS  93           HE2      HIS  93 -13.749  33.444 -20.305
  Start of MODEL   15
    1    H    GLN   1           H        GLN   1   5.079 -20.477   4.300
    2    HA   GLN   1           HA       GLN   1   4.861 -19.638   2.011
    3   1HB   GLN   1          2HB       GLN   1   4.085 -22.320   3.031
    4   2HB   GLN   1          1HB       GLN   1   3.833 -22.016   1.317
    5   1HG   GLN   1          2HG       GLN   1   6.004 -22.162   0.860
    6   2HG   GLN   1          1HG       GLN   1   6.451 -21.155   2.236
    7   1HE2  GLN   1          1HE2      GLN   1   8.176 -22.415   2.857
    8   2HE2  GLN   1          2HE2      GLN   1   7.993 -23.996   3.530
    9    H    SER   2           H        SER   2   3.584 -18.897   0.420
   10    HA   SER   2           HA       SER   2   1.753 -18.054  -0.627
   11   1HB   SER   2          2HB       SER   2   0.472 -20.538   0.530
   12   2HB   SER   2          1HB       SER   2  -0.268 -19.507  -0.696
   13    HG   SER   2           HG       SER   2   0.738 -20.889  -1.964
   14    H    ASP   3           H        ASP   3   2.315 -16.947   1.872
   15    HA   ASP   3           HA       ASP   3  -0.227 -15.767   2.501
   16   1HB   ASP   3          2HB       ASP   3   0.992 -17.775   4.302
   17   2HB   ASP   3          1HB       ASP   3   0.475 -16.283   5.080
   18    H    VAL   4           H        VAL   4   1.085 -14.070   1.565
   19    HA   VAL   4           HA       VAL   4   3.369 -13.076   2.993
   20    HB   VAL   4           HB       VAL   4   1.732 -11.650   0.890
   21   1HG1  VAL   4          1HG1      VAL   4   4.320 -11.115   2.245
   22   2HG1  VAL   4          2HG1      VAL   4   3.059  -9.998   1.724
   23   3HG1  VAL   4          3HG1      VAL   4   4.168 -10.687   0.540
   24   1HG2  VAL   4          1HG2      VAL   4   2.711 -13.952   0.269
   25   2HG2  VAL   4          2HG2      VAL   4   4.276 -13.140   0.337
   26   3HG2  VAL   4          3HG2      VAL   4   3.044 -12.584  -0.794
   27    H    ARG   5           H        ARG   5   3.394 -11.667   4.638
   28    HA   ARG   5           HA       ARG   5   0.853 -10.586   5.579
   29   1HB   ARG   5          2HB       ARG   5   3.515 -11.131   6.799
   30   2HB   ARG   5          1HB       ARG   5   2.557  -9.829   7.492
   31   1HG   ARG   5          2HG       ARG   5   0.670 -11.478   7.716
   32   2HG   ARG   5          1HG       ARG   5   1.823 -12.736   7.265
   33   1HD   ARG   5          2HD       ARG   5   2.451 -10.846   9.499
   34   2HD   ARG   5          1HD       ARG   5   1.384 -12.222   9.777
   35    HE   ARG   5           HE       ARG   5   3.865 -12.931   8.510
   36   1HH1  ARG   5          1HH1      ARG   5   2.296 -12.355  11.588
   37   2HH1  ARG   5          2HH1      ARG   5   3.408 -13.338  12.478
   38   1HH2  ARG   5          1HH2      ARG   5   5.331 -14.223   9.693
   39   2HH2  ARG   5          2HH2      ARG   5   5.130 -14.399  11.404
   40    H    ILE   6           H        ILE   6   0.264  -8.621   4.938
   41    HA   ILE   6           HA       ILE   6   2.353  -6.648   4.291
   42    HB   ILE   6           HB       ILE   6  -0.548  -6.549   3.451
   43   1HG1  ILE   6          2HG1      ILE   6   1.767  -7.353   1.688
   44   2HG1  ILE   6          1HG1      ILE   6   0.792  -8.539   2.550
   45   1HG2  ILE   6          1HG2      ILE   6   1.897  -4.976   2.690
   46   2HG2  ILE   6          2HG2      ILE   6   0.382  -4.386   3.372
   47   3HG2  ILE   6          3HG2      ILE   6   0.429  -4.984   1.715
   48   1HD1  ILE   6          1HD1      ILE   6  -1.157  -7.157   1.347
   49   2HD1  ILE   6          2HD1      ILE   6  -0.353  -8.546   0.615
   50   3HD1  ILE   6          3HD1      ILE   6   0.146  -6.909   0.184
   51    H    LYS   7           H        LYS   7   2.559  -4.876   5.518
   52    HA   LYS   7           HA       LYS   7   0.503  -4.367   7.560
   53   1HB   LYS   7          2HB       LYS   7   3.468  -3.986   7.483
   54   2HB   LYS   7          1HB       LYS   7   2.507  -2.919   8.500
   55   1HG   LYS   7          2HG       LYS   7   1.480  -5.153   9.379
   56   2HG   LYS   7          1HG       LYS   7   2.965  -5.854   8.733
   57   1HD   LYS   7          2HD       LYS   7   4.320  -4.624  10.187
   58   2HD   LYS   7          1HD       LYS   7   3.038  -3.465  10.546
   59   1HE   LYS   7          2HE       LYS   7   1.785  -5.425  11.587
   60   2HE   LYS   7          1HE       LYS   7   3.310  -6.303  11.494
   61   1HZ   LYS   7          1HZ       LYS   7   4.323  -4.498  12.814
   62   2HZ   LYS   7          2HZ       LYS   7   3.103  -5.319  13.647
   63   3HZ   LYS   7          3HZ       LYS   7   2.796  -3.791  12.991
   64    H    PHE   8           H        PHE   8  -0.689  -2.579   7.464
   65    HA   PHE   8           HA       PHE   8   0.163  -0.421   5.641
   66   1HB   PHE   8          2HB       PHE   8  -2.602  -1.399   6.371
   67   2HB   PHE   8          1HB       PHE   8  -2.309   0.115   5.522
   68    HD1  PHE   8           HD1      PHE   8  -1.396   0.105   3.242
   69    HD2  PHE   8           HD2      PHE   8  -2.409  -3.503   5.262
   70    HE1  PHE   8           HE1      PHE   8  -1.360  -1.101   1.099
   71    HE2  PHE   8           HE2      PHE   8  -2.372  -4.715   3.120
   72    HZ   PHE   8           HZ       PHE   8  -1.847  -3.515   1.036
   73    H    GLU   9           H        GLU   9   0.032   1.706   6.317
   74    HA   GLU   9           HA       GLU   9  -0.761   2.155   9.120
   75   1HB   GLU   9          2HB       GLU   9   1.847   2.242   8.190
   76   2HB   GLU   9          1HB       GLU   9   1.360   3.931   8.180
   77   1HG   GLU   9          2HG       GLU   9   0.476   3.290  10.599
   78   2HG   GLU   9          1HG       GLU   9   1.745   2.075  10.453
   79    H    HIS  10           H        HIS  10  -2.164   3.755   9.416
   80    HA   HIS  10           HA       HIS  10  -2.281   5.975   7.518
   81   1HB   HIS  10          2HB       HIS  10  -3.929   4.137   6.850
   82   2HB   HIS  10          1HB       HIS  10  -4.799   4.521   8.331
   83    HD1  HIS  10           HD1      HIS  10  -6.870   5.504   7.275
   84    HD2  HIS  10           HD2      HIS  10  -3.370   7.295   5.934
   85    HE1  HIS  10           HE1      HIS  10  -7.608   7.496   5.932
   86    HE2  HIS  10           HE2      HIS  10  -5.477   8.486   5.023
   87    H    ASN  11           H        ASN  11  -2.202   7.784   8.674
   88    HA   ASN  11           HA       ASN  11  -2.408   9.296  10.358
   89   1HB   ASN  11          2HB       ASN  11  -4.960   7.768  10.467
   90   2HB   ASN  11          1HB       ASN  11  -4.595   8.820  11.829
   91   1HD2  ASN  11          1HD2      ASN  11  -4.372   8.944   8.279
   92   2HD2  ASN  11          2HD2      ASN  11  -5.060  10.521   8.128
   93    H    GLY  12           H        GLY  12  -0.732   7.052  10.866
   94   1HA   GLY  12          2HA       GLY  12   0.593   6.610  12.755
   95   2HA   GLY  12          1HA       GLY  12  -0.727   7.152  13.783
   96    H    GLU  13           H        GLU  13  -2.819   5.582  12.936
   97    HA   GLU  13           HA       GLU  13  -2.236   3.113  14.227
   98   1HB   GLU  13          2HB       GLU  13  -4.561   4.566  13.513
   99   2HB   GLU  13          1HB       GLU  13  -4.704   2.984  12.762
  100   1HG   GLU  13          2HG       GLU  13  -5.556   2.357  14.725
  101   2HG   GLU  13          1HG       GLU  13  -3.879   2.311  15.262
  102    H    ARG  14           H        ARG  14  -2.007   1.068  13.407
  103    HA   ARG  14           HA       ARG  14  -1.858   0.830  10.475
  104   1HB   ARG  14          2HB       ARG  14   0.040  -0.718  10.753
  105   2HB   ARG  14          1HB       ARG  14   0.402   0.891  11.362
  106   1HG   ARG  14          2HG       ARG  14  -0.209  -0.007  13.658
  107   2HG   ARG  14          1HG       ARG  14  -0.156  -1.611  12.923
  108   1HD   ARG  14          2HD       ARG  14   2.139  -1.384  12.379
  109   2HD   ARG  14          1HD       ARG  14   2.124   0.343  12.736
  110    HE   ARG  14           HE       ARG  14   1.461  -1.308  14.994
  111   1HH1  ARG  14          1HH1      ARG  14   4.084   0.126  13.175
  112   2HH1  ARG  14          2HH1      ARG  14   5.184   0.111  14.512
  113   1HH2  ARG  14          1HH2      ARG  14   2.913  -1.327  16.754
  114   2HH2  ARG  14          2HH2      ARG  14   4.520  -0.716  16.544
  115    H    ARG  15           H        ARG  15  -2.399  -1.176   9.561
  116    HA   ARG  15           HA       ARG  15  -3.713  -3.094  11.365
  117   1HB   ARG  15          2HB       ARG  15  -4.942  -1.461   9.329
  118   2HB   ARG  15          1HB       ARG  15  -5.126  -3.164   8.931
  119   1HG   ARG  15          2HG       ARG  15  -6.564  -3.539  10.615
  120   2HG   ARG  15          1HG       ARG  15  -5.704  -2.472  11.727
  121   1HD   ARG  15          2HD       ARG  15  -7.011  -0.717  11.237
  122   2HD   ARG  15          1HD       ARG  15  -7.000  -1.071   9.510
  123    HE   ARG  15           HE       ARG  15  -9.005  -2.131   9.758
  124   1HH1  ARG  15          1HH1      ARG  15  -7.527  -1.834  12.920
  125   2HH1  ARG  15          2HH1      ARG  15  -8.916  -2.432  13.764
  126   1HH2  ARG  15          1HH2      ARG  15 -10.834  -2.921  10.876
  127   2HH2  ARG  15          2HH2      ARG  15 -10.794  -3.051  12.603
  128    H    ILE  16           H        ILE  16  -3.442  -5.222  10.889
  129    HA   ILE  16           HA       ILE  16  -1.536  -5.849   8.750
  130    HB   ILE  16           HB       ILE  16  -2.427  -7.650  11.007
  131   1HG1  ILE  16          2HG1      ILE  16   0.140  -6.906  11.615
  132   2HG1  ILE  16          1HG1      ILE  16  -0.518  -5.407  10.968
  133   1HG2  ILE  16          1HG2      ILE  16  -0.725  -9.092  10.404
  134   2HG2  ILE  16          2HG2      ILE  16   0.165  -7.847   9.530
  135   3HG2  ILE  16          3HG2      ILE  16  -1.306  -8.530   8.838
  136   1HD1  ILE  16          1HD1      ILE  16  -2.322  -5.482  12.590
  137   2HD1  ILE  16          2HD1      ILE  16  -0.753  -5.543  13.391
  138   3HD1  ILE  16          3HD1      ILE  16  -1.711  -7.013  13.217
  139    H    ILE  17           H        ILE  17  -2.064  -7.093   7.034
  140    HA   ILE  17           HA       ILE  17  -4.659  -8.482   7.070
  141    HB   ILE  17           HB       ILE  17  -4.901  -6.404   5.790
  142   1HG1  ILE  17          2HG1      ILE  17  -5.711  -7.423   3.657
  143   2HG1  ILE  17          1HG1      ILE  17  -4.919  -8.926   4.115
  144   1HG2  ILE  17          1HG2      ILE  17  -2.682  -7.515   4.081
  145   2HG2  ILE  17          2HG2      ILE  17  -2.637  -6.051   5.062
  146   3HG2  ILE  17          3HG2      ILE  17  -3.688  -6.133   3.649
  147   1HD1  ILE  17          1HD1      ILE  17  -7.291  -9.011   4.591
  148   2HD1  ILE  17          2HD1      ILE  17  -7.158  -7.576   5.606
  149   3HD1  ILE  17          3HD1      ILE  17  -6.358  -9.073   6.086
  150    H    ALA  18           H        ALA  18  -4.715 -10.486   6.185
  151    HA   ALA  18           HA       ALA  18  -2.164 -11.680   5.449
  152   1HB   ALA  18          1HB       ALA  18  -4.791 -12.697   6.378
  153   2HB   ALA  18          2HB       ALA  18  -3.160 -13.146   6.876
  154   3HB   ALA  18          3HB       ALA  18  -3.822 -13.763   5.363
  155    H    PHE  19           H        PHE  19  -1.591 -12.261   3.440
  156    HA   PHE  19           HA       PHE  19  -3.646 -12.304   1.335
  157   1HB   PHE  19          2HB       PHE  19  -1.214 -10.623   1.517
  158   2HB   PHE  19          1HB       PHE  19  -1.520 -11.366  -0.049
  159    HD1  PHE  19           HD2      PHE  19  -2.716  -8.954   2.423
  160    HD2  PHE  19           HD1      PHE  19  -3.434 -10.733  -1.375
  161    HE1  PHE  19           HE2      PHE  19  -4.335  -7.177   1.900
  162    HE2  PHE  19           HE1      PHE  19  -5.054  -8.960  -1.906
  163    HZ   PHE  19           HZ       PHE  19  -5.507  -7.178  -0.265
  164    H    SER  20           H        SER  20  -3.606 -14.116   0.163
  165    HA   SER  20           HA       SER  20  -1.275 -15.889   0.381
  166   1HB   SER  20          2HB       SER  20  -4.165 -16.337  -0.366
  167   2HB   SER  20          1HB       SER  20  -2.930 -17.550  -0.704
  168    HG   SER  20           HG       SER  20  -3.160 -16.466   1.885
  169    H    ARG  21           H        ARG  21  -0.173 -16.657  -1.406
  170    HA   ARG  21           HA       ARG  21  -0.203 -15.000  -3.741
  171   1HB   ARG  21          2HB       ARG  21   1.297 -17.564  -3.173
  172   2HB   ARG  21          1HB       ARG  21   1.584 -16.514  -4.554
  173   1HG   ARG  21          2HG       ARG  21   2.571 -14.875  -3.280
  174   2HG   ARG  21          1HG       ARG  21   1.758 -15.389  -1.800
  175   1HD   ARG  21          2HD       ARG  21   3.136 -17.502  -1.923
  176   2HD   ARG  21          1HD       ARG  21   4.066 -16.719  -3.202
  177    HE   ARG  21           HE       ARG  21   4.136 -14.923  -1.174
  178   1HH1  ARG  21          1HH1      ARG  21   4.961 -18.314  -1.417
  179   2HH1  ARG  21          2HH1      ARG  21   6.159 -18.237  -0.168
  180   1HH2  ARG  21          1HH2      ARG  21   5.709 -14.825   0.468
  181   2HH2  ARG  21          2HH2      ARG  21   6.582 -16.256   0.903
  182    HA   PRO  22           HA       PRO  22   0.579 -15.277  -5.906
  183   1HB   PRO  22          2HB       PRO  22  -0.593 -14.544  -8.215
  184   2HB   PRO  22          1HB       PRO  22   0.301 -16.061  -8.060
  185   1HG   PRO  22          2HG       PRO  22  -2.653 -15.585  -7.992
  186   2HG   PRO  22          1HG       PRO  22  -1.744 -16.879  -8.794
  187   1HD   PRO  22          2HD       PRO  22  -3.016 -17.177  -6.387
  188   2HD   PRO  22          1HD       PRO  22  -1.602 -18.128  -6.880
  189    H    VAL  23           H        VAL  23   0.617 -13.295  -5.068
  190    HA   VAL  23           HA       VAL  23  -1.877 -11.886  -4.557
  191    HB   VAL  23           HB       VAL  23  -0.221 -12.032  -2.750
  192   1HG1  VAL  23          1HG1      VAL  23   1.667 -11.607  -4.675
  193   2HG1  VAL  23          2HG1      VAL  23   1.945 -11.502  -2.936
  194   3HG1  VAL  23          3HG1      VAL  23   1.609 -10.041  -3.865
  195   1HG2  VAL  23          1HG2      VAL  23  -0.174  -9.631  -2.152
  196   2HG2  VAL  23          2HG2      VAL  23  -1.753 -10.178  -2.715
  197   3HG2  VAL  23          3HG2      VAL  23  -0.710  -9.245  -3.787
  198    H    LYS  24           H        LYS  24  -2.681 -10.571  -6.031
  199    HA   LYS  24           HA       LYS  24  -0.902  -9.302  -7.983
  200   1HB   LYS  24          2HB       LYS  24  -3.550 -10.426  -8.079
  201   2HB   LYS  24          1HB       LYS  24  -3.604  -8.746  -8.597
  202   1HG   LYS  24          2HG       LYS  24  -3.271 -10.006 -10.544
  203   2HG   LYS  24          1HG       LYS  24  -1.697  -9.305 -10.161
  204   1HD   LYS  24          2HD       LYS  24  -0.770 -11.318  -9.665
  205   2HD   LYS  24          1HD       LYS  24  -2.275 -11.971  -9.015
  206   1HE   LYS  24          2HE       LYS  24  -1.869 -11.473 -11.952
  207   2HE   LYS  24          1HE       LYS  24  -1.407 -12.991 -11.183
  208   1HZ   LYS  24          1HZ       LYS  24  -3.616 -13.483 -10.673
  209   2HZ   LYS  24          2HZ       LYS  24  -3.699 -12.858 -12.241
  210   3HZ   LYS  24          3HZ       LYS  24  -4.144 -11.896 -10.924
  211    H    TYR  25           H        TYR  25  -0.674  -7.127  -8.165
  212    HA   TYR  25           HA       TYR  25  -1.150  -5.452  -5.989
  213   1HB   TYR  25          2HB       TYR  25   0.535  -5.009  -7.757
  214   2HB   TYR  25          1HB       TYR  25  -0.768  -4.614  -8.872
  215    HD1  TYR  25           HD2      TYR  25   0.612  -3.612  -5.556
  216    HD2  TYR  25           HD1      TYR  25  -1.470  -2.402  -9.064
  217    HE1  TYR  25           HE2      TYR  25   0.669  -1.283  -4.779
  218    HE2  TYR  25           HE1      TYR  25  -1.417  -0.067  -8.295
  219    HH   TYR  25           HH       TYR  25   0.552   1.129  -6.181
  220    H    GLU  26           H        GLU  26  -3.055  -5.941  -8.932
  221    HA   GLU  26           HA       GLU  26  -4.909  -3.861  -8.515
  222   1HB   GLU  26          2HB       GLU  26  -4.456  -5.550 -10.556
  223   2HB   GLU  26          1HB       GLU  26  -5.846  -6.351  -9.839
  224   1HG   GLU  26          2HG       GLU  26  -7.239  -4.501 -10.197
  225   2HG   GLU  26          1HG       GLU  26  -5.873  -3.428 -10.500
  226    H    ASP  27           H        ASP  27  -4.974  -7.293  -7.594
  227    HA   ASP  27           HA       ASP  27  -7.557  -7.238  -6.446
  228   1HB   ASP  27          2HB       ASP  27  -5.960  -9.248  -7.113
  229   2HB   ASP  27          1HB       ASP  27  -5.497  -9.141  -5.418
  230    H    VAL  28           H        VAL  28  -4.317  -6.858  -5.035
  231    HA   VAL  28           HA       VAL  28  -5.183  -6.656  -2.348
  232    HB   VAL  28           HB       VAL  28  -2.694  -5.432  -3.556
  233   1HG1  VAL  28          1HG1      VAL  28  -1.994  -6.127  -1.056
  234   2HG1  VAL  28          2HG1      VAL  28  -3.698  -5.757  -0.797
  235   3HG1  VAL  28          3HG1      VAL  28  -2.626  -4.536  -1.482
  236   1HG2  VAL  28          1HG2      VAL  28  -1.701  -7.437  -3.628
  237   2HG2  VAL  28          2HG2      VAL  28  -3.338  -8.093  -3.595
  238   3HG2  VAL  28          3HG2      VAL  28  -2.413  -7.951  -2.100
  239    H    GLU  29           H        GLU  29  -4.415  -4.195  -4.791
  240    HA   GLU  29           HA       GLU  29  -4.878  -1.932  -3.212
  241   1HB   GLU  29          2HB       GLU  29  -3.752  -1.883  -5.407
  242   2HB   GLU  29          1HB       GLU  29  -5.279  -2.250  -6.193
  243   1HG   GLU  29          2HG       GLU  29  -5.712   0.007  -4.556
  244   2HG   GLU  29          1HG       GLU  29  -4.209   0.275  -5.438
  245    H    HIS  30           H        HIS  30  -7.087  -3.823  -5.248
  246    HA   HIS  30           HA       HIS  30  -9.335  -2.185  -5.070
  247   1HB   HIS  30          2HB       HIS  30  -8.741  -4.797  -6.020
  248   2HB   HIS  30          1HB       HIS  30 -10.173  -4.919  -5.007
  249    HD1  HIS  30           HD1      HIS  30  -9.516  -1.867  -7.109
  250    HD2  HIS  30           HD2      HIS  30 -11.896  -5.277  -7.152
  251    HE1  HIS  30           HE1      HIS  30 -11.182  -1.505  -8.958
  252    HE2  HIS  30           HE2      HIS  30 -12.636  -3.561  -8.939
  253    H    LYS  31           H        LYS  31  -8.211  -4.734  -2.874
  254    HA   LYS  31           HA       LYS  31 -10.456  -4.601  -1.131
  255   1HB   LYS  31          2HB       LYS  31  -7.719  -5.810  -0.969
  256   2HB   LYS  31          1HB       LYS  31  -8.691  -5.689   0.491
  257   1HG   LYS  31          2HG       LYS  31 -10.037  -7.363  -0.120
  258   2HG   LYS  31          1HG       LYS  31 -10.139  -6.800  -1.789
  259   1HD   LYS  31          2HD       LYS  31  -9.011  -8.761  -2.114
  260   2HD   LYS  31          1HD       LYS  31  -7.645  -7.672  -1.864
  261   1HE   LYS  31          2HE       LYS  31  -7.328  -8.406   0.348
  262   2HE   LYS  31          1HE       LYS  31  -8.914  -9.171   0.409
  263   1HZ   LYS  31          1HZ       LYS  31  -7.011 -10.148  -1.588
  264   2HZ   LYS  31          2HZ       LYS  31  -8.183 -10.992  -0.709
  265   3HZ   LYS  31          3HZ       LYS  31  -6.726 -10.556   0.031
  266    H    VAL  32           H        VAL  32  -7.156  -3.252  -0.910
  267    HA   VAL  32           HA       VAL  32  -7.508  -1.958   1.558
  268    HB   VAL  32           HB       VAL  32  -5.686  -1.046  -0.672
  269   1HG1  VAL  32          1HG1      VAL  32  -5.789  -0.516   2.282
  270   2HG1  VAL  32          2HG1      VAL  32  -5.717   0.640   0.951
  271   3HG1  VAL  32          3HG1      VAL  32  -4.299  -0.325   1.357
  272   1HG2  VAL  32          1HG2      VAL  32  -4.174  -2.468   1.160
  273   2HG2  VAL  32          2HG2      VAL  32  -4.658  -3.010  -0.445
  274   3HG2  VAL  32          3HG2      VAL  32  -5.629  -3.443   0.961
  275    H    THR  33           H        THR  33  -8.097  -0.841  -1.755
  276    HA   THR  33           HA       THR  33  -8.611   1.846  -1.177
  277    HB   THR  33           HB       THR  33  -9.743   0.091  -3.368
  278    HG1  THR  33           HG1      THR  33  -7.747   0.256  -3.991
  279   1HG2  THR  33          1HG2      THR  33 -10.478   2.747  -2.722
  280   2HG2  THR  33          2HG2      THR  33 -10.940   1.783  -4.125
  281   3HG2  THR  33          3HG2      THR  33  -9.493   2.787  -4.183
  282    H    THR  34           H        THR  34 -10.791  -0.967  -1.146
  283    HA   THR  34           HA       THR  34 -13.119   0.586  -0.558
  284    HB   THR  34           HB       THR  34 -12.659  -2.373  -0.144
  285    HG1  THR  34           HG1      THR  34 -13.303  -2.638  -2.184
  286   1HG2  THR  34          1HG2      THR  34 -15.060  -2.613  -0.302
  287   2HG2  THR  34          2HG2      THR  34 -15.244  -0.866  -0.458
  288   3HG2  THR  34          3HG2      THR  34 -14.637  -1.559   1.046
  289    H    VAL  35           H        VAL  35 -10.653  -0.970   1.396
  290    HA   VAL  35           HA       VAL  35 -12.037  -0.973   3.851
  291    HB   VAL  35           HB       VAL  35  -9.052  -0.718   3.448
  292   1HG1  VAL  35          1HG1      VAL  35 -10.473  -0.459   5.780
  293   2HG1  VAL  35          2HG1      VAL  35  -8.780  -0.934   5.657
  294   3HG1  VAL  35          3HG1      VAL  35 -10.034  -2.165   5.783
  295   1HG2  VAL  35          1HG2      VAL  35 -10.766  -2.846   2.751
  296   2HG2  VAL  35          2HG2      VAL  35  -9.896  -3.343   4.202
  297   3HG2  VAL  35          3HG2      VAL  35  -9.004  -2.831   2.770
  298    H    PHE  36           H        PHE  36  -9.595   1.363   2.645
  299    HA   PHE  36           HA       PHE  36 -10.443   3.243   4.720
  300   1HB   PHE  36          2HB       PHE  36  -8.097   3.377   2.823
  301   2HB   PHE  36          1HB       PHE  36  -8.425   4.509   4.129
  302    HD1  PHE  36           HD2      PHE  36  -7.387   1.080   3.310
  303    HD2  PHE  36           HD1      PHE  36  -7.940   3.955   6.400
  304    HE1  PHE  36           HE2      PHE  36  -6.106  -0.340   4.858
  305    HE2  PHE  36           HE1      PHE  36  -6.659   2.540   7.950
  306    HZ   PHE  36           HZ       PHE  36  -5.743   0.388   7.178
  307    H    GLY  37           H        GLY  37 -11.105   2.708   1.422
  308   1HA   GLY  37          2HA       GLY  37 -12.743   4.024   0.300
  309   2HA   GLY  37          1HA       GLY  37 -12.224   5.417   1.236
  310    H    GLN  38           H        GLN  38 -12.361   6.264  -1.091
  311    HA   GLN  38           HA       GLN  38  -9.645   6.252  -2.171
  312   1HB   GLN  38          2HB       GLN  38 -10.662   6.174  -4.521
  313   2HB   GLN  38          1HB       GLN  38 -10.559   4.662  -3.631
  314   1HG   GLN  38          2HG       GLN  38 -12.770   4.384  -3.618
  315   2HG   GLN  38          1HG       GLN  38 -13.077   6.074  -3.221
  316   1HE2  GLN  38          1HE2      GLN  38 -14.271   4.154  -5.206
  317   2HE2  GLN  38          2HE2      GLN  38 -14.217   5.002  -6.709
  318    HA   PRO  39           HA       PRO  39  -8.927   7.032  -4.243
  319   1HB   PRO  39          2HB       PRO  39  -7.296   9.375  -4.598
  320   2HB   PRO  39          1HB       PRO  39  -8.211   8.485  -5.816
  321   1HG   PRO  39          2HG       PRO  39  -8.805  11.040  -5.002
  322   2HG   PRO  39          1HG       PRO  39  -9.981   9.919  -5.711
  323   1HD   PRO  39          2HD       PRO  39  -9.509  10.602  -2.830
  324   2HD   PRO  39          1HD       PRO  39 -11.045  10.360  -3.694
  325    H    LEU  40           H        LEU  40  -6.852   6.302  -3.709
  326    HA   LEU  40           HA       LEU  40  -5.579   7.472  -1.336
  327   1HB   LEU  40          2HB       LEU  40  -6.397   4.603  -1.728
  328   2HB   LEU  40          1HB       LEU  40  -5.097   5.043  -0.638
  329    HG   LEU  40           HG       LEU  40  -7.948   6.010  -0.403
  330   1HD1  LEU  40          1HD1      LEU  40  -6.550   4.079   1.419
  331   2HD1  LEU  40          2HD1      LEU  40  -7.471   3.537   0.016
  332   3HD1  LEU  40          3HD1      LEU  40  -8.273   4.441   1.301
  333   1HD2  LEU  40          1HD2      LEU  40  -6.957   7.625   0.803
  334   2HD2  LEU  40          2HD2      LEU  40  -5.439   6.738   0.933
  335   3HD2  LEU  40          3HD2      LEU  40  -6.774   6.366   2.023
  336    H    ASP  41           H        ASP  41  -3.332   7.141  -1.179
  337    HA   ASP  41           HA       ASP  41  -2.065   6.136  -3.646
  338   1HB   ASP  41          2HB       ASP  41  -1.634   8.585  -2.057
  339   2HB   ASP  41          1HB       ASP  41  -0.164   7.751  -2.548
  340    H    LEU  42           H        LEU  42  -0.911   4.335  -3.385
  341    HA   LEU  42           HA       LEU  42  -0.231   3.398  -0.738
  342   1HB   LEU  42          2HB       LEU  42   0.167   2.219  -3.487
  343   2HB   LEU  42          1HB       LEU  42   0.717   1.432  -2.019
  344    HG   LEU  42           HG       LEU  42  -2.169   2.170  -2.488
  345   1HD1  LEU  42          1HD1      LEU  42  -2.209  -0.468  -2.791
  346   2HD1  LEU  42          2HD1      LEU  42  -0.594  -0.158  -3.429
  347   3HD1  LEU  42          3HD1      LEU  42  -1.994   0.634  -4.153
  348   1HD2  LEU  42          1HD2      LEU  42  -2.658   0.973  -0.593
  349   2HD2  LEU  42          2HD2      LEU  42  -1.088   1.649  -0.155
  350   3HD2  LEU  42          3HD2      LEU  42  -1.204  -0.020  -0.712
  351    H    HIS  43           H        HIS  43   1.389   4.614   0.127
  352    HA   HIS  43           HA       HIS  43   3.832   5.051  -1.429
  353   1HB   HIS  43          2HB       HIS  43   2.449   6.731   0.214
  354   2HB   HIS  43          1HB       HIS  43   3.679   6.125   1.319
  355    HD1  HIS  43           HD1      HIS  43   3.712   9.060   0.537
  356    HD2  HIS  43           HD2      HIS  43   5.812   6.126  -1.529
  357    HE1  HIS  43           HE1      HIS  43   5.576  10.270  -0.639
  358    HE2  HIS  43           HE2      HIS  43   6.882   8.464  -1.814
  359    H    TYR  44           H        TYR  44   5.360   3.542  -1.289
  360    HA   TYR  44           HA       TYR  44   5.586   1.939   1.152
  361   1HB   TYR  44          2HB       TYR  44   5.425   0.592  -0.804
  362   2HB   TYR  44          1HB       TYR  44   6.610   1.566  -1.663
  363    HD1  TYR  44           HD1      TYR  44   9.014   1.441  -0.980
  364    HD2  TYR  44           HD2      TYR  44   6.087  -1.240   0.543
  365    HE1  TYR  44           HE1      TYR  44  10.798  -0.099  -0.281
  366    HE2  TYR  44           HE2      TYR  44   7.860  -2.790   1.248
  367    HH   TYR  44           HH       TYR  44  10.962  -2.658   0.159
  368    H    MET  45           H        MET  45   7.138   2.354   2.589
  369    HA   MET  45           HA       MET  45   9.566   3.763   1.683
  370   1HB   MET  45          2HB       MET  45   8.216   4.163   4.360
  371   2HB   MET  45          1HB       MET  45   9.612   5.031   3.740
  372   1HG   MET  45          2HG       MET  45   8.361   6.439   2.525
  373   2HG   MET  45          1HG       MET  45   7.219   5.185   2.049
  374   1HE   MET  45          1HE       MET  45   5.444   6.933   2.101
  375   2HE   MET  45          2HE       MET  45   6.170   8.300   2.947
  376   3HE   MET  45          3HE       MET  45   4.675   7.581   3.548
  377    H    ASN  46           H        ASN  46  11.460   2.854   2.270
  378    HA   ASN  46           HA       ASN  46  11.410   0.325   3.642
  379   1HB   ASN  46          2HB       ASN  46  13.449   1.936   2.198
  380   2HB   ASN  46          1HB       ASN  46  14.044   0.799   3.404
  381   1HD2  ASN  46          1HD2      ASN  46  13.093   1.173   0.226
  382   2HD2  ASN  46          2HD2      ASN  46  12.919  -0.493  -0.192
  383    H    ASN  47           H        ASN  47  12.655   3.566   4.338
  384    HA   ASN  47           HA       ASN  47  12.217   3.374   7.108
  385   1HB   ASN  47          2HB       ASN  47  14.678   3.501   7.798
  386   2HB   ASN  47          1HB       ASN  47  14.066   1.919   7.330
  387   1HD2  ASN  47          1HD2      ASN  47  16.291   4.432   6.638
  388   2HD2  ASN  47          2HD2      ASN  47  17.078   3.668   5.302
  389    H    GLU  48           H        GLU  48  14.412   4.842   4.719
  390    HA   GLU  48           HA       GLU  48  13.725   7.484   5.829
  391   1HB   GLU  48          2HB       GLU  48  16.308   6.284   5.133
  392   2HB   GLU  48          1HB       GLU  48  16.065   7.882   4.440
  393   1HG   GLU  48          2HG       GLU  48  15.714   7.250   7.361
  394   2HG   GLU  48          1HG       GLU  48  17.209   7.857   6.651
  395    H    LEU  49           H        LEU  49  14.326   5.609   2.891
  396    HA   LEU  49           HA       LEU  49  13.520   7.861   1.223
  397   1HB   LEU  49          2HB       LEU  49  14.922   5.282   0.782
  398   2HB   LEU  49          1HB       LEU  49  13.969   5.907  -0.549
  399    HG   LEU  49           HG       LEU  49  15.291   8.084  -0.257
  400   1HD1  LEU  49          1HD1      LEU  49  16.189   7.340   2.000
  401   2HD1  LEU  49          2HD1      LEU  49  17.355   8.029   0.871
  402   3HD1  LEU  49          3HD1      LEU  49  17.277   6.282   1.101
  403   1HD2  LEU  49          1HD2      LEU  49  17.185   5.980  -1.088
  404   2HD2  LEU  49          2HD2      LEU  49  16.627   7.415  -1.949
  405   3HD2  LEU  49          3HD2      LEU  49  15.612   5.973  -1.885
  406    H    SER  50           H        SER  50  11.611   8.004   0.195
  407    HA   SER  50           HA       SER  50   9.674   5.839   0.635
  408   1HB   SER  50          2HB       SER  50   7.929   7.523   0.317
  409   2HB   SER  50          1HB       SER  50   9.059   8.047   1.566
  410    HG   SER  50           HG       SER  50   9.310   9.769   0.405
  411    H    ILE  51           H        ILE  51   9.148   4.600  -1.027
  412    HA   ILE  51           HA       ILE  51   9.530   5.650  -3.759
  413    HB   ILE  51           HB       ILE  51   9.555   2.742  -2.944
  414   1HG1  ILE  51          2HG1      ILE  51  12.092   3.903  -3.833
  415   2HG1  ILE  51          1HG1      ILE  51  11.518   4.590  -2.319
  416   1HG2  ILE  51          1HG2      ILE  51  10.639   3.953  -5.469
  417   2HG2  ILE  51          2HG2      ILE  51   8.964   3.417  -5.324
  418   3HG2  ILE  51          3HG2      ILE  51  10.281   2.261  -5.124
  419   1HD1  ILE  51          1HD1      ILE  51  11.162   1.944  -1.861
  420   2HD1  ILE  51          2HD1      ILE  51  12.597   2.861  -1.405
  421   3HD1  ILE  51          3HD1      ILE  51  12.584   1.929  -2.903
  422    H    LEU  52           H        LEU  52   7.828   5.670  -5.105
  423    HA   LEU  52           HA       LEU  52   5.239   4.834  -4.078
  424   1HB   LEU  52          2HB       LEU  52   5.801   7.054  -5.310
  425   2HB   LEU  52          1HB       LEU  52   5.704   6.085  -6.767
  426    HG   LEU  52           HG       LEU  52   3.434   6.192  -4.792
  427   1HD1  LEU  52          1HD1      LEU  52   3.581   8.444  -5.311
  428   2HD1  LEU  52          2HD1      LEU  52   2.471   7.836  -6.541
  429   3HD1  LEU  52          3HD1      LEU  52   4.159   8.134  -6.949
  430   1HD2  LEU  52          1HD2      LEU  52   3.900   5.079  -7.487
  431   2HD2  LEU  52          2HD2      LEU  52   2.335   5.846  -7.218
  432   3HD2  LEU  52          3HD2      LEU  52   2.851   4.512  -6.187
  433    H    LEU  53           H        LEU  53   4.100   3.110  -4.771
  434    HA   LEU  53           HA       LEU  53   5.324   1.427  -6.848
  435   1HB   LEU  53          2HB       LEU  53   3.154   0.580  -4.942
  436   2HB   LEU  53          1HB       LEU  53   4.234  -0.437  -5.875
  437    HG   LEU  53           HG       LEU  53   5.444   1.373  -3.845
  438   1HD1  LEU  53          1HD1      LEU  53   3.894   0.575  -2.366
  439   2HD1  LEU  53          2HD1      LEU  53   5.101  -0.707  -2.271
  440   3HD1  LEU  53          3HD1      LEU  53   3.654  -0.930  -3.254
  441   1HD2  LEU  53          1HD2      LEU  53   7.057   0.178  -4.979
  442   2HD2  LEU  53          2HD2      LEU  53   6.044  -1.259  -5.124
  443   3HD2  LEU  53          3HD2      LEU  53   6.775  -0.849  -3.573
  444    H    LYS  54           H        LYS  54   4.501   2.297  -8.724
  445    HA   LYS  54           HA       LYS  54   1.566   2.352  -8.975
  446   1HB   LYS  54          2HB       LYS  54   1.971   3.831 -10.958
  447   2HB   LYS  54          1HB       LYS  54   2.457   4.521  -9.418
  448   1HG   LYS  54          2HG       LYS  54   4.662   3.124 -10.612
  449   2HG   LYS  54          1HG       LYS  54   3.981   4.287 -11.751
  450   1HD   LYS  54          2HD       LYS  54   4.018   5.771  -9.490
  451   2HD   LYS  54          1HD       LYS  54   5.413   4.728  -9.211
  452   1HE   LYS  54          2HE       LYS  54   5.227   5.893 -11.910
  453   2HE   LYS  54          1HE       LYS  54   5.486   7.052 -10.607
  454   1HZ   LYS  54          1HZ       LYS  54   7.203   4.779 -11.403
  455   2HZ   LYS  54          2HZ       LYS  54   7.348   5.506  -9.883
  456   3HZ   LYS  54          3HZ       LYS  54   7.612   6.416 -11.283
  457    H    ASN  55           H        ASN  55   3.308  -0.027  -9.228
  458    HA   ASN  55           HA       ASN  55   2.084  -1.215 -11.466
  459   1HB   ASN  55          2HB       ASN  55   4.244  -1.712 -12.737
  460   2HB   ASN  55          1HB       ASN  55   3.585  -0.089 -12.904
  461   1HD2  ASN  55          1HD2      ASN  55   6.366  -1.660 -12.680
  462   2HD2  ASN  55          2HD2      ASN  55   7.337  -0.490 -11.859
  463    H    GLN  56           H        GLN  56   2.895  -3.476 -11.846
  464    HA   GLN  56           HA       GLN  56   3.146  -4.823  -9.382
  465   1HB   GLN  56          2HB       GLN  56   2.770  -5.541 -12.142
  466   2HB   GLN  56          1HB       GLN  56   3.984  -6.589 -11.421
  467   1HG   GLN  56          2HG       GLN  56   1.523  -6.138  -9.853
  468   2HG   GLN  56          1HG       GLN  56   1.367  -7.094 -11.325
  469   1HE2  GLN  56          1HE2      GLN  56   1.751  -7.360  -8.129
  470   2HE2  GLN  56          2HE2      GLN  56   2.631  -8.843  -8.038
  471    H    ASP  57           H        ASP  57   5.531  -3.929 -11.831
  472    HA   ASP  57           HA       ASP  57   7.683  -5.467 -10.919
  473   1HB   ASP  57          2HB       ASP  57   7.988  -2.691 -12.064
  474   2HB   ASP  57          1HB       ASP  57   9.104  -4.046 -12.189
  475    H    ASP  58           H        ASP  58   6.548  -2.270  -9.895
  476    HA   ASP  58           HA       ASP  58   8.697  -1.703  -8.145
  477   1HB   ASP  58          2HB       ASP  58   5.892  -0.650  -8.419
  478   2HB   ASP  58          1HB       ASP  58   6.904  -0.144  -7.073
  479    H    LEU  59           H        LEU  59   5.522  -3.204  -7.624
  480    HA   LEU  59           HA       LEU  59   5.808  -3.505  -4.818
  481   1HB   LEU  59          2HB       LEU  59   3.700  -3.696  -6.370
  482   2HB   LEU  59          1HB       LEU  59   4.161  -5.387  -6.459
  483    HG   LEU  59           HG       LEU  59   4.139  -5.333  -3.884
  484   1HD1  LEU  59          1HD1      LEU  59   4.055  -3.024  -3.427
  485   2HD1  LEU  59          2HD1      LEU  59   2.451  -3.643  -3.035
  486   3HD1  LEU  59          3HD1      LEU  59   2.716  -2.770  -4.545
  487   1HD2  LEU  59          1HD2      LEU  59   1.474  -5.318  -4.065
  488   2HD2  LEU  59          2HD2      LEU  59   2.465  -6.638  -4.684
  489   3HD2  LEU  59          3HD2      LEU  59   1.868  -5.393  -5.783
  490    H    ASP  60           H        ASP  60   6.511  -5.620  -7.571
  491    HA   ASP  60           HA       ASP  60   7.214  -7.915  -6.086
  492   1HB   ASP  60          2HB       ASP  60   6.765  -7.647  -8.634
  493   2HB   ASP  60          1HB       ASP  60   8.478  -7.249  -8.731
  494    H    LYS  61           H        LYS  61   9.136  -5.203  -7.313
  495    HA   LYS  61           HA       LYS  61  11.660  -6.186  -6.539
  496   1HB   LYS  61          2HB       LYS  61  10.953  -4.155  -8.059
  497   2HB   LYS  61          1HB       LYS  61  11.092  -3.252  -6.557
  498   1HG   LYS  61          2HG       LYS  61  13.422  -4.463  -6.430
  499   2HG   LYS  61          1HG       LYS  61  13.196  -4.581  -8.177
  500   1HD   LYS  61          2HD       LYS  61  13.168  -2.267  -8.453
  501   2HD   LYS  61          1HD       LYS  61  12.805  -1.973  -6.753
  502   1HE   LYS  61          2HE       LYS  61  15.411  -2.987  -7.886
  503   2HE   LYS  61          1HE       LYS  61  15.105  -1.372  -7.250
  504   1HZ   LYS  61          1HZ       LYS  61  14.402  -2.825  -5.155
  505   2HZ   LYS  61          2HZ       LYS  61  15.990  -2.298  -5.407
  506   3HZ   LYS  61          3HZ       LYS  61  15.547  -3.875  -5.828
  507    H    ALA  62           H        ALA  62   9.172  -4.443  -4.768
  508    HA   ALA  62           HA       ALA  62  10.732  -3.599  -2.583
  509   1HB   ALA  62          1HB       ALA  62   8.382  -3.829  -1.390
  510   2HB   ALA  62          2HB       ALA  62   7.824  -3.996  -3.055
  511   3HB   ALA  62          3HB       ALA  62   8.708  -2.551  -2.561
  512    H    ILE  63           H        ILE  63   8.991  -6.628  -3.185
  513    HA   ILE  63           HA       ILE  63   9.365  -7.755  -0.621
  514    HB   ILE  63           HB       ILE  63   9.104  -9.276  -3.220
  515   1HG1  ILE  63          2HG1      ILE  63   6.726  -8.881  -1.512
  516   2HG1  ILE  63          1HG1      ILE  63   7.304  -7.432  -2.325
  517   1HG2  ILE  63          1HG2      ILE  63   7.938 -10.305  -0.715
  518   2HG2  ILE  63          2HG2      ILE  63   9.700 -10.273  -0.784
  519   3HG2  ILE  63          3HG2      ILE  63   8.786 -11.152  -2.008
  520   1HD1  ILE  63          1HD1      ILE  63   6.441  -8.086  -4.254
  521   2HD1  ILE  63          2HD1      ILE  63   5.641  -9.384  -3.368
  522   3HD1  ILE  63          3HD1      ILE  63   7.202  -9.672  -4.136
  523    H    ASP  64           H        ASP  64  11.296  -7.874  -3.585
  524    HA   ASP  64           HA       ASP  64  13.184  -9.778  -2.849
  525   1HB   ASP  64          2HB       ASP  64  13.615  -7.290  -4.523
  526   2HB   ASP  64          1HB       ASP  64  14.687  -8.686  -4.477
  527    H    ILE  65           H        ILE  65  12.954  -6.375  -1.990
  528    HA   ILE  65           HA       ILE  65  15.539  -6.103  -0.874
  529    HB   ILE  65           HB       ILE  65  13.064  -4.556  -0.090
  530   1HG1  ILE  65          2HG1      ILE  65  15.094  -3.786  -2.192
  531   2HG1  ILE  65          1HG1      ILE  65  13.594  -4.616  -2.584
  532   1HG2  ILE  65          1HG2      ILE  65  15.986  -3.820   0.056
  533   2HG2  ILE  65          2HG2      ILE  65  14.983  -4.309   1.422
  534   3HG2  ILE  65          3HG2      ILE  65  14.629  -2.812   0.559
  535   1HD1  ILE  65          1HD1      ILE  65  13.062  -2.412  -2.960
  536   2HD1  ILE  65          2HD1      ILE  65  14.010  -1.840  -1.589
  537   3HD1  ILE  65          3HD1      ILE  65  12.471  -2.660  -1.318
  538    H    LEU  66           H        LEU  66  12.411  -7.046   0.514
  539    HA   LEU  66           HA       LEU  66  13.268  -7.135   3.209
  540   1HB   LEU  66          2HB       LEU  66  10.870  -7.193   2.237
  541   2HB   LEU  66          1HB       LEU  66  11.129  -8.920   2.090
  542    HG   LEU  66           HG       LEU  66  11.658  -8.922   4.579
  543   1HD1  LEU  66          1HD1      LEU  66  12.078  -6.672   5.074
  544   2HD1  LEU  66          2HD1      LEU  66  10.499  -7.001   5.789
  545   3HD1  LEU  66          3HD1      LEU  66  10.612  -6.127   4.260
  546   1HD2  LEU  66          1HD2      LEU  66   9.062  -8.431   5.034
  547   2HD2  LEU  66          2HD2      LEU  66   9.645  -9.896   4.246
  548   3HD2  LEU  66          3HD2      LEU  66   9.033  -8.559   3.274
  549    H    ASP  67           H        ASP  67  13.082  -9.638   0.683
  550    HA   ASP  67           HA       ASP  67  13.856 -11.836   2.219
  551   1HB   ASP  67          2HB       ASP  67  13.111 -11.612  -0.324
  552   2HB   ASP  67          1HB       ASP  67  14.850 -11.626  -0.593
  553    H    ARG  68           H        ARG  68  15.805  -9.386   0.583
  554    HA   ARG  68           HA       ARG  68  18.326 -10.580   1.011
  555   1HB   ARG  68          2HB       ARG  68  17.704  -8.655  -0.566
  556   2HB   ARG  68          1HB       ARG  68  17.850  -7.610   0.841
  557   1HG   ARG  68          2HG       ARG  68  20.098  -7.716   0.854
  558   2HG   ARG  68          1HG       ARG  68  20.129  -9.407   0.347
  559   1HD   ARG  68          2HD       ARG  68  20.116  -8.887  -1.871
  560   2HD   ARG  68          1HD       ARG  68  19.186  -7.409  -1.631
  561    HE   ARG  68           HE       ARG  68  21.147  -6.263  -1.525
  562   1HH1  ARG  68          1HH1      ARG  68  21.834  -9.626  -0.827
  563   2HH1  ARG  68          2HH1      ARG  68  23.546  -9.389  -0.743
  564   1HH2  ARG  68          1HH2      ARG  68  23.405  -5.955  -1.415
  565   2HH2  ARG  68          2HH2      ARG  68  24.439  -7.302  -1.077
  566    H    SER  69           H        SER  69  16.301  -8.530   3.024
  567    HA   SER  69           HA       SER  69  18.299  -7.877   4.941
  568   1HB   SER  69          2HB       SER  69  16.400  -6.455   4.858
  569   2HB   SER  69          1HB       SER  69  15.283  -7.809   5.009
  570    HG   SER  69           HG       SER  69  16.915  -6.627   6.984
  571    H    SER  70           H        SER  70  18.689  -8.730   6.982
  572    HA   SER  70           HA       SER  70  18.354 -11.571   7.222
  573   1HB   SER  70          2HB       SER  70  19.396  -9.764   9.399
  574   2HB   SER  70          1HB       SER  70  19.821 -11.443   9.066
  575    HG   SER  70           HG       SER  70  21.409  -9.868   8.385
  576    H    SER  71           H        SER  71  16.906  -8.725   8.723
  577    HA   SER  71           HA       SER  71  15.519 -10.237  10.736
  578   1HB   SER  71          2HB       SER  71  14.240  -7.997  10.994
  579   2HB   SER  71          1HB       SER  71  15.950  -8.041  11.416
  580    HG   SER  71           HG       SER  71  16.384  -6.744   9.804
  581    H    MET  72           H        MET  72  14.477  -8.502   7.801
  582    HA   MET  72           HA       MET  72  12.488  -8.526   6.662
  583   1HB   MET  72          2HB       MET  72  11.912 -10.882   5.884
  584   2HB   MET  72          1HB       MET  72  13.536 -10.308   5.538
  585   1HG   MET  72          2HG       MET  72  14.419 -11.601   7.390
  586   2HG   MET  72          1HG       MET  72  12.794 -12.122   7.826
  587   1HE   MET  72          1HE       MET  72  15.509 -14.033   7.061
  588   2HE   MET  72          2HE       MET  72  14.555 -15.365   6.406
  589   3HE   MET  72          3HE       MET  72  14.011 -14.521   7.855
  590    H    LYS  73           H        LYS  73  11.047  -7.651   8.204
  591    HA   LYS  73           HA       LYS  73   9.165  -9.632   9.295
  592   1HB   LYS  73          2HB       LYS  73   8.856  -8.192  11.290
  593   2HB   LYS  73          1HB       LYS  73  10.476  -8.863  11.168
  594   1HG   LYS  73          2HG       LYS  73  10.174  -6.222   9.937
  595   2HG   LYS  73          1HG       LYS  73   9.893  -6.256  11.678
  596   1HD   LYS  73          2HD       LYS  73  12.071  -7.423  11.948
  597   2HD   LYS  73          1HD       LYS  73  12.348  -7.225  10.216
  598   1HE   LYS  73          2HE       LYS  73  11.892  -4.709  10.712
  599   2HE   LYS  73          1HE       LYS  73  12.269  -5.156  12.374
  600   1HZ   LYS  73          1HZ       LYS  73  14.083  -5.793  10.119
  601   2HZ   LYS  73          2HZ       LYS  73  14.432  -5.787  11.775
  602   3HZ   LYS  73          3HZ       LYS  73  14.171  -4.327  10.963
  603    H    SER  74           H        SER  74   7.895  -9.224   7.413
  604    HA   SER  74           HA       SER  74   6.143  -8.299   6.295
  605   1HB   SER  74          2HB       SER  74   5.522  -7.905   8.874
  606   2HB   SER  74          1HB       SER  74   5.651  -6.221   8.369
  607    HG   SER  74           HG       SER  74   4.056  -8.184   7.075
  608    H    LEU  75           H        LEU  75   5.200  -5.944   5.669
  609    HA   LEU  75           HA       LEU  75   7.531  -4.255   5.024
  610   1HB   LEU  75          2HB       LEU  75   5.174  -5.003   3.301
  611   2HB   LEU  75          1HB       LEU  75   6.229  -3.657   2.926
  612    HG   LEU  75           HG       LEU  75   6.891  -5.535   1.596
  613   1HD1  LEU  75          1HD1      LEU  75   8.842  -5.183   3.866
  614   2HD1  LEU  75          2HD1      LEU  75   8.687  -4.122   2.468
  615   3HD1  LEU  75          3HD1      LEU  75   9.216  -5.789   2.254
  616   1HD2  LEU  75          1HD2      LEU  75   5.915  -7.139   3.463
  617   2HD2  LEU  75          2HD2      LEU  75   7.612  -7.207   3.940
  618   3HD2  LEU  75          3HD2      LEU  75   7.134  -7.685   2.311
  619    H    ARG  76           H        ARG  76   7.400  -2.254   5.801
  620    HA   ARG  76           HA       ARG  76   4.912  -1.274   6.911
  621   1HB   ARG  76          2HB       ARG  76   7.753  -0.286   6.904
  622   2HB   ARG  76          1HB       ARG  76   6.442   0.756   7.439
  623   1HG   ARG  76          2HG       ARG  76   6.145  -0.374   9.368
  624   2HG   ARG  76          1HG       ARG  76   6.518  -1.937   8.636
  625   1HD   ARG  76          2HD       ARG  76   8.912  -1.288   8.593
  626   2HD   ARG  76          1HD       ARG  76   8.490   0.197   9.445
  627    HE   ARG  76           HE       ARG  76   7.481  -1.871  10.967
  628   1HH1  ARG  76          1HH1      ARG  76  10.640  -0.853   9.854
  629   2HH1  ARG  76          2HH1      ARG  76  11.470  -1.517  11.222
  630   1HH2  ARG  76          1HH2      ARG  76   8.577  -2.743  12.763
  631   2HH2  ARG  76          2HH2      ARG  76  10.299  -2.590  12.873
  632    H    ILE  77           H        ILE  77   3.544  -0.812   5.207
  633    HA   ILE  77           HA       ILE  77   4.456   1.217   3.271
  634    HB   ILE  77           HB       ILE  77   2.023  -0.553   3.013
  635   1HG1  ILE  77          2HG1      ILE  77   4.151  -1.190   1.170
  636   2HG1  ILE  77          1HG1      ILE  77   4.725  -1.338   2.828
  637   1HG2  ILE  77          1HG2      ILE  77   3.455   1.315   1.146
  638   2HG2  ILE  77          2HG2      ILE  77   1.765   1.344   1.649
  639   3HG2  ILE  77          3HG2      ILE  77   2.342   0.072   0.573
  640   1HD1  ILE  77          1HD1      ILE  77   2.361  -2.616   3.016
  641   2HD1  ILE  77          2HD1      ILE  77   3.892  -3.409   2.644
  642   3HD1  ILE  77          3HD1      ILE  77   2.791  -2.965   1.341
  643    H    LEU  78           H        LEU  78   3.614   3.202   3.354
  644    HA   LEU  78           HA       LEU  78   1.361   3.692   5.176
  645   1HB   LEU  78          2HB       LEU  78   3.773   5.202   4.385
  646   2HB   LEU  78          1HB       LEU  78   2.319   6.160   4.585
  647    HG   LEU  78           HG       LEU  78   2.076   5.262   6.880
  648   1HD1  LEU  78          1HD1      LEU  78   4.871   4.222   6.712
  649   2HD1  LEU  78          2HD1      LEU  78   3.517   3.190   6.254
  650   3HD1  LEU  78          3HD1      LEU  78   3.605   3.855   7.884
  651   1HD2  LEU  78          1HD2      LEU  78   3.447   6.840   7.784
  652   2HD2  LEU  78          2HD2      LEU  78   3.527   7.336   6.092
  653   3HD2  LEU  78          3HD2      LEU  78   4.827   6.369   6.791
  654    H    LEU  79           H        LEU  79  -0.576   4.273   4.392
  655    HA   LEU  79           HA       LEU  79  -0.713   5.135   1.577
  656   1HB   LEU  79          2HB       LEU  79  -3.032   4.291   1.576
  657   2HB   LEU  79          1HB       LEU  79  -1.846   3.040   1.884
  658    HG   LEU  79           HG       LEU  79  -2.471   3.647   4.424
  659   1HD1  LEU  79          1HD1      LEU  79  -4.150   5.144   4.402
  660   2HD1  LEU  79          2HD1      LEU  79  -5.143   3.715   4.125
  661   3HD1  LEU  79          3HD1      LEU  79  -4.653   4.726   2.766
  662   1HD2  LEU  79          1HD2      LEU  79  -2.772   1.509   2.809
  663   2HD2  LEU  79          2HD2      LEU  79  -4.461   1.899   3.133
  664   3HD2  LEU  79          3HD2      LEU  79  -3.358   1.575   4.471
  665    H    LEU  80           H        LEU  80  -1.705   7.005   1.033
  666    HA   LEU  80           HA       LEU  80  -3.051   8.530   3.168
  667   1HB   LEU  80          2HB       LEU  80  -1.285   9.801   1.085
  668   2HB   LEU  80          1HB       LEU  80  -1.969  10.544   2.519
  669    HG   LEU  80           HG       LEU  80  -0.474   8.616   3.676
  670   1HD1  LEU  80          1HD1      LEU  80   1.740   8.673   2.492
  671   2HD1  LEU  80          2HD1      LEU  80   0.893   9.330   1.092
  672   3HD1  LEU  80          3HD1      LEU  80   0.485   7.724   1.695
  673   1HD2  LEU  80          1HD2      LEU  80  -0.473  11.008   4.212
  674   2HD2  LEU  80          2HD2      LEU  80   0.529  11.320   2.793
  675   3HD2  LEU  80          3HD2      LEU  80   1.164  10.358   4.126
  676    H    SER  81           H        SER  81  -4.597  10.110   2.434
  677    HA   SER  81           HA       SER  81  -6.007   9.214   0.063
  678   1HB   SER  81          2HB       SER  81  -6.925  11.536   1.721
  679   2HB   SER  81          1HB       SER  81  -7.878  10.292   0.912
  680    HG   SER  81           HG       SER  81  -6.816  10.320   3.434
  681    H    GLN  82           H        GLN  82  -6.382  10.390  -1.782
  682    HA   GLN  82           HA       GLN  82  -4.565  12.594  -2.262
  683   1HB   GLN  82          2HB       GLN  82  -4.869  10.670  -3.875
  684   2HB   GLN  82          1HB       GLN  82  -6.454  11.334  -4.246
  685   1HG   GLN  82          2HG       GLN  82  -5.373  12.402  -5.880
  686   2HG   GLN  82          1HG       GLN  82  -4.890  13.516  -4.603
  687   1HE2  GLN  82          1HE2      GLN  82  -2.839  12.939  -3.466
  688   2HE2  GLN  82          2HE2      GLN  82  -1.550  12.310  -4.427
  689    H    ASP  83           H        ASP  83  -7.411  12.541  -0.874
  690    HA   ASP  83           HA       ASP  83  -8.080  15.230  -1.759
  691   1HB   ASP  83          2HB       ASP  83  -9.950  12.875  -1.910
  692   2HB   ASP  83          1HB       ASP  83 -10.567  14.512  -1.707
  693    H    ARG  84           H        ARG  84  -7.071  15.582   0.358
  694    HA   ARG  84           HA       ARG  84  -8.890  14.975   2.595
  695   1HB   ARG  84          2HB       ARG  84  -6.941  15.275   4.075
  696   2HB   ARG  84          1HB       ARG  84  -6.692  13.992   2.901
  697   1HG   ARG  84          2HG       ARG  84  -5.128  15.214   1.703
  698   2HG   ARG  84          1HG       ARG  84  -5.681  16.755   2.361
  699   1HD   ARG  84          2HD       ARG  84  -3.866  16.551   3.681
  700   2HD   ARG  84          1HD       ARG  84  -4.923  15.508   4.630
  701    HE   ARG  84           HE       ARG  84  -3.639  13.718   4.025
  702   1HH1  ARG  84          1HH1      ARG  84  -2.929  16.369   1.853
  703   2HH1  ARG  84          2HH1      ARG  84  -1.594  15.563   1.102
  704   1HH2  ARG  84          1HH2      ARG  84  -1.884  12.653   3.030
  705   2HH2  ARG  84          2HH2      ARG  84  -1.000  13.448   1.771
  706    H    ASN  85           H        ASN  85  -8.995  17.277   0.643
  707    HA   ASN  85           HA       ASN  85  -9.285  19.362   2.657
  708   1HB   ASN  85          2HB       ASN  85  -7.532  19.609   0.210
  709   2HB   ASN  85          1HB       ASN  85  -8.174  21.013   1.060
  710   1HD2  ASN  85          1HD2      ASN  85  -7.847  20.717   3.581
  711   2HD2  ASN  85          2HD2      ASN  85  -6.222  20.337   4.027
  712    H    LEU  86           H        LEU  86 -11.436  19.697   2.446
  713    HA   LEU  86           HA       LEU  86 -12.637  19.740  -0.205
  714   1HB   LEU  86          2HB       LEU  86 -14.784  19.938   0.962
  715   2HB   LEU  86          1HB       LEU  86 -13.859  18.557   1.514
  716    HG   LEU  86           HG       LEU  86 -13.136  20.487   3.328
  717   1HD1  LEU  86          1HD1      LEU  86 -15.182  21.718   2.099
  718   2HD1  LEU  86          2HD1      LEU  86 -14.801  21.931   3.809
  719   3HD1  LEU  86          3HD1      LEU  86 -16.068  20.806   3.323
  720   1HD2  LEU  86          1HD2      LEU  86 -13.594  18.456   4.247
  721   2HD2  LEU  86          2HD2      LEU  86 -15.044  18.215   3.271
  722   3HD2  LEU  86          3HD2      LEU  86 -15.091  19.289   4.668
  723    H    GLU  87           H        GLU  87 -12.673  21.532  -1.352
  724    HA   GLU  87           HA       GLU  87 -13.025  24.101   0.042
  725   1HB   GLU  87          2HB       GLU  87 -10.692  23.418  -1.128
  726   2HB   GLU  87          1HB       GLU  87 -11.525  24.111  -2.515
  727   1HG   GLU  87          2HG       GLU  87 -11.286  25.549   0.109
  728   2HG   GLU  87          1HG       GLU  87 -10.065  25.668  -1.158
  729    H    HIS  88           H        HIS  88 -15.083  24.592  -0.391
  730    HA   HIS  88           HA       HIS  88 -16.016  24.380  -3.178
  731   1HB   HIS  88          2HB       HIS  88 -17.260  23.739  -0.618
  732   2HB   HIS  88          1HB       HIS  88 -18.262  24.809  -1.590
  733    HD1  HIS  88           HD1      HIS  88 -18.550  23.862  -4.204
  734    HD2  HIS  88           HD2      HIS  88 -17.640  21.133  -1.204
  735    HE1  HIS  88           HE1      HIS  88 -19.219  21.615  -5.114
  736    HE2  HIS  88           HE2      HIS  88 -18.720  19.987  -3.257
  737    H    HIS  89           H        HIS  89 -18.100  26.039  -3.285
  738    HA   HIS  89           HA       HIS  89 -16.854  28.662  -2.996
  739   1HB   HIS  89          2HB       HIS  89 -18.011  27.743  -5.136
  740   2HB   HIS  89          1HB       HIS  89 -19.511  28.170  -4.318
  741    HD1  HIS  89           HD1      HIS  89 -20.106  30.045  -5.955
  742    HD2  HIS  89           HD2      HIS  89 -16.409  30.561  -4.128
  743    HE1  HIS  89           HE1      HIS  89 -19.403  32.395  -6.511
  744    HE2  HIS  89           HE2      HIS  89 -17.153  32.677  -5.419
  745    H    HIS  90           H        HIS  90 -17.723  27.458  -0.577
  746    HA   HIS  90           HA       HIS  90 -20.134  28.969   0.134
  747   1HB   HIS  90          2HB       HIS  90 -19.851  26.467   0.678
  748   2HB   HIS  90          1HB       HIS  90 -18.704  26.990   1.905
  749    HD1  HIS  90           HD1      HIS  90 -21.228  29.501   1.869
  750    HD2  HIS  90           HD2      HIS  90 -20.976  25.644   3.399
  751    HE1  HIS  90           HE1      HIS  90 -23.025  29.352   3.619
  752    HE2  HIS  90           HE2      HIS  90 -22.802  27.037   4.586
  753    H    HIS  91           H        HIS  91 -18.807  30.948  -0.042
  754    HA   HIS  91           HA       HIS  91 -16.642  31.482   1.686
  755   1HB   HIS  91          2HB       HIS  91 -18.584  33.316   0.277
  756   2HB   HIS  91          1HB       HIS  91 -17.196  33.898   1.188
  757    HD1  HIS  91           HD1      HIS  91 -14.889  32.354   0.272
  758    HD2  HIS  91           HD2      HIS  91 -17.962  33.360  -2.340
  759    HE1  HIS  91           HE1      HIS  91 -13.882  32.238  -2.025
  760    HE2  HIS  91           HE2      HIS  91 -15.722  32.981  -3.577
  761    H    HIS  92           H        HIS  92 -16.578  32.912   3.517
  762    HA   HIS  92           HA       HIS  92 -18.936  32.598   5.231
  763   1HB   HIS  92          2HB       HIS  92 -17.285  33.295   7.066
  764   2HB   HIS  92          1HB       HIS  92 -17.061  31.711   6.338
  765    HD1  HIS  92           HD1      HIS  92 -14.874  31.291   5.087
  766    HD2  HIS  92           HD2      HIS  92 -15.293  35.215   6.388
  767    HE1  HIS  92           HE1      HIS  92 -12.621  32.356   4.748
  768    HE2  HIS  92           HE2      HIS  92 -12.943  34.767   5.406
  769    H    HIS  93           H        HIS  93 -20.291  34.265   5.145
  770    HA   HIS  93           HA       HIS  93 -19.412  36.914   4.475
  771   1HB   HIS  93          2HB       HIS  93 -21.790  37.554   4.809
  772   2HB   HIS  93          1HB       HIS  93 -21.590  36.212   3.694
  773    HD1  HIS  93           HD1      HIS  93 -23.158  37.153   6.914
  774    HD2  HIS  93           HD2      HIS  93 -22.506  33.697   4.697
  775    HE1  HIS  93           HE1      HIS  93 -24.688  35.419   7.906
  776    HE2  HIS  93           HE2      HIS  93 -24.227  33.320   6.590
  Start of MODEL   16
    1    H    GLN   1           H        GLN   1   7.503 -21.319   1.705
    2    HA   GLN   1           HA       GLN   1   7.344 -19.250   3.012
    3   1HB   GLN   1          2HB       GLN   1   9.242 -18.357   1.297
    4   2HB   GLN   1          1HB       GLN   1   7.803 -17.724   0.511
    5   1HG   GLN   1          2HG       GLN   1   7.985 -17.259   3.413
    6   2HG   GLN   1          1HG       GLN   1   9.171 -16.419   2.415
    7   1HE2  GLN   1          1HE2      GLN   1   8.542 -14.419   2.020
    8   2HE2  GLN   1          2HE2      GLN   1   6.931 -13.911   1.660
    9    H    SER   2           H        SER   2   5.226 -18.747   3.127
   10    HA   SER   2           HA       SER   2   3.620 -18.549   0.720
   11   1HB   SER   2          2HB       SER   2   3.624 -20.981   1.422
   12   2HB   SER   2          1HB       SER   2   2.808 -20.476   2.903
   13    HG   SER   2           HG       SER   2   1.045 -19.950   1.777
   14    H    ASP   3           H        ASP   3   1.694 -17.394   1.005
   15    HA   ASP   3           HA       ASP   3   0.332 -15.807   1.881
   16   1HB   ASP   3          2HB       ASP   3   0.376 -17.874   3.763
   17   2HB   ASP   3          1HB       ASP   3   0.607 -16.406   4.706
   18    H    VAL   4           H        VAL   4   1.561 -14.026   1.410
   19    HA   VAL   4           HA       VAL   4   3.636 -13.131   3.223
   20    HB   VAL   4           HB       VAL   4   2.495 -11.629   0.863
   21   1HG1  VAL   4          1HG1      VAL   4   5.320 -11.430   1.751
   22   2HG1  VAL   4          2HG1      VAL   4   4.088 -10.631   2.729
   23   3HG1  VAL   4          3HG1      VAL   4   4.273 -10.210   1.026
   24   1HG2  VAL   4          1HG2      VAL   4   4.291 -12.584  -0.476
   25   2HG2  VAL   4          2HG2      VAL   4   3.245 -13.854   0.156
   26   3HG2  VAL   4          3HG2      VAL   4   4.817 -13.556   0.898
   27    H    ARG   5           H        ARG   5   3.328 -11.834   4.915
   28    HA   ARG   5           HA       ARG   5   0.719 -10.586   5.298
   29   1HB   ARG   5          2HB       ARG   5   2.757 -11.672   7.028
   30   2HB   ARG   5          1HB       ARG   5   2.371 -10.026   7.507
   31   1HG   ARG   5          2HG       ARG   5   0.323 -10.577   8.243
   32   2HG   ARG   5          1HG       ARG   5   0.052 -11.743   6.945
   33   1HD   ARG   5          2HD       ARG   5   0.928 -13.470   8.128
   34   2HD   ARG   5          1HD       ARG   5   2.107 -12.449   8.952
   35    HE   ARG   5           HE       ARG   5  -0.542 -13.119   9.848
   36   1HH1  ARG   5          1HH1      ARG   5   2.072 -10.805  10.111
   37   2HH1  ARG   5          2HH1      ARG   5   1.578 -10.235  11.671
   38   1HH2  ARG   5          1HH2      ARG   5  -1.192 -12.365  11.903
   39   2HH2  ARG   5          2HH2      ARG   5  -0.276 -11.122  12.688
   40    H    ILE   6           H        ILE   6   0.397  -8.557   4.689
   41    HA   ILE   6           HA       ILE   6   2.704  -6.747   4.470
   42    HB   ILE   6           HB       ILE   6  -0.054  -6.326   3.312
   43   1HG1  ILE   6          2HG1      ILE   6   1.976  -6.942   1.353
   44   2HG1  ILE   6          1HG1      ILE   6   1.848  -8.251   2.521
   45   1HG2  ILE   6          1HG2      ILE   6   1.039  -4.259   3.409
   46   2HG2  ILE   6          2HG2      ILE   6   1.313  -4.824   1.761
   47   3HG2  ILE   6          3HG2      ILE   6   2.596  -4.958   2.963
   48   1HD1  ILE   6          1HD1      ILE   6   0.406  -8.655   0.631
   49   2HD1  ILE   6          2HD1      ILE   6  -0.397  -7.104   0.880
   50   3HD1  ILE   6          3HD1      ILE   6  -0.560  -8.385   2.083
   51    H    LYS   7           H        LYS   7   2.907  -5.023   5.765
   52    HA   LYS   7           HA       LYS   7   0.671  -4.376   7.572
   53   1HB   LYS   7          2HB       LYS   7   2.798  -5.240   8.601
   54   2HB   LYS   7          1HB       LYS   7   3.605  -3.795   8.012
   55   1HG   LYS   7          2HG       LYS   7   1.271  -3.004   9.440
   56   2HG   LYS   7          1HG       LYS   7   2.173  -4.160  10.422
   57   1HD   LYS   7          2HD       LYS   7   4.160  -2.544   9.446
   58   2HD   LYS   7          1HD       LYS   7   2.829  -1.408   9.677
   59   1HE   LYS   7          2HE       LYS   7   2.583  -2.470  11.996
   60   2HE   LYS   7          1HE       LYS   7   4.179  -3.161  11.707
   61   1HZ   LYS   7          1HZ       LYS   7   4.268  -1.057  12.932
   62   2HZ   LYS   7          2HZ       LYS   7   3.547  -0.256  11.627
   63   3HZ   LYS   7          3HZ       LYS   7   5.079  -0.957  11.451
   64    H    PHE   8           H        PHE   8  -0.380  -2.581   7.012
   65    HA   PHE   8           HA       PHE   8   1.158  -0.393   5.781
   66   1HB   PHE   8          2HB       PHE   8  -1.153   0.356   4.934
   67   2HB   PHE   8          1HB       PHE   8  -0.401  -1.030   4.156
   68    HD1  PHE   8           HD1      PHE   8  -3.102   0.086   6.360
   69    HD2  PHE   8           HD2      PHE   8  -1.321  -3.240   4.392
   70    HE1  PHE   8           HE1      PHE   8  -5.120  -1.250   6.799
   71    HE2  PHE   8           HE2      PHE   8  -3.334  -4.582   4.828
   72    HZ   PHE   8           HZ       PHE   8  -5.239  -3.587   6.032
   73    H    GLU   9           H        GLU   9   0.818   1.726   6.451
   74    HA   GLU   9           HA       GLU   9  -0.704   2.032   8.954
   75   1HB   GLU   9          2HB       GLU   9   2.114   2.507   8.434
   76   2HB   GLU   9          1HB       GLU   9   1.313   3.958   9.023
   77   1HG   GLU   9          2HG       GLU   9   0.637   2.893  11.019
   78   2HG   GLU   9          1HG       GLU   9   1.055   1.300  10.395
   79    H    HIS  10           H        HIS  10  -1.827   3.916   9.261
   80    HA   HIS  10           HA       HIS  10  -1.764   5.944   7.150
   81   1HB   HIS  10          2HB       HIS  10  -3.544   4.365   6.532
   82   2HB   HIS  10          1HB       HIS  10  -4.279   4.565   8.118
   83    HD1  HIS  10           HD1      HIS  10  -6.292   5.960   7.929
   84    HD2  HIS  10           HD2      HIS  10  -3.295   7.247   5.355
   85    HE1  HIS  10           HE1      HIS  10  -7.238   7.967   6.746
   86    HE2  HIS  10           HE2      HIS  10  -5.428   8.694   5.151
   87    H    ASN  11           H        ASN  11  -1.302   7.762   8.202
   88    HA   ASN  11           HA       ASN  11  -1.248   9.419   9.760
   89   1HB   ASN  11          2HB       ASN  11  -4.089   8.517   9.731
   90   2HB   ASN  11          1HB       ASN  11  -3.598   9.629  11.004
   91   1HD2  ASN  11          1HD2      ASN  11  -5.461  10.134   8.891
   92   2HD2  ASN  11          2HD2      ASN  11  -4.828  11.443   7.961
   93    H    GLY  12           H        GLY  12  -0.267   6.847  10.633
   94   1HA   GLY  12          2HA       GLY  12   0.774   6.519  12.776
   95   2HA   GLY  12          1HA       GLY  12  -0.655   7.207  13.532
   96    H    GLU  13           H        GLU  13  -2.650   5.734  12.207
   97    HA   GLU  13           HA       GLU  13  -2.688   3.381  13.763
   98   1HB   GLU  13          2HB       GLU  13  -4.479   4.769  11.969
   99   2HB   GLU  13          1HB       GLU  13  -4.551   3.035  11.688
  100   1HG   GLU  13          2HG       GLU  13  -6.129   3.205  13.300
  101   2HG   GLU  13          1HG       GLU  13  -4.716   2.977  14.326
  102    H    ARG  14           H        ARG  14  -2.167   1.302  13.335
  103    HA   ARG  14           HA       ARG  14  -1.027   0.722  10.679
  104   1HB   ARG  14          2HB       ARG  14   0.413  -0.937  11.810
  105   2HB   ARG  14          1HB       ARG  14   0.686   0.698  12.395
  106   1HG   ARG  14          2HG       ARG  14  -0.340   0.271  14.441
  107   2HG   ARG  14          1HG       ARG  14  -1.163  -1.166  13.834
  108   1HD   ARG  14          2HD       ARG  14   0.491  -2.280  14.865
  109   2HD   ARG  14          1HD       ARG  14   1.438  -1.843  13.443
  110    HE   ARG  14           HE       ARG  14   2.663  -0.404  14.737
  111   1HH1  ARG  14          1HH1      ARG  14  -0.234  -1.295  16.491
  112   2HH1  ARG  14          2HH1      ARG  14   0.289  -0.565  17.972
  113   1HH2  ARG  14          1HH2      ARG  14   3.345   0.564  16.688
  114   2HH2  ARG  14          2HH2      ARG  14   2.322   0.492  18.084
  115    H    ARG  15           H        ARG  15  -1.286  -1.409   9.822
  116    HA   ARG  15           HA       ARG  15  -3.201  -3.189  11.080
  117   1HB   ARG  15          2HB       ARG  15  -3.877  -1.437   8.810
  118   2HB   ARG  15          1HB       ARG  15  -4.301  -3.129   8.584
  119   1HG   ARG  15          2HG       ARG  15  -5.092  -2.259  11.202
  120   2HG   ARG  15          1HG       ARG  15  -5.733  -1.168   9.974
  121   1HD   ARG  15          2HD       ARG  15  -7.187  -2.692   9.223
  122   2HD   ARG  15          1HD       ARG  15  -5.979  -3.977   9.236
  123    HE   ARG  15           HE       ARG  15  -6.567  -3.651  11.858
  124   1HH1  ARG  15          1HH1      ARG  15  -8.546  -4.199   9.021
  125   2HH1  ARG  15          2HH1      ARG  15  -9.782  -5.038   9.895
  126   1HH2  ARG  15          1HH2      ARG  15  -8.199  -4.761  13.002
  127   2HH2  ARG  15          2HH2      ARG  15  -9.586  -5.356  12.153
  128    H    ILE  16           H        ILE  16  -2.874  -5.286  10.541
  129    HA   ILE  16           HA       ILE  16  -0.887  -5.839   8.431
  130    HB   ILE  16           HB       ILE  16  -1.459  -7.588  10.826
  131   1HG1  ILE  16          2HG1      ILE  16   0.928  -5.764  10.486
  132   2HG1  ILE  16          1HG1      ILE  16  -0.504  -5.295  11.397
  133   1HG2  ILE  16          1HG2      ILE  16  -0.383  -8.428   8.598
  134   2HG2  ILE  16          2HG2      ILE  16   0.290  -8.917  10.150
  135   3HG2  ILE  16          3HG2      ILE  16   1.058  -7.629   9.225
  136   1HD1  ILE  16          1HD1      ILE  16   1.650  -6.435  12.498
  137   2HD1  ILE  16          2HD1      ILE  16   0.704  -7.878  12.132
  138   3HD1  ILE  16          3HD1      ILE  16   0.019  -6.608  13.146
  139    H    ILE  17           H        ILE  17  -1.529  -7.038   6.753
  140    HA   ILE  17           HA       ILE  17  -3.861  -8.811   7.076
  141    HB   ILE  17           HB       ILE  17  -3.353  -7.144   4.608
  142   1HG1  ILE  17          2HG1      ILE  17  -3.983  -5.721   6.538
  143   2HG1  ILE  17          1HG1      ILE  17  -5.221  -5.744   5.289
  144   1HG2  ILE  17          1HG2      ILE  17  -4.530  -9.121   4.042
  145   2HG2  ILE  17          2HG2      ILE  17  -5.726  -7.827   4.111
  146   3HG2  ILE  17          3HG2      ILE  17  -5.591  -8.975   5.443
  147   1HD1  ILE  17          1HD1      ILE  17  -5.618  -7.775   7.340
  148   2HD1  ILE  17          2HD1      ILE  17  -6.745  -6.595   6.672
  149   3HD1  ILE  17          3HD1      ILE  17  -5.636  -6.126   7.961
  150    H    ALA  18           H        ALA  18  -3.590 -10.824   6.307
  151    HA   ALA  18           HA       ALA  18  -1.083 -11.446   4.932
  152   1HB   ALA  18          1HB       ALA  18  -3.033 -13.494   5.928
  153   2HB   ALA  18          2HB       ALA  18  -1.939 -12.666   7.036
  154   3HB   ALA  18          3HB       ALA  18  -1.290 -13.631   5.710
  155    H    PHE  19           H        PHE  19  -0.971 -12.168   2.874
  156    HA   PHE  19           HA       PHE  19  -3.495 -12.773   1.478
  157   1HB   PHE  19          2HB       PHE  19  -1.346 -10.844   0.772
  158   2HB   PHE  19          1HB       PHE  19  -2.044 -11.776  -0.548
  159    HD1  PHE  19           HD2      PHE  19  -4.436 -11.563  -1.087
  160    HD2  PHE  19           HD1      PHE  19  -2.576  -9.119   1.860
  161    HE1  PHE  19           HE2      PHE  19  -6.341 -10.010  -1.180
  162    HE2  PHE  19           HE1      PHE  19  -4.479  -7.561   1.772
  163    HZ   PHE  19           HZ       PHE  19  -6.365  -8.005   0.252
  164    H    SER  20           H        SER  20  -3.527 -14.712   0.559
  165    HA   SER  20           HA       SER  20  -1.138 -16.327   0.455
  166   1HB   SER  20          2HB       SER  20  -3.687 -16.980   0.948
  167   2HB   SER  20          1HB       SER  20  -3.669 -17.280  -0.790
  168    HG   SER  20           HG       SER  20  -3.060 -19.093   0.612
  169    H    ARG  21           H        ARG  21  -0.255 -17.306  -1.410
  170    HA   ARG  21           HA       ARG  21  -0.490 -15.658  -3.803
  171   1HB   ARG  21          2HB       ARG  21   1.570 -17.358  -2.604
  172   2HB   ARG  21          1HB       ARG  21   1.418 -17.579  -4.343
  173   1HG   ARG  21          2HG       ARG  21   3.022 -15.920  -4.140
  174   2HG   ARG  21          1HG       ARG  21   1.544 -15.020  -4.478
  175   1HD   ARG  21          2HD       ARG  21   1.895 -13.835  -2.632
  176   2HD   ARG  21          1HD       ARG  21   1.656 -15.302  -1.687
  177    HE   ARG  21           HE       ARG  21   3.882 -15.275  -1.223
  178   1HH1  ARG  21          1HH1      ARG  21   3.395 -13.448  -4.172
  179   2HH1  ARG  21          2HH1      ARG  21   5.058 -12.982  -4.301
  180   1HH2  ARG  21          1HH2      ARG  21   6.070 -14.662  -1.402
  181   2HH2  ARG  21          2HH2      ARG  21   6.578 -13.671  -2.728
  182    HA   PRO  22           HA       PRO  22   0.326 -15.978  -5.949
  183   1HB   PRO  22          2HB       PRO  22  -0.984 -15.594  -8.269
  184   2HB   PRO  22          1HB       PRO  22   0.149 -16.931  -8.043
  185   1HG   PRO  22          2HG       PRO  22  -2.841 -16.941  -7.931
  186   2HG   PRO  22          1HG       PRO  22  -1.744 -18.120  -8.672
  187   1HD   PRO  22          2HD       PRO  22  -2.914 -18.467  -6.223
  188   2HD   PRO  22          1HD       PRO  22  -1.365 -19.198  -6.686
  189    H    VAL  23           H        VAL  23   0.076 -13.896  -5.416
  190    HA   VAL  23           HA       VAL  23  -2.656 -12.799  -5.292
  191    HB   VAL  23           HB       VAL  23  -1.687 -13.109  -3.045
  192   1HG1  VAL  23          1HG1      VAL  23   0.270 -12.109  -2.301
  193   2HG1  VAL  23          2HG1      VAL  23   0.308 -10.957  -3.637
  194   3HG1  VAL  23          3HG1      VAL  23   0.700 -12.652  -3.923
  195   1HG2  VAL  23          1HG2      VAL  23  -3.280 -11.408  -3.137
  196   2HG2  VAL  23          2HG2      VAL  23  -2.215 -10.330  -4.041
  197   3HG2  VAL  23          3HG2      VAL  23  -1.900 -10.654  -2.338
  198    H    LYS  24           H        LYS  24  -3.037 -11.151  -6.602
  199    HA   LYS  24           HA       LYS  24  -0.808  -9.845  -7.952
  200   1HB   LYS  24          2HB       LYS  24  -3.789  -9.830  -8.417
  201   2HB   LYS  24          1HB       LYS  24  -2.679  -8.804  -9.315
  202   1HG   LYS  24          2HG       LYS  24  -1.509 -10.796 -10.130
  203   2HG   LYS  24          1HG       LYS  24  -2.649 -11.815  -9.245
  204   1HD   LYS  24          2HD       LYS  24  -4.382 -11.355 -10.678
  205   2HD   LYS  24          1HD       LYS  24  -3.721  -9.786 -11.145
  206   1HE   LYS  24          2HE       LYS  24  -3.629 -11.479 -12.958
  207   2HE   LYS  24          1HE       LYS  24  -2.050 -10.832 -12.517
  208   1HZ   LYS  24          1HZ       LYS  24  -3.150 -13.425 -11.566
  209   2HZ   LYS  24          2HZ       LYS  24  -1.606 -12.814 -11.241
  210   3HZ   LYS  24          3HZ       LYS  24  -2.028 -13.249 -12.819
  211    H    TYR  25           H        TYR  25  -0.576  -7.576  -8.073
  212    HA   TYR  25           HA       TYR  25  -0.940  -6.193  -5.646
  213   1HB   TYR  25          2HB       TYR  25   0.841  -5.711  -7.341
  214   2HB   TYR  25          1HB       TYR  25  -0.391  -4.990  -8.369
  215    HD1  TYR  25           HD2      TYR  25   1.507  -4.612  -5.233
  216    HD2  TYR  25           HD1      TYR  25  -1.259  -2.794  -7.910
  217    HE1  TYR  25           HE2      TYR  25   1.852  -2.449  -4.114
  218    HE2  TYR  25           HE1      TYR  25  -0.921  -0.628  -6.800
  219    HH   TYR  25           HH       TYR  25   0.821   0.491  -5.420
  220    H    GLU  26           H        GLU  26  -2.807  -6.253  -8.638
  221    HA   GLU  26           HA       GLU  26  -4.478  -4.049  -8.106
  222   1HB   GLU  26          2HB       GLU  26  -4.697  -6.466  -9.866
  223   2HB   GLU  26          1HB       GLU  26  -6.097  -5.425  -9.644
  224   1HG   GLU  26          2HG       GLU  26  -5.263  -3.813 -10.944
  225   2HG   GLU  26          1HG       GLU  26  -3.637  -3.983 -10.284
  226    H    ASP  27           H        ASP  27  -4.854  -7.511  -7.387
  227    HA   ASP  27           HA       ASP  27  -7.440  -7.326  -6.287
  228   1HB   ASP  27          2HB       ASP  27  -5.540  -9.372  -6.724
  229   2HB   ASP  27          1HB       ASP  27  -5.936  -9.421  -5.008
  230    H    VAL  28           H        VAL  28  -4.233  -7.181  -4.762
  231    HA   VAL  28           HA       VAL  28  -5.205  -6.974  -2.101
  232    HB   VAL  28           HB       VAL  28  -2.557  -5.963  -3.158
  233   1HG1  VAL  28          1HG1      VAL  28  -2.773  -7.063  -0.438
  234   2HG1  VAL  28          2HG1      VAL  28  -3.613  -5.534  -0.703
  235   3HG1  VAL  28          3HG1      VAL  28  -1.884  -5.659  -1.031
  236   1HG2  VAL  28          1HG2      VAL  28  -2.627  -8.560  -1.795
  237   2HG2  VAL  28          2HG2      VAL  28  -1.735  -8.052  -3.229
  238   3HG2  VAL  28          3HG2      VAL  28  -3.424  -8.535  -3.369
  239    H    GLU  29           H        GLU  29  -4.087  -4.554  -4.449
  240    HA   GLU  29           HA       GLU  29  -4.465  -2.293  -2.814
  241   1HB   GLU  29          2HB       GLU  29  -3.115  -2.348  -4.910
  242   2HB   GLU  29          1HB       GLU  29  -4.608  -2.435  -5.831
  243   1HG   GLU  29          2HG       GLU  29  -5.235  -0.252  -4.628
  244   2HG   GLU  29          1HG       GLU  29  -3.520  -0.157  -4.226
  245    H    HIS  30           H        HIS  30  -6.603  -3.850  -5.196
  246    HA   HIS  30           HA       HIS  30  -8.682  -2.003  -5.170
  247   1HB   HIS  30          2HB       HIS  30  -8.404  -4.012  -6.703
  248   2HB   HIS  30          1HB       HIS  30  -9.100  -4.982  -5.410
  249    HD1  HIS  30           HD1      HIS  30 -11.485  -5.421  -5.880
  250    HD2  HIS  30           HD2      HIS  30 -10.344  -1.625  -7.130
  251    HE1  HIS  30           HE1      HIS  30 -13.566  -4.370  -6.828
  252    HE2  HIS  30           HE2      HIS  30 -12.824  -2.113  -7.669
  253    H    LYS  31           H        LYS  31  -8.040  -4.689  -2.949
  254    HA   LYS  31           HA       LYS  31 -10.479  -4.541  -1.532
  255   1HB   LYS  31          2HB       LYS  31  -8.635  -6.369  -1.470
  256   2HB   LYS  31          1HB       LYS  31  -7.889  -5.357  -0.240
  257   1HG   LYS  31          2HG       LYS  31 -10.397  -5.491   0.724
  258   2HG   LYS  31          1HG       LYS  31 -10.297  -7.043  -0.106
  259   1HD   LYS  31          2HD       LYS  31  -8.749  -7.866   1.330
  260   2HD   LYS  31          1HD       LYS  31  -7.975  -6.297   1.563
  261   1HE   LYS  31          2HE       LYS  31  -9.747  -5.599   3.051
  262   2HE   LYS  31          1HE       LYS  31 -10.637  -7.089   2.740
  263   1HZ   LYS  31          1HZ       LYS  31  -9.062  -6.776   4.835
  264   2HZ   LYS  31          2HZ       LYS  31  -7.915  -7.376   3.747
  265   3HZ   LYS  31          3HZ       LYS  31  -9.301  -8.281   4.098
  266    H    VAL  32           H        VAL  32  -7.299  -3.070  -0.920
  267    HA   VAL  32           HA       VAL  32  -8.017  -1.740   1.456
  268    HB   VAL  32           HB       VAL  32  -5.902  -0.819  -0.493
  269   1HG1  VAL  32          1HG1      VAL  32  -5.790  -0.590   2.493
  270   2HG1  VAL  32          2HG1      VAL  32  -6.663   0.604   1.533
  271   3HG1  VAL  32          3HG1      VAL  32  -4.939   0.351   1.265
  272   1HG2  VAL  32          1HG2      VAL  32  -4.542  -2.234   1.373
  273   2HG2  VAL  32          2HG2      VAL  32  -5.047  -2.882  -0.187
  274   3HG2  VAL  32          3HG2      VAL  32  -6.020  -3.189   1.250
  275    H    THR  33           H        THR  33  -8.160  -0.702  -1.940
  276    HA   THR  33           HA       THR  33  -8.764   1.982  -1.489
  277    HB   THR  33           HB       THR  33 -10.143   1.370  -3.786
  278    HG1  THR  33           HG1      THR  33  -7.879  -0.272  -3.918
  279   1HG2  THR  33          1HG2      THR  33  -7.204   1.638  -4.014
  280   2HG2  THR  33          2HG2      THR  33  -8.113   2.951  -3.265
  281   3HG2  THR  33          3HG2      THR  33  -8.493   2.446  -4.910
  282    H    THR  34           H        THR  34 -10.894  -0.857  -1.668
  283    HA   THR  34           HA       THR  34 -13.302   0.667  -1.451
  284    HB   THR  34           HB       THR  34 -12.926  -2.258  -0.794
  285    HG1  THR  34           HG1      THR  34 -13.169  -2.681  -2.912
  286   1HG2  THR  34          1HG2      THR  34 -15.204  -2.558  -1.247
  287   2HG2  THR  34          2HG2      THR  34 -15.365  -0.944  -1.940
  288   3HG2  THR  34          3HG2      THR  34 -15.121  -1.140  -0.204
  289    H    VAL  35           H        VAL  35 -11.108  -0.829   0.859
  290    HA   VAL  35           HA       VAL  35 -12.826  -0.674   3.111
  291    HB   VAL  35           HB       VAL  35  -9.803  -0.663   3.118
  292   1HG1  VAL  35          1HG1      VAL  35 -11.280  -1.939   5.310
  293   2HG1  VAL  35          2HG1      VAL  35 -11.458  -0.188   5.217
  294   3HG1  VAL  35          3HG1      VAL  35  -9.853  -0.903   5.351
  295   1HG2  VAL  35          1HG2      VAL  35 -11.021  -3.191   3.773
  296   2HG2  VAL  35          2HG2      VAL  35  -9.798  -2.817   2.561
  297   3HG2  VAL  35          3HG2      VAL  35 -11.509  -2.661   2.163
  298    H    PHE  36           H        PHE  36 -10.111   1.431   2.092
  299    HA   PHE  36           HA       PHE  36 -11.043   3.451   4.001
  300   1HB   PHE  36          2HB       PHE  36  -8.476   3.365   2.413
  301   2HB   PHE  36          1HB       PHE  36  -8.878   4.527   3.670
  302    HD1  PHE  36           HD1      PHE  36  -9.838   3.087   5.883
  303    HD2  PHE  36           HD2      PHE  36  -6.856   1.902   3.085
  304    HE1  PHE  36           HE1      PHE  36  -8.848   1.597   7.572
  305    HE2  PHE  36           HE2      PHE  36  -5.865   0.409   4.768
  306    HZ   PHE  36           HZ       PHE  36  -6.861   0.255   7.014
  307    H    GLY  37           H        GLY  37 -11.937   2.795   0.987
  308   1HA   GLY  37          2HA       GLY  37 -13.003   4.080  -0.592
  309   2HA   GLY  37          1HA       GLY  37 -12.755   5.471   0.449
  310    H    GLN  38           H        GLN  38 -12.568   6.065  -2.072
  311    HA   GLN  38           HA       GLN  38  -9.678   6.207  -2.639
  312   1HB   GLN  38          2HB       GLN  38 -11.985   5.612  -4.447
  313   2HB   GLN  38          1HB       GLN  38 -10.605   6.483  -5.102
  314   1HG   GLN  38          2HG       GLN  38  -9.350   4.647  -5.183
  315   2HG   GLN  38          1HG       GLN  38  -9.830   4.142  -3.566
  316   1HE2  GLN  38          1HE2      GLN  38 -12.215   3.380  -3.502
  317   2HE2  GLN  38          2HE2      GLN  38 -12.665   2.277  -4.751
  318    HA   PRO  39           HA       PRO  39  -8.714   7.084  -4.471
  319   1HB   PRO  39          2HB       PRO  39  -7.016   9.011  -5.182
  320   2HB   PRO  39          1HB       PRO  39  -8.545   8.785  -6.038
  321   1HG   PRO  39          2HG       PRO  39  -7.782  10.850  -4.033
  322   2HG   PRO  39          1HG       PRO  39  -8.839  10.991  -5.447
  323   1HD   PRO  39          2HD       PRO  39  -9.651  10.616  -2.774
  324   2HD   PRO  39          1HD       PRO  39 -10.670  10.469  -4.218
  325    H    LEU  40           H        LEU  40  -6.647   6.371  -3.852
  326    HA   LEU  40           HA       LEU  40  -5.404   7.632  -1.513
  327   1HB   LEU  40          2HB       LEU  40  -6.194   4.733  -1.755
  328   2HB   LEU  40          1HB       LEU  40  -4.995   5.295  -0.605
  329    HG   LEU  40           HG       LEU  40  -7.838   6.299  -0.662
  330   1HD1  LEU  40          1HD1      LEU  40  -7.612   3.827  -0.216
  331   2HD1  LEU  40          2HD1      LEU  40  -8.377   4.774   1.061
  332   3HD1  LEU  40          3HD1      LEU  40  -6.698   4.259   1.229
  333   1HD2  LEU  40          1HD2      LEU  40  -6.727   7.879   0.541
  334   2HD2  LEU  40          2HD2      LEU  40  -5.455   6.767   1.045
  335   3HD2  LEU  40          3HD2      LEU  40  -7.036   6.710   1.826
  336    H    ASP  41           H        ASP  41  -3.161   7.283  -1.317
  337    HA   ASP  41           HA       ASP  41  -1.896   6.087  -3.697
  338   1HB   ASP  41          2HB       ASP  41  -1.261   8.559  -2.137
  339   2HB   ASP  41          1HB       ASP  41   0.064   7.674  -2.884
  340    H    LEU  42           H        LEU  42  -0.693   4.337  -3.349
  341    HA   LEU  42           HA       LEU  42  -0.065   3.544  -0.622
  342   1HB   LEU  42          2HB       LEU  42   0.170   2.143  -3.279
  343   2HB   LEU  42          1HB       LEU  42   0.772   1.446  -1.787
  344    HG   LEU  42           HG       LEU  42  -2.109   2.225  -2.232
  345   1HD1  LEU  42          1HD1      LEU  42  -0.704  -0.412  -2.581
  346   2HD1  LEU  42          2HD1      LEU  42  -1.669   0.473  -3.763
  347   3HD1  LEU  42          3HD1      LEU  42  -2.449  -0.266  -2.366
  348   1HD2  LEU  42          1HD2      LEU  42  -0.563   1.093   0.021
  349   2HD2  LEU  42          2HD2      LEU  42  -2.151   0.390  -0.287
  350   3HD2  LEU  42          3HD2      LEU  42  -1.996   2.119   0.027
  351    H    HIS  43           H        HIS  43   1.681   4.593   0.170
  352    HA   HIS  43           HA       HIS  43   4.071   4.880  -1.495
  353   1HB   HIS  43          2HB       HIS  43   2.870   6.566   0.356
  354   2HB   HIS  43          1HB       HIS  43   4.260   5.926   1.223
  355    HD1  HIS  43           HD1      HIS  43   3.828   7.147  -2.364
  356    HD2  HIS  43           HD2      HIS  43   6.251   7.721   0.960
  357    HE1  HIS  43           HE1      HIS  43   5.572   8.807  -3.084
  358    HE2  HIS  43           HE2      HIS  43   6.973   9.207  -1.031
  359    H    TYR  44           H        TYR  44   5.687   3.464  -1.355
  360    HA   TYR  44           HA       TYR  44   5.834   1.718   1.003
  361   1HB   TYR  44          2HB       TYR  44   5.602   0.438  -1.001
  362   2HB   TYR  44          1HB       TYR  44   6.821   1.395  -1.835
  363    HD1  TYR  44           HD2      TYR  44   9.220   1.159  -1.172
  364    HD2  TYR  44           HD1      TYR  44   6.206  -1.456   0.299
  365    HE1  TYR  44           HE2      TYR  44  10.953  -0.463  -0.524
  366    HE2  TYR  44           HE1      TYR  44   7.930  -3.084   0.952
  367    HH   TYR  44           HH       TYR  44  10.787  -2.614   1.524
  368    H    MET  45           H        MET  45   7.354   2.174   2.459
  369    HA   MET  45           HA       MET  45   9.606   3.880   1.701
  370   1HB   MET  45          2HB       MET  45   8.549   2.989   4.387
  371   2HB   MET  45          1HB       MET  45  10.011   3.943   4.191
  372   1HG   MET  45          2HG       MET  45   7.503   4.936   2.947
  373   2HG   MET  45          1HG       MET  45   7.685   5.059   4.697
  374   1HE   MET  45          1HE       MET  45   8.580   7.198   5.723
  375   2HE   MET  45          2HE       MET  45  10.190   7.772   5.290
  376   3HE   MET  45          3HE       MET  45   9.955   6.094   5.781
  377    H    ASN  46           H        ASN  46  11.647   3.170   1.523
  378    HA   ASN  46           HA       ASN  46  12.157   0.330   1.760
  379   1HB   ASN  46          2HB       ASN  46  14.017   2.583   0.950
  380   2HB   ASN  46          1HB       ASN  46  14.360   0.864   0.796
  381   1HD2  ASN  46          1HD2      ASN  46  14.684   1.250  -1.455
  382   2HD2  ASN  46          2HD2      ASN  46  13.332   1.386  -2.523
  383    H    ASN  47           H        ASN  47  13.483   3.310   3.157
  384    HA   ASN  47           HA       ASN  47  13.783   2.234   5.748
  385   1HB   ASN  47          2HB       ASN  47  16.049   1.897   3.909
  386   2HB   ASN  47          1HB       ASN  47  16.476   2.721   5.406
  387   1HD2  ASN  47          1HD2      ASN  47  16.766  -0.113   4.134
  388   2HD2  ASN  47          2HD2      ASN  47  16.427  -1.152   5.471
  389    H    GLU  48           H        GLU  48  15.653   4.441   3.676
  390    HA   GLU  48           HA       GLU  48  15.108   6.608   5.585
  391   1HB   GLU  48          2HB       GLU  48  17.477   6.085   5.228
  392   2HB   GLU  48          1HB       GLU  48  17.285   6.363   3.504
  393   1HG   GLU  48          2HG       GLU  48  17.163   8.634   3.738
  394   2HG   GLU  48          1HG       GLU  48  16.562   8.543   5.393
  395    H    LEU  49           H        LEU  49  14.747   5.631   2.228
  396    HA   LEU  49           HA       LEU  49  13.570   8.251   1.598
  397   1HB   LEU  49          2HB       LEU  49  14.630   6.101  -0.234
  398   2HB   LEU  49          1HB       LEU  49  13.860   7.580  -0.774
  399    HG   LEU  49           HG       LEU  49  16.096   8.081   1.032
  400   1HD1  LEU  49          1HD1      LEU  49  17.373   6.396   0.221
  401   2HD1  LEU  49          2HD1      LEU  49  17.638   7.554  -1.081
  402   3HD1  LEU  49          3HD1      LEU  49  16.451   6.264  -1.276
  403   1HD2  LEU  49          1HD2      LEU  49  16.673   9.698  -0.659
  404   2HD2  LEU  49          2HD2      LEU  49  14.937   9.767  -0.363
  405   3HD2  LEU  49          3HD2      LEU  49  15.554   8.958  -1.804
  406    H    SER  50           H        SER  50  11.712   8.227   0.104
  407    HA   SER  50           HA       SER  50   9.890   6.003   0.739
  408   1HB   SER  50          2HB       SER  50   8.743   8.544  -0.257
  409   2HB   SER  50          1HB       SER  50   8.189   7.488   1.040
  410    HG   SER  50           HG       SER  50   8.974   9.544   1.771
  411    H    ILE  51           H        ILE  51   9.212   4.747  -0.873
  412    HA   ILE  51           HA       ILE  51   9.475   5.733  -3.644
  413    HB   ILE  51           HB       ILE  51   9.558   2.843  -2.783
  414   1HG1  ILE  51          2HG1      ILE  51  11.503   3.951  -1.834
  415   2HG1  ILE  51          1HG1      ILE  51  12.002   2.955  -3.195
  416   1HG2  ILE  51          1HG2      ILE  51  10.124   4.236  -5.386
  417   2HG2  ILE  51          2HG2      ILE  51   8.885   3.028  -5.046
  418   3HG2  ILE  51          3HG2      ILE  51  10.587   2.567  -5.056
  419   1HD1  ILE  51          1HD1      ILE  51  11.979   5.905  -2.911
  420   2HD1  ILE  51          2HD1      ILE  51  11.732   5.215  -4.513
  421   3HD1  ILE  51          3HD1      ILE  51  13.199   4.841  -3.609
  422    H    LEU  52           H        LEU  52   7.693   5.702  -4.915
  423    HA   LEU  52           HA       LEU  52   5.198   4.730  -3.732
  424   1HB   LEU  52          2HB       LEU  52   5.220   7.025  -4.569
  425   2HB   LEU  52          1HB       LEU  52   5.701   6.458  -6.157
  426    HG   LEU  52           HG       LEU  52   3.506   5.189  -6.243
  427   1HD1  LEU  52          1HD1      LEU  52   2.435   7.055  -4.204
  428   2HD1  LEU  52          2HD1      LEU  52   3.290   5.621  -3.635
  429   3HD1  LEU  52          3HD1      LEU  52   1.880   5.449  -4.680
  430   1HD2  LEU  52          1HD2      LEU  52   2.541   6.928  -7.322
  431   2HD2  LEU  52          2HD2      LEU  52   4.135   7.646  -7.093
  432   3HD2  LEU  52          3HD2      LEU  52   2.817   8.053  -5.994
  433    H    LEU  53           H        LEU  53   4.235   2.905  -4.381
  434    HA   LEU  53           HA       LEU  53   5.418   1.323  -6.487
  435   1HB   LEU  53          2HB       LEU  53   2.867   0.658  -5.038
  436   2HB   LEU  53          1HB       LEU  53   4.009  -0.439  -5.786
  437    HG   LEU  53           HG       LEU  53   4.444   1.128  -3.239
  438   1HD1  LEU  53          1HD1      LEU  53   4.389  -1.014  -2.141
  439   2HD1  LEU  53          2HD1      LEU  53   4.188  -1.841  -3.686
  440   3HD1  LEU  53          3HD1      LEU  53   2.905  -0.801  -3.070
  441   1HD2  LEU  53          1HD2      LEU  53   6.562   0.999  -4.246
  442   2HD2  LEU  53          2HD2      LEU  53   6.272  -0.634  -4.844
  443   3HD2  LEU  53          3HD2      LEU  53   6.509  -0.357  -3.119
  444    H    LYS  54           H        LYS  54   4.718   1.080  -8.519
  445    HA   LYS  54           HA       LYS  54   2.248   2.479  -9.293
  446   1HB   LYS  54          2HB       LYS  54   4.760   1.845 -10.835
  447   2HB   LYS  54          1HB       LYS  54   3.286   2.410 -11.613
  448   1HG   LYS  54          2HG       LYS  54   4.327   4.011  -9.346
  449   2HG   LYS  54          1HG       LYS  54   5.230   4.051 -10.860
  450   1HD   LYS  54          2HD       LYS  54   3.553   5.107 -11.995
  451   2HD   LYS  54          1HD       LYS  54   2.283   4.392 -11.003
  452   1HE   LYS  54          2HE       LYS  54   3.172   5.865  -9.113
  453   2HE   LYS  54          1HE       LYS  54   4.069   6.722 -10.365
  454   1HZ   LYS  54          1HZ       LYS  54   2.123   7.477 -11.352
  455   2HZ   LYS  54          2HZ       LYS  54   1.779   7.604  -9.701
  456   3HZ   LYS  54          3HZ       LYS  54   1.151   6.315 -10.598
  457    H    ASN  55           H        ASN  55   4.049  -0.532  -9.679
  458    HA   ASN  55           HA       ASN  55   1.588  -1.952 -10.267
  459   1HB   ASN  55          2HB       ASN  55   2.547  -3.029 -12.309
  460   2HB   ASN  55          1HB       ASN  55   2.244  -1.306 -12.502
  461   1HD2  ASN  55          1HD2      ASN  55   3.796  -1.946 -14.335
  462   2HD2  ASN  55          2HD2      ASN  55   5.474  -1.692 -14.010
  463    H    GLN  56           H        GLN  56   2.493  -4.416 -10.935
  464    HA   GLN  56           HA       GLN  56   3.383  -5.515  -8.538
  465   1HB   GLN  56          2HB       GLN  56   2.342  -6.600 -10.731
  466   2HB   GLN  56          1HB       GLN  56   4.032  -6.936 -11.078
  467   1HG   GLN  56          2HG       GLN  56   3.497  -8.839  -9.969
  468   2HG   GLN  56          1HG       GLN  56   4.009  -7.840  -8.608
  469   1HE2  GLN  56          1HE2      GLN  56   2.754  -9.034  -7.168
  470   2HE2  GLN  56          2HE2      GLN  56   1.033  -8.884  -7.111
  471    H    ASP  57           H        ASP  57   5.194  -4.445 -11.357
  472    HA   ASP  57           HA       ASP  57   7.680  -5.551 -10.845
  473   1HB   ASP  57          2HB       ASP  57   6.691  -3.182 -12.317
  474   2HB   ASP  57          1HB       ASP  57   8.394  -3.148 -11.877
  475    H    ASP  58           H        ASP  58   6.301  -2.519  -9.609
  476    HA   ASP  58           HA       ASP  58   8.574  -1.710  -8.139
  477   1HB   ASP  58          2HB       ASP  58   5.676  -0.973  -8.145
  478   2HB   ASP  58          1HB       ASP  58   6.682  -0.432  -6.806
  479    H    LEU  59           H        LEU  59   5.823  -3.772  -7.366
  480    HA   LEU  59           HA       LEU  59   6.390  -3.947  -4.573
  481   1HB   LEU  59          2HB       LEU  59   4.160  -4.388  -5.681
  482   2HB   LEU  59          1HB       LEU  59   4.821  -5.919  -6.225
  483    HG   LEU  59           HG       LEU  59   5.333  -6.189  -3.623
  484   1HD1  LEU  59          1HD1      LEU  59   4.050  -5.008  -2.191
  485   2HD1  LEU  59          2HD1      LEU  59   2.707  -4.877  -3.324
  486   3HD1  LEU  59          3HD1      LEU  59   4.103  -3.812  -3.484
  487   1HD2  LEU  59          1HD2      LEU  59   4.119  -7.911  -4.458
  488   2HD2  LEU  59          2HD2      LEU  59   2.994  -6.855  -5.311
  489   3HD2  LEU  59          3HD2      LEU  59   2.825  -7.102  -3.573
  490    H    ASP  60           H        ASP  60   7.222  -5.892  -7.407
  491    HA   ASP  60           HA       ASP  60   8.321  -8.103  -6.059
  492   1HB   ASP  60          2HB       ASP  60   8.598  -6.966  -8.809
  493   2HB   ASP  60          1HB       ASP  60   9.726  -8.216  -8.297
  494    H    LYS  61           H        LYS  61   9.822  -5.084  -7.192
  495    HA   LYS  61           HA       LYS  61  12.461  -5.803  -6.402
  496   1HB   LYS  61          2HB       LYS  61  12.991  -3.419  -6.715
  497   2HB   LYS  61          1HB       LYS  61  12.099  -4.079  -8.076
  498   1HG   LYS  61          2HG       LYS  61  10.225  -2.839  -7.630
  499   2HG   LYS  61          1HG       LYS  61  10.586  -2.711  -5.909
  500   1HD   LYS  61          2HD       LYS  61  10.915  -0.556  -6.882
  501   2HD   LYS  61          1HD       LYS  61  12.504  -1.224  -6.499
  502   1HE   LYS  61          2HE       LYS  61  12.303  -2.109  -8.998
  503   2HE   LYS  61          1HE       LYS  61  11.232  -0.716  -9.137
  504   1HZ   LYS  61          1HZ       LYS  61  13.662  -0.348  -9.662
  505   2HZ   LYS  61          2HZ       LYS  61  13.956  -0.490  -8.002
  506   3HZ   LYS  61          3HZ       LYS  61  12.955   0.744  -8.581
  507    H    ALA  62           H        ALA  62   9.743  -4.330  -4.761
  508    HA   ALA  62           HA       ALA  62  11.102  -3.229  -2.554
  509   1HB   ALA  62          1HB       ALA  62   8.308  -3.907  -3.208
  510   2HB   ALA  62          2HB       ALA  62   8.992  -2.433  -2.525
  511   3HB   ALA  62          3HB       ALA  62   8.698  -3.830  -1.490
  512    H    ILE  63           H        ILE  63   9.799  -6.468  -3.146
  513    HA   ILE  63           HA       ILE  63  10.160  -7.492  -0.543
  514    HB   ILE  63           HB       ILE  63  10.288  -9.049  -3.131
  515   1HG1  ILE  63          2HG1      ILE  63   7.833  -8.767  -1.423
  516   2HG1  ILE  63          1HG1      ILE  63   8.215  -7.534  -2.617
  517   1HG2  ILE  63          1HG2      ILE  63   9.175 -10.725  -1.356
  518   2HG2  ILE  63          2HG2      ILE  63  10.205  -9.789  -0.272
  519   3HG2  ILE  63          3HG2      ILE  63  10.912 -10.637  -1.647
  520   1HD1  ILE  63          1HD1      ILE  63   6.697  -9.680  -3.121
  521   2HD1  ILE  63          2HD1      ILE  63   8.279 -10.309  -3.586
  522   3HD1  ILE  63          3HD1      ILE  63   7.653  -8.846  -4.348
  523    H    ASP  64           H        ASP  64  12.308  -7.369  -3.357
  524    HA   ASP  64           HA       ASP  64  14.380  -8.969  -2.420
  525   1HB   ASP  64          2HB       ASP  64  13.983  -7.621  -4.707
  526   2HB   ASP  64          1HB       ASP  64  15.128  -6.525  -3.942
  527    H    ILE  65           H        ILE  65  13.687  -5.563  -1.776
  528    HA   ILE  65           HA       ILE  65  16.109  -5.011  -0.392
  529    HB   ILE  65           HB       ILE  65  13.471  -3.589  -0.015
  530   1HG1  ILE  65          2HG1      ILE  65  13.957  -3.644  -2.393
  531   2HG1  ILE  65          1HG1      ILE  65  14.269  -2.026  -1.775
  532   1HG2  ILE  65          1HG2      ILE  65  14.797  -2.690   1.604
  533   2HG2  ILE  65          2HG2      ILE  65  15.275  -1.667   0.249
  534   3HG2  ILE  65          3HG2      ILE  65  16.290  -3.027   0.728
  535   1HD1  ILE  65          1HD1      ILE  65  16.659  -2.489  -1.751
  536   2HD1  ILE  65          2HD1      ILE  65  15.976  -2.733  -3.358
  537   3HD1  ILE  65          3HD1      ILE  65  16.354  -4.123  -2.341
  538    H    LEU  66           H        LEU  66  12.925  -6.151   0.620
  539    HA   LEU  66           HA       LEU  66  13.294  -5.929   3.402
  540   1HB   LEU  66          2HB       LEU  66  11.175  -6.497   1.949
  541   2HB   LEU  66          1HB       LEU  66  11.678  -8.153   2.231
  542    HG   LEU  66           HG       LEU  66  11.684  -7.507   4.735
  543   1HD1  LEU  66          1HD1      LEU  66   9.580  -5.544   4.125
  544   2HD1  LEU  66          2HD1      LEU  66  11.232  -5.010   3.824
  545   3HD1  LEU  66          3HD1      LEU  66  10.767  -5.575   5.428
  546   1HD2  LEU  66          1HD2      LEU  66   9.889  -8.768   3.165
  547   2HD2  LEU  66          2HD2      LEU  66   8.898  -7.445   3.778
  548   3HD2  LEU  66          3HD2      LEU  66   9.691  -8.546   4.903
  549    H    ASP  67           H        ASP  67  14.164  -8.470   1.108
  550    HA   ASP  67           HA       ASP  67  14.813 -10.504   2.910
  551   1HB   ASP  67          2HB       ASP  67  14.717 -10.551   0.318
  552   2HB   ASP  67          1HB       ASP  67  16.401 -10.041   0.398
  553    H    ARG  68           H        ARG  68  16.685  -7.721   1.825
  554    HA   ARG  68           HA       ARG  68  19.162  -8.496   2.952
  555   1HB   ARG  68          2HB       ARG  68  18.063  -5.750   2.318
  556   2HB   ARG  68          1HB       ARG  68  19.730  -6.072   2.773
  557   1HG   ARG  68          2HG       ARG  68  20.228  -7.085   0.769
  558   2HG   ARG  68          1HG       ARG  68  18.548  -7.516   0.447
  559   1HD   ARG  68          2HD       ARG  68  18.058  -5.493  -0.455
  560   2HD   ARG  68          1HD       ARG  68  19.162  -4.628   0.612
  561    HE   ARG  68           HE       ARG  68  19.738  -5.684  -1.996
  562   1HH1  ARG  68          1HH1      ARG  68  21.140  -4.743   1.072
  563   2HH1  ARG  68          2HH1      ARG  68  22.709  -4.446   0.405
  564   1HH2  ARG  68          1HH2      ARG  68  21.809  -5.295  -2.870
  565   2HH2  ARG  68          2HH2      ARG  68  23.090  -4.759  -1.835
  566    H    SER  69           H        SER  69  16.326  -6.893   4.259
  567    HA   SER  69           HA       SER  69  17.522  -5.951   6.656
  568   1HB   SER  69          2HB       SER  69  15.381  -5.078   5.751
  569   2HB   SER  69          1HB       SER  69  14.610  -6.614   6.146
  570    HG   SER  69           HG       SER  69  14.838  -4.553   7.711
  571    H    SER  70           H        SER  70  16.850  -6.724   8.854
  572    HA   SER  70           HA       SER  70  17.493  -9.518   9.111
  573   1HB   SER  70          2HB       SER  70  18.020  -7.364  10.666
  574   2HB   SER  70          1HB       SER  70  16.618  -8.019  11.511
  575    HG   SER  70           HG       SER  70  18.425  -8.998  12.350
  576    H    SER  71           H        SER  71  14.617  -7.517   9.614
  577    HA   SER  71           HA       SER  71  13.060  -9.481  10.902
  578   1HB   SER  71          2HB       SER  71  11.153  -7.966   9.758
  579   2HB   SER  71          1HB       SER  71  12.045  -7.460  11.189
  580    HG   SER  71           HG       SER  71  12.004  -6.354   8.732
  581    H    MET  72           H        MET  72  12.535  -8.280   7.573
  582    HA   MET  72           HA       MET  72  11.678  -9.281   5.722
  583   1HB   MET  72          2HB       MET  72  13.908 -10.419   5.936
  584   2HB   MET  72          1HB       MET  72  13.089 -11.752   6.742
  585   1HG   MET  72          2HG       MET  72  11.663 -11.323   4.380
  586   2HG   MET  72          1HG       MET  72  13.364 -11.192   3.936
  587   1HE   MET  72          1HE       MET  72  15.037 -12.661   5.117
  588   2HE   MET  72          2HE       MET  72  14.985 -14.357   4.640
  589   3HE   MET  72          3HE       MET  72  14.511 -13.886   6.271
  590    H    LYS  73           H        LYS  73  10.042  -9.371   8.156
  591    HA   LYS  73           HA       LYS  73   8.441 -11.775   7.562
  592   1HB   LYS  73          2HB       LYS  73   9.047 -10.401  10.147
  593   2HB   LYS  73          1HB       LYS  73   7.501 -11.217   9.964
  594   1HG   LYS  73          2HG       LYS  73  10.019 -12.667   9.286
  595   2HG   LYS  73          1HG       LYS  73   9.539 -12.478  10.974
  596   1HD   LYS  73          2HD       LYS  73   8.357 -14.357  10.634
  597   2HD   LYS  73          1HD       LYS  73   7.203 -13.295   9.825
  598   1HE   LYS  73          2HE       LYS  73   8.327 -13.745   7.681
  599   2HE   LYS  73          1HE       LYS  73   9.436 -14.839   8.506
  600   1HZ   LYS  73          1HZ       LYS  73   7.295 -15.724   7.318
  601   2HZ   LYS  73          2HZ       LYS  73   6.555 -15.313   8.783
  602   3HZ   LYS  73          3HZ       LYS  73   7.833 -16.420   8.763
  603    H    SER  74           H        SER  74   8.418  -8.314   8.073
  604    HA   SER  74           HA       SER  74   5.624  -8.246   7.156
  605   1HB   SER  74          2HB       SER  74   5.467  -6.089   8.534
  606   2HB   SER  74          1HB       SER  74   5.487  -7.607   9.431
  607    HG   SER  74           HG       SER  74   7.470  -7.181  10.149
  608    H    LEU  75           H        LEU  75   5.036  -6.100   6.168
  609    HA   LEU  75           HA       LEU  75   7.312  -5.059   4.611
  610   1HB   LEU  75          2HB       LEU  75   4.555  -5.824   3.883
  611   2HB   LEU  75          1HB       LEU  75   5.128  -4.333   3.163
  612    HG   LEU  75           HG       LEU  75   5.530  -6.120   1.622
  613   1HD1  LEU  75          1HD1      LEU  75   8.287  -5.873   2.607
  614   2HD1  LEU  75          2HD1      LEU  75   7.424  -4.353   2.380
  615   3HD1  LEU  75          3HD1      LEU  75   7.600  -5.477   1.033
  616   1HD2  LEU  75          1HD2      LEU  75   5.581  -8.129   2.686
  617   2HD2  LEU  75          2HD2      LEU  75   6.540  -7.521   4.033
  618   3HD2  LEU  75          3HD2      LEU  75   7.316  -7.880   2.491
  619    H    ARG  76           H        ARG  76   7.857  -3.003   5.003
  620    HA   ARG  76           HA       ARG  76   6.137  -1.334   6.623
  621   1HB   ARG  76          2HB       ARG  76   8.958  -1.226   5.690
  622   2HB   ARG  76          1HB       ARG  76   8.181   0.305   6.064
  623   1HG   ARG  76          2HG       ARG  76   8.064  -0.134   8.291
  624   2HG   ARG  76          1HG       ARG  76   7.937  -1.879   8.056
  625   1HD   ARG  76          2HD       ARG  76  10.289  -2.020   7.529
  626   2HD   ARG  76          1HD       ARG  76  10.445  -0.265   7.601
  627    HE   ARG  76           HE       ARG  76  10.387  -2.101   9.815
  628   1HH1  ARG  76          1HH1      ARG  76   9.825   1.215   8.833
  629   2HH1  ARG  76          2HH1      ARG  76  10.082   1.859  10.419
  630   1HH2  ARG  76          1HH2      ARG  76  10.720  -1.247  11.905
  631   2HH2  ARG  76          2HH2      ARG  76  10.592   0.460  12.166
  632    H    ILE  77           H        ILE  77   4.380  -0.765   5.379
  633    HA   ILE  77           HA       ILE  77   4.960   0.985   3.077
  634    HB   ILE  77           HB       ILE  77   2.491  -0.734   3.300
  635   1HG1  ILE  77          2HG1      ILE  77   5.030  -1.300   1.750
  636   2HG1  ILE  77          1HG1      ILE  77   4.461  -2.195   3.154
  637   1HG2  ILE  77          1HG2      ILE  77   2.180  -0.202   0.968
  638   2HG2  ILE  77          2HG2      ILE  77   3.710   0.673   0.928
  639   3HG2  ILE  77          3HG2      ILE  77   2.365   1.292   1.888
  640   1HD1  ILE  77          1HD1      ILE  77   3.926  -3.475   1.243
  641   2HD1  ILE  77          2HD1      ILE  77   3.223  -2.081   0.421
  642   3HD1  ILE  77          3HD1      ILE  77   2.416  -2.777   1.826
  643    H    LEU  78           H        LEU  78   4.066   2.956   3.132
  644    HA   LEU  78           HA       LEU  78   2.043   3.509   5.209
  645   1HB   LEU  78          2HB       LEU  78   4.334   4.556   5.475
  646   2HB   LEU  78          1HB       LEU  78   3.997   5.480   4.025
  647    HG   LEU  78           HG       LEU  78   1.882   6.277   5.322
  648   1HD1  LEU  78          1HD1      LEU  78   1.751   5.096   7.265
  649   2HD1  LEU  78          2HD1      LEU  78   2.711   6.463   7.828
  650   3HD1  LEU  78          3HD1      LEU  78   3.499   4.940   7.423
  651   1HD2  LEU  78          1HD2      LEU  78   4.710   7.150   5.540
  652   2HD2  LEU  78          2HD2      LEU  78   3.529   7.919   6.602
  653   3HD2  LEU  78          3HD2      LEU  78   3.315   7.982   4.853
  654    H    LEU  79           H        LEU  79   0.081   3.898   4.378
  655    HA   LEU  79           HA       LEU  79  -0.070   5.083   1.687
  656   1HB   LEU  79          2HB       LEU  79  -2.311   4.096   1.512
  657   2HB   LEU  79          1HB       LEU  79  -1.062   2.888   1.741
  658    HG   LEU  79           HG       LEU  79  -1.817   3.206   4.302
  659   1HD1  LEU  79          1HD1      LEU  79  -3.942   3.891   4.639
  660   2HD1  LEU  79          2HD1      LEU  79  -4.501   3.298   3.076
  661   3HD1  LEU  79          3HD1      LEU  79  -3.632   4.828   3.178
  662   1HD2  LEU  79          1HD2      LEU  79  -2.825   1.128   4.116
  663   2HD2  LEU  79          2HD2      LEU  79  -1.770   1.169   2.704
  664   3HD2  LEU  79          3HD2      LEU  79  -3.498   1.482   2.525
  665    H    LEU  80           H        LEU  80  -1.148   6.942   1.358
  666    HA   LEU  80           HA       LEU  80  -2.732   8.058   3.562
  667   1HB   LEU  80          2HB       LEU  80  -0.829   9.780   2.001
  668   2HB   LEU  80          1HB       LEU  80  -1.651  10.150   3.503
  669    HG   LEU  80           HG       LEU  80   0.415   7.973   3.379
  670   1HD1  LEU  80          1HD1      LEU  80   0.887  10.925   3.742
  671   2HD1  LEU  80          2HD1      LEU  80   1.563   9.875   2.497
  672   3HD1  LEU  80          3HD1      LEU  80   2.050   9.673   4.180
  673   1HD2  LEU  80          1HD2      LEU  80   0.318   7.981   5.636
  674   2HD2  LEU  80          2HD2      LEU  80  -1.294   8.632   5.342
  675   3HD2  LEU  80          3HD2      LEU  80   0.038   9.719   5.728
  676    H    SER  81           H        SER  81  -4.260   9.673   2.924
  677    HA   SER  81           HA       SER  81  -5.240   9.229   0.221
  678   1HB   SER  81          2HB       SER  81  -6.693   9.165   2.336
  679   2HB   SER  81          1HB       SER  81  -6.566  10.923   2.338
  680    HG   SER  81           HG       SER  81  -8.436   9.987   1.219
  681    H    GLN  82           H        GLN  82  -5.587  10.839  -1.301
  682    HA   GLN  82           HA       GLN  82  -3.893  13.169  -1.011
  683   1HB   GLN  82          2HB       GLN  82  -5.238  11.835  -3.325
  684   2HB   GLN  82          1HB       GLN  82  -4.692  13.499  -3.487
  685   1HG   GLN  82          2HG       GLN  82  -2.701  11.675  -2.355
  686   2HG   GLN  82          1HG       GLN  82  -3.184  11.298  -4.007
  687   1HE2  GLN  82          1HE2      GLN  82  -2.613  14.295  -2.175
  688   2HE2  GLN  82          2HE2      GLN  82  -1.523  14.987  -3.323
  689    H    ASP  83           H        ASP  83  -6.856  12.656  -0.009
  690    HA   ASP  83           HA       ASP  83  -8.388  14.750  -1.121
  691   1HB   ASP  83          2HB       ASP  83  -9.794  14.469   0.995
  692   2HB   ASP  83          1HB       ASP  83  -9.621  13.062  -0.039
  693    H    ARG  84           H        ARG  84  -7.418  16.726  -1.144
  694    HA   ARG  84           HA       ARG  84  -6.858  18.803  -0.408
  695   1HB   ARG  84          2HB       ARG  84  -8.177  17.671   2.005
  696   2HB   ARG  84          1HB       ARG  84  -7.200  19.115   2.224
  697   1HG   ARG  84          2HG       ARG  84  -9.329  18.953   0.116
  698   2HG   ARG  84          1HG       ARG  84  -9.689  19.424   1.779
  699   1HD   ARG  84          2HD       ARG  84  -7.812  21.149   1.491
  700   2HD   ARG  84          1HD       ARG  84  -7.951  20.820  -0.235
  701    HE   ARG  84           HE       ARG  84  -9.868  22.056  -0.270
  702   1HH1  ARG  84          1HH1      ARG  84  -9.222  21.147   3.051
  703   2HH1  ARG  84          2HH1      ARG  84 -10.495  22.126   3.698
  704   1HH2  ARG  84          1HH2      ARG  84 -11.545  23.348   0.587
  705   2HH2  ARG  84          2HH2      ARG  84 -11.816  23.377   2.298
  706    H    ASN  85           H        ASN  85  -4.798  19.368  -0.424
  707    HA   ASN  85           HA       ASN  85  -3.028  18.417   1.708
  708   1HB   ASN  85          2HB       ASN  85  -2.315  18.352  -1.235
  709   2HB   ASN  85          1HB       ASN  85  -1.221  17.978   0.092
  710   1HD2  ASN  85          1HD2      ASN  85  -1.819  16.149   1.474
  711   2HD2  ASN  85          2HD2      ASN  85  -2.629  14.802   0.755
  712    H    LEU  86           H        LEU  86  -2.871  20.405   2.685
  713    HA   LEU  86           HA       LEU  86  -2.442  22.822   1.190
  714   1HB   LEU  86          2HB       LEU  86  -2.904  22.077   3.978
  715   2HB   LEU  86          1HB       LEU  86  -1.728  23.365   3.814
  716    HG   LEU  86           HG       LEU  86  -4.036  24.182   4.171
  717   1HD1  LEU  86          1HD1      LEU  86  -3.824  25.986   2.757
  718   2HD1  LEU  86          2HD1      LEU  86  -3.254  25.002   1.410
  719   3HD1  LEU  86          3HD1      LEU  86  -2.181  25.347   2.768
  720   1HD2  LEU  86          1HD2      LEU  86  -4.773  23.475   1.384
  721   2HD2  LEU  86          2HD2      LEU  86  -5.794  23.727   2.799
  722   3HD2  LEU  86          3HD2      LEU  86  -4.900  22.218   2.613
  723    H    GLU  87           H        GLU  87  -0.557  23.510   0.409
  724    HA   GLU  87           HA       GLU  87   1.900  22.171   1.160
  725   1HB   GLU  87          2HB       GLU  87   0.922  23.450  -1.165
  726   2HB   GLU  87          1HB       GLU  87   2.327  24.366  -0.644
  727   1HG   GLU  87          2HG       GLU  87   3.748  22.764  -1.261
  728   2HG   GLU  87          1HG       GLU  87   2.743  21.482  -0.583
  729    H    HIS  88           H        HIS  88   1.264  25.651   0.637
  730    HA   HIS  88           HA       HIS  88   2.542  26.239   3.207
  731   1HB   HIS  88          2HB       HIS  88   3.816  28.118   2.041
  732   2HB   HIS  88          1HB       HIS  88   4.403  26.482   1.774
  733    HD1  HIS  88           HD1      HIS  88   4.097  25.482  -0.603
  734    HD2  HIS  88           HD2      HIS  88   2.834  29.422  -0.227
  735    HE1  HIS  88           HE1      HIS  88   3.793  26.318  -2.954
  736    HE2  HIS  88           HE2      HIS  88   3.053  28.713  -2.704
  737    H    HIS  89           H        HIS  89   1.514  27.763   4.322
  738    HA   HIS  89           HA       HIS  89  -0.631  29.238   2.977
  739   1HB   HIS  89          2HB       HIS  89  -1.447  29.687   5.306
  740   2HB   HIS  89          1HB       HIS  89  -1.406  27.985   4.865
  741    HD1  HIS  89           HD1      HIS  89   0.043  30.446   7.235
  742    HD2  HIS  89           HD2      HIS  89   0.572  26.452   6.208
  743    HE1  HIS  89           HE1      HIS  89   1.434  29.453   9.083
  744    HE2  HIS  89           HE2      HIS  89   1.823  27.063   8.386
  745    H    HIS  90           H        HIS  90   2.494  29.747   4.271
  746    HA   HIS  90           HA       HIS  90   3.798  31.589   4.478
  747   1HB   HIS  90          2HB       HIS  90   1.632  32.506   2.696
  748   2HB   HIS  90          1HB       HIS  90   2.493  33.790   3.536
  749    HD1  HIS  90           HD1      HIS  90   3.257  30.809   1.309
  750    HD2  HIS  90           HD2      HIS  90   4.835  34.507   2.357
  751    HE1  HIS  90           HE1      HIS  90   5.235  31.150  -0.207
  752    HE2  HIS  90           HE2      HIS  90   6.105  33.442   0.372
  753    H    HIS  91           H        HIS  91   3.963  33.713   5.625
  754    HA   HIS  91           HA       HIS  91   3.631  35.040   7.440
  755   1HB   HIS  91          2HB       HIS  91   1.414  35.467   6.316
  756   2HB   HIS  91          1HB       HIS  91   0.726  34.200   7.325
  757    HD1  HIS  91           HD1      HIS  91   3.212  36.436   8.940
  758    HD2  HIS  91           HD2      HIS  91  -0.917  36.192   8.518
  759    HE1  HIS  91           HE1      HIS  91   2.266  38.029  10.638
  760    HE2  HIS  91           HE2      HIS  91  -0.228  37.939  10.295
  761    H    HIS  92           H        HIS  92   4.706  34.166   9.114
  762    HA   HIS  92           HA       HIS  92   3.234  32.375  10.902
  763   1HB   HIS  92          2HB       HIS  92   4.991  31.243   9.227
  764   2HB   HIS  92          1HB       HIS  92   6.110  31.736  10.493
  765    HD1  HIS  92           HD1      HIS  92   3.819  29.078   9.588
  766    HD2  HIS  92           HD2      HIS  92   5.348  30.639  13.119
  767    HE1  HIS  92           HE1      HIS  92   3.396  27.322  11.339
  768    HE2  HIS  92           HE2      HIS  92   4.256  28.327  13.483
  769    H    HIS  93           H        HIS  93   3.955  32.403  13.080
  770    HA   HIS  93           HA       HIS  93   5.466  34.829  13.756
  771   1HB   HIS  93          2HB       HIS  93   4.410  34.696  15.965
  772   2HB   HIS  93          1HB       HIS  93   3.197  34.714  14.694
  773    HD1  HIS  93           HD1      HIS  93   4.176  32.906  17.669
  774    HD2  HIS  93           HD2      HIS  93   2.142  31.995  14.161
  775    HE1  HIS  93           HE1      HIS  93   2.923  30.780  18.151
  776    HE2  HIS  93           HE2      HIS  93   1.806  30.182  15.973
  Start of MODEL   17
    1    H    GLN   1           H        GLN   1   8.201 -16.952   1.845
    2    HA   GLN   1           HA       GLN   1   8.244 -18.902   0.359
    3   1HB   GLN   1          2HB       GLN   1   8.605 -20.152   3.032
    4   2HB   GLN   1          1HB       GLN   1   7.533 -20.982   1.913
    5   1HG   GLN   1          2HG       GLN   1   9.607 -20.545   0.282
    6   2HG   GLN   1          1HG       GLN   1  10.458 -20.617   1.825
    7   1HE2  GLN   1          1HE2      GLN   1  11.414 -22.552   1.792
    8   2HE2  GLN   1          2HE2      GLN   1  10.607 -24.058   1.544
    9    H    SER   2           H        SER   2   6.451 -17.567  -0.129
   10    HA   SER   2           HA       SER   2   4.248 -17.099  -0.387
   11   1HB   SER   2          2HB       SER   2   4.118 -19.814   0.875
   12   2HB   SER   2          1HB       SER   2   2.633 -18.897   0.624
   13    HG   SER   2           HG       SER   2   2.938 -18.966  -1.536
   14    H    ASP   3           H        ASP   3   2.185 -16.599   0.841
   15    HA   ASP   3           HA       ASP   3   1.132 -15.412   2.461
   16   1HB   ASP   3          2HB       ASP   3   2.846 -17.223   4.156
   17   2HB   ASP   3          1HB       ASP   3   1.745 -16.050   4.871
   18    H    VAL   4           H        VAL   4   1.713 -13.326   2.132
   19    HA   VAL   4           HA       VAL   4   4.187 -12.378   3.418
   20    HB   VAL   4           HB       VAL   4   2.584 -10.914   1.319
   21   1HG1  VAL   4          1HG1      VAL   4   4.023  -9.525   2.748
   22   2HG1  VAL   4          2HG1      VAL   4   4.588  -9.561   1.078
   23   3HG1  VAL   4          3HG1      VAL   4   5.408 -10.523   2.306
   24   1HG2  VAL   4          1HG2      VAL   4   4.612 -13.047   1.064
   25   2HG2  VAL   4          2HG2      VAL   4   4.812 -11.648   0.009
   26   3HG2  VAL   4          3HG2      VAL   4   3.314 -12.575  -0.034
   27    H    ARG   5           H        ARG   5   4.022 -11.198   5.200
   28    HA   ARG   5           HA       ARG   5   1.416 -10.227   6.061
   29   1HB   ARG   5          2HB       ARG   5   3.635 -11.284   7.389
   30   2HB   ARG   5          1HB       ARG   5   3.637  -9.580   7.822
   31   1HG   ARG   5          2HG       ARG   5   1.974  -9.876   9.250
   32   2HG   ARG   5          1HG       ARG   5   0.975 -10.643   8.013
   33   1HD   ARG   5          2HD       ARG   5   1.418 -12.704   8.777
   34   2HD   ARG   5          1HD       ARG   5   3.132 -12.353   8.992
   35    HE   ARG   5           HE       ARG   5   1.070 -12.230  10.989
   36   1HH1  ARG   5          1HH1      ARG   5   4.229 -11.028  10.069
   37   2HH1  ARG   5          2HH1      ARG   5   4.696 -10.652  11.693
   38   1HH2  ARG   5          1HH2      ARG   5   1.690 -11.730  13.127
   39   2HH2  ARG   5          2HH2      ARG   5   3.253 -11.051  13.430
   40    H    ILE   6           H        ILE   6   0.827  -8.321   5.207
   41    HA   ILE   6           HA       ILE   6   2.851  -6.195   4.980
   42    HB   ILE   6           HB       ILE   6   0.134  -6.257   3.669
   43   1HG1  ILE   6          2HG1      ILE   6   2.759  -6.857   2.307
   44   2HG1  ILE   6          1HG1      ILE   6   1.746  -8.128   2.982
   45   1HG2  ILE   6          1HG2      ILE   6   1.544  -4.646   2.118
   46   2HG2  ILE   6          2HG2      ILE   6   2.461  -4.409   3.606
   47   3HG2  ILE   6          3HG2      ILE   6   0.732  -4.060   3.568
   48   1HD1  ILE   6          1HD1      ILE   6   1.495  -6.685   0.493
   49   2HD1  ILE   6          2HD1      ILE   6   0.004  -6.645   1.433
   50   3HD1  ILE   6          3HD1      ILE   6   0.739  -8.192   1.011
   51    H    LYS   7           H        LYS   7   2.780  -4.539   6.352
   52    HA   LYS   7           HA       LYS   7   0.366  -4.176   7.980
   53   1HB   LYS   7          2HB       LYS   7   1.857  -2.825   9.474
   54   2HB   LYS   7          1HB       LYS   7   2.301  -4.519   9.340
   55   1HG   LYS   7          2HG       LYS   7   3.662  -2.846   7.389
   56   2HG   LYS   7          1HG       LYS   7   3.989  -2.369   9.055
   57   1HD   LYS   7          2HD       LYS   7   4.079  -5.264   8.559
   58   2HD   LYS   7          1HD       LYS   7   5.315  -4.331   7.713
   59   1HE   LYS   7          2HE       LYS   7   4.800  -3.870  10.625
   60   2HE   LYS   7          1HE       LYS   7   5.792  -5.231  10.104
   61   1HZ   LYS   7          1HZ       LYS   7   7.414  -3.849   9.276
   62   2HZ   LYS   7          2HZ       LYS   7   6.903  -2.978  10.631
   63   3HZ   LYS   7          3HZ       LYS   7   6.373  -2.528   9.091
   64    H    PHE   8           H        PHE   8  -0.975  -2.631   7.413
   65    HA   PHE   8           HA       PHE   8   0.030  -0.340   5.872
   66   1HB   PHE   8          2HB       PHE   8  -2.597  -1.761   6.002
   67   2HB   PHE   8          1HB       PHE   8  -2.583  -0.053   5.567
   68    HD1  PHE   8           HD1      PHE   8  -1.083   0.654   3.621
   69    HD2  PHE   8           HD2      PHE   8  -2.154  -3.391   4.401
   70    HE1  PHE   8           HE1      PHE   8  -0.525   0.062   1.301
   71    HE2  PHE   8           HE2      PHE   8  -1.597  -3.989   2.081
   72    HZ   PHE   8           HZ       PHE   8  -0.780  -2.262   0.528
   73    H    GLU   9           H        GLU   9  -0.274   1.744   6.547
   74    HA   GLU   9           HA       GLU   9  -1.555   2.110   9.173
   75   1HB   GLU   9          2HB       GLU   9   1.153   2.722   8.322
   76   2HB   GLU   9          1HB       GLU   9   0.325   4.158   8.913
   77   1HG   GLU   9          2HG       GLU   9  -0.345   2.475  10.864
   78   2HG   GLU   9          1HG       GLU   9   1.161   1.715  10.355
   79    H    HIS  10           H        HIS  10  -3.033   3.674   9.331
   80    HA   HIS  10           HA       HIS  10  -3.135   5.793   7.318
   81   1HB   HIS  10          2HB       HIS  10  -4.596   3.974   6.499
   82   2HB   HIS  10          1HB       HIS  10  -5.497   4.032   8.010
   83    HD1  HIS  10           HD1      HIS  10  -7.547   4.489   6.329
   84    HD2  HIS  10           HD2      HIS  10  -4.760   7.548   6.709
   85    HE1  HIS  10           HE1      HIS  10  -8.680   6.545   5.429
   86    HE2  HIS  10           HE2      HIS  10  -7.021   8.406   5.789
   87    H    ASN  11           H        ASN  11  -3.192   7.645   8.392
   88    HA   ASN  11           HA       ASN  11  -3.594   9.231   9.969
   89   1HB   ASN  11          2HB       ASN  11  -6.016   8.263   9.276
   90   2HB   ASN  11          1HB       ASN  11  -6.032   7.891  10.997
   91   1HD2  ASN  11          1HD2      ASN  11  -7.516   9.876   9.305
   92   2HD2  ASN  11          2HD2      ASN  11  -7.277  11.388  10.103
   93    H    GLY  12           H        GLY  12  -1.941   7.019  10.753
   94   1HA   GLY  12          2HA       GLY  12  -0.794   6.746  12.800
   95   2HA   GLY  12          1HA       GLY  12  -2.236   7.276  13.653
   96    H    GLU  13           H        GLU  13  -4.052   5.474  12.288
   97    HA   GLU  13           HA       GLU  13  -3.833   3.227  13.980
   98   1HB   GLU  13          2HB       GLU  13  -5.522   3.650  11.508
   99   2HB   GLU  13          1HB       GLU  13  -5.710   2.306  12.624
  100   1HG   GLU  13          2HG       GLU  13  -5.963   4.212  14.401
  101   2HG   GLU  13          1HG       GLU  13  -6.375   5.184  12.989
  102    H    ARG  14           H        ARG  14  -3.013   1.217  13.684
  103    HA   ARG  14           HA       ARG  14  -1.731   0.659  11.089
  104   1HB   ARG  14          2HB       ARG  14  -0.093  -0.718  12.371
  105   2HB   ARG  14          1HB       ARG  14  -0.025   0.998  12.742
  106   1HG   ARG  14          2HG       ARG  14  -1.838  -0.253  14.549
  107   2HG   ARG  14          1HG       ARG  14  -0.333  -1.172  14.519
  108   1HD   ARG  14          2HD       ARG  14   0.924   0.892  14.934
  109   2HD   ARG  14          1HD       ARG  14  -0.589   1.800  14.984
  110    HE   ARG  14           HE       ARG  14  -0.963  -0.087  16.872
  111   1HH1  ARG  14          1HH1      ARG  14   1.640   2.184  16.297
  112   2HH1  ARG  14          2HH1      ARG  14   2.067   2.305  17.970
  113   1HH2  ARG  14          1HH2      ARG  14  -0.398   0.078  19.074
  114   2HH2  ARG  14          2HH2      ARG  14   0.911   1.110  19.547
  115    H    ARG  15           H        ARG  15  -2.008  -1.322  10.148
  116    HA   ARG  15           HA       ARG  15  -3.389  -3.439  11.597
  117   1HB   ARG  15          2HB       ARG  15  -4.580  -1.867   9.358
  118   2HB   ARG  15          1HB       ARG  15  -4.908  -3.593   9.426
  119   1HG   ARG  15          2HG       ARG  15  -5.920  -3.390  11.575
  120   2HG   ARG  15          1HG       ARG  15  -5.408  -1.707  11.716
  121   1HD   ARG  15          2HD       ARG  15  -6.788  -1.489   9.463
  122   2HD   ARG  15          1HD       ARG  15  -7.611  -2.904  10.119
  123    HE   ARG  15           HE       ARG  15  -7.869  -0.212  11.011
  124   1HH1  ARG  15          1HH1      ARG  15  -7.928  -3.535  12.115
  125   2HH1  ARG  15          2HH1      ARG  15  -8.924  -3.193  13.488
  126   1HH2  ARG  15          1HH2      ARG  15  -9.181   0.236  12.826
  127   2HH2  ARG  15          2HH2      ARG  15  -9.637  -1.051  13.892
  128    H    ILE  16           H        ILE  16  -2.818  -5.449  10.927
  129    HA   ILE  16           HA       ILE  16  -0.969  -5.608   8.644
  130    HB   ILE  16           HB       ILE  16  -1.323  -7.661  10.828
  131   1HG1  ILE  16          2HG1      ILE  16   0.832  -5.545  10.632
  132   2HG1  ILE  16          1HG1      ILE  16  -0.557  -5.439  11.708
  133   1HG2  ILE  16          1HG2      ILE  16   0.818  -7.238   8.747
  134   2HG2  ILE  16          2HG2      ILE  16  -0.339  -8.566   8.826
  135   3HG2  ILE  16          3HG2      ILE  16   0.910  -8.413  10.060
  136   1HD1  ILE  16          1HD1      ILE  16   1.881  -7.075  11.915
  137   2HD1  ILE  16          2HD1      ILE  16   0.377  -7.837  12.437
  138   3HD1  ILE  16          3HD1      ILE  16   0.901  -6.322  13.173
  139    H    ILE  17           H        ILE  17  -1.590  -6.612   6.844
  140    HA   ILE  17           HA       ILE  17  -3.913  -8.431   6.972
  141    HB   ILE  17           HB       ILE  17  -3.039  -6.865   4.544
  142   1HG1  ILE  17          2HG1      ILE  17  -3.706  -5.282   6.281
  143   2HG1  ILE  17          1HG1      ILE  17  -4.931  -5.347   5.018
  144   1HG2  ILE  17          1HG2      ILE  17  -4.577  -9.048   4.595
  145   2HG2  ILE  17          2HG2      ILE  17  -4.824  -7.730   3.453
  146   3HG2  ILE  17          3HG2      ILE  17  -5.812  -7.828   4.910
  147   1HD1  ILE  17          1HD1      ILE  17  -6.103  -5.291   7.047
  148   2HD1  ILE  17          2HD1      ILE  17  -5.049  -6.496   7.788
  149   3HD1  ILE  17          3HD1      ILE  17  -6.175  -6.971   6.517
  150    H    ALA  18           H        ALA  18  -3.693 -10.455   6.200
  151    HA   ALA  18           HA       ALA  18  -1.066 -11.262   5.211
  152   1HB   ALA  18          1HB       ALA  18  -1.460 -13.307   6.094
  153   2HB   ALA  18          2HB       ALA  18  -3.162 -13.300   5.634
  154   3HB   ALA  18          3HB       ALA  18  -2.634 -12.415   7.064
  155    H    PHE  19           H        PHE  19  -0.670 -11.894   3.169
  156    HA   PHE  19           HA       PHE  19  -2.960 -12.328   1.365
  157   1HB   PHE  19          2HB       PHE  19  -0.610 -10.511   1.045
  158   2HB   PHE  19          1HB       PHE  19  -1.246 -11.312  -0.388
  159    HD1  PHE  19           HD2      PHE  19  -3.565 -10.879  -1.118
  160    HD2  PHE  19           HD1      PHE  19  -1.778  -8.724   2.086
  161    HE1  PHE  19           HE2      PHE  19  -5.317  -9.161  -1.303
  162    HE2  PHE  19           HE1      PHE  19  -3.525  -7.002   1.908
  163    HZ   PHE  19           HZ       PHE  19  -5.298  -7.219   0.212
  164    H    SER  20           H        SER  20  -2.696 -13.862  -0.258
  165    HA   SER  20           HA       SER  20  -0.570 -15.800   0.225
  166   1HB   SER  20          2HB       SER  20  -3.203 -16.182  -0.213
  167   2HB   SER  20          1HB       SER  20  -2.614 -16.309  -1.870
  168    HG   SER  20           HG       SER  20  -2.634 -18.325  -0.726
  169    H    ARG  21           H        ARG  21   0.950 -16.424  -1.276
  170    HA   ARG  21           HA       ARG  21   1.313 -14.604  -3.541
  171   1HB   ARG  21          2HB       ARG  21   3.165 -16.410  -2.012
  172   2HB   ARG  21          1HB       ARG  21   3.615 -15.791  -3.596
  173   1HG   ARG  21          2HG       ARG  21   2.964 -13.483  -2.510
  174   2HG   ARG  21          1HG       ARG  21   3.296 -14.356  -1.013
  175   1HD   ARG  21          2HD       ARG  21   5.296 -14.675  -3.155
  176   2HD   ARG  21          1HD       ARG  21   5.172 -13.059  -2.461
  177    HE   ARG  21           HE       ARG  21   5.305 -14.649  -0.280
  178   1HH1  ARG  21          1HH1      ARG  21   7.287 -14.392  -3.153
  179   2HH1  ARG  21          2HH1      ARG  21   8.740 -14.867  -2.342
  180   1HH2  ARG  21          1HH2      ARG  21   7.225 -15.268   0.784
  181   2HH2  ARG  21          2HH2      ARG  21   8.706 -15.363  -0.109
  182    HA   PRO  22           HA       PRO  22   2.299 -14.432  -5.455
  183   1HB   PRO  22          2HB       PRO  22   0.823 -14.526  -7.953
  184   2HB   PRO  22          1HB       PRO  22   2.568 -14.498  -7.701
  185   1HG   PRO  22          2HG       PRO  22   1.232 -16.663  -8.669
  186   2HG   PRO  22          1HG       PRO  22   2.742 -16.779  -7.749
  187   1HD   PRO  22          2HD       PRO  22  -0.077 -17.213  -6.830
  188   2HD   PRO  22          1HD       PRO  22   1.396 -18.126  -6.430
  189    H    VAL  23           H        VAL  23   1.391 -12.403  -5.323
  190    HA   VAL  23           HA       VAL  23  -1.547 -12.302  -5.114
  191    HB   VAL  23           HB       VAL  23  -0.457 -11.991  -2.931
  192   1HG1  VAL  23          1HG1      VAL  23   1.098 -10.349  -2.443
  193   2HG1  VAL  23          2HG1      VAL  23   0.676  -9.383  -3.857
  194   3HG1  VAL  23          3HG1      VAL  23   1.600 -10.872  -4.050
  195   1HG2  VAL  23          1HG2      VAL  23  -1.775  -9.522  -4.054
  196   2HG2  VAL  23          2HG2      VAL  23  -1.543  -9.848  -2.336
  197   3HG2  VAL  23          3HG2      VAL  23  -2.574 -10.904  -3.301
  198    H    LYS  24           H        LYS  24  -2.509 -11.107  -6.606
  199    HA   LYS  24           HA       LYS  24  -1.011  -9.440  -8.391
  200   1HB   LYS  24          2HB       LYS  24  -3.911 -10.169  -8.120
  201   2HB   LYS  24          1HB       LYS  24  -3.423  -8.874  -9.203
  202   1HG   LYS  24          2HG       LYS  24  -3.360 -10.579 -10.681
  203   2HG   LYS  24          1HG       LYS  24  -1.728 -10.755 -10.032
  204   1HD   LYS  24          2HD       LYS  24  -3.221 -12.227  -8.268
  205   2HD   LYS  24          1HD       LYS  24  -4.049 -12.523  -9.798
  206   1HE   LYS  24          2HE       LYS  24  -2.342 -13.726 -10.635
  207   2HE   LYS  24          1HE       LYS  24  -1.119 -12.667  -9.935
  208   1HZ   LYS  24          1HZ       LYS  24  -1.232 -15.016  -9.051
  209   2HZ   LYS  24          2HZ       LYS  24  -2.674 -14.572  -8.288
  210   3HZ   LYS  24          3HZ       LYS  24  -1.232 -13.783  -7.894
  211    H    TYR  25           H        TYR  25  -0.707  -7.298  -8.328
  212    HA   TYR  25           HA       TYR  25  -1.174  -5.767  -6.052
  213   1HB   TYR  25          2HB       TYR  25   0.503  -5.218  -7.788
  214   2HB   TYR  25          1HB       TYR  25  -0.798  -4.771  -8.885
  215    HD1  TYR  25           HD1      TYR  25   0.925  -3.839  -5.745
  216    HD2  TYR  25           HD2      TYR  25  -1.827  -2.625  -8.761
  217    HE1  TYR  25           HE1      TYR  25   1.013  -1.535  -4.893
  218    HE2  TYR  25           HE2      TYR  25  -1.744  -0.319  -7.914
  219    HH   TYR  25           HH       TYR  25   0.599   0.817  -5.898
  220    H    GLU  26           H        GLU  26  -3.151  -6.190  -8.944
  221    HA   GLU  26           HA       GLU  26  -4.971  -4.098  -8.522
  222   1HB   GLU  26          2HB       GLU  26  -5.023  -6.656 -10.050
  223   2HB   GLU  26          1HB       GLU  26  -6.554  -5.840  -9.767
  224   1HG   GLU  26          2HG       GLU  26  -4.961  -3.794 -10.633
  225   2HG   GLU  26          1HG       GLU  26  -4.368  -5.165 -11.573
  226    H    ASP  27           H        ASP  27  -4.978  -7.451  -7.360
  227    HA   ASP  27           HA       ASP  27  -7.515  -7.304  -6.100
  228   1HB   ASP  27          2HB       ASP  27  -5.169  -9.168  -5.847
  229   2HB   ASP  27          1HB       ASP  27  -6.552  -9.310  -4.767
  230    H    VAL  28           H        VAL  28  -4.201  -6.823  -4.926
  231    HA   VAL  28           HA       VAL  28  -4.836  -6.477  -2.208
  232    HB   VAL  28           HB       VAL  28  -2.556  -5.119  -3.653
  233   1HG1  VAL  28          1HG1      VAL  28  -3.226  -4.605  -1.187
  234   2HG1  VAL  28          2HG1      VAL  28  -1.532  -4.871  -1.599
  235   3HG1  VAL  28          3HG1      VAL  28  -2.471  -6.165  -0.854
  236   1HG2  VAL  28          1HG2      VAL  28  -1.426  -7.321  -2.588
  237   2HG2  VAL  28          2HG2      VAL  28  -2.002  -7.224  -4.252
  238   3HG2  VAL  28          3HG2      VAL  28  -3.014  -7.962  -3.011
  239    H    GLU  29           H        GLU  29  -4.470  -4.100  -4.835
  240    HA   GLU  29           HA       GLU  29  -4.998  -1.828  -3.237
  241   1HB   GLU  29          2HB       GLU  29  -5.208  -0.609  -5.306
  242   2HB   GLU  29          1HB       GLU  29  -3.885  -1.755  -5.461
  243   1HG   GLU  29          2HG       GLU  29  -5.223  -3.221  -6.787
  244   2HG   GLU  29          1HG       GLU  29  -6.662  -2.250  -6.502
  245    H    HIS  30           H        HIS  30  -7.096  -3.886  -5.225
  246    HA   HIS  30           HA       HIS  30  -9.445  -2.403  -5.060
  247   1HB   HIS  30          2HB       HIS  30  -8.749  -5.218  -5.610
  248   2HB   HIS  30          1HB       HIS  30 -10.402  -4.946  -5.066
  249    HD1  HIS  30           HD1      HIS  30  -8.262  -2.899  -7.465
  250    HD2  HIS  30           HD2      HIS  30 -11.868  -4.958  -7.333
  251    HE1  HIS  30           HE1      HIS  30  -9.345  -2.501  -9.698
  252    HE2  HIS  30           HE2      HIS  30 -11.473  -3.848  -9.634
  253    H    LYS  31           H        LYS  31  -8.142  -4.817  -2.806
  254    HA   LYS  31           HA       LYS  31 -10.386  -4.766  -1.056
  255   1HB   LYS  31          2HB       LYS  31  -8.566  -6.574  -1.264
  256   2HB   LYS  31          1HB       LYS  31  -7.596  -5.537  -0.228
  257   1HG   LYS  31          2HG       LYS  31  -8.951  -5.868   1.607
  258   2HG   LYS  31          1HG       LYS  31 -10.351  -6.297   0.623
  259   1HD   LYS  31          2HD       LYS  31  -9.645  -8.465   0.315
  260   2HD   LYS  31          1HD       LYS  31  -7.944  -8.057   0.549
  261   1HE   LYS  31          2HE       LYS  31  -8.064  -8.274   2.798
  262   2HE   LYS  31          1HE       LYS  31  -9.701  -7.625   2.877
  263   1HZ   LYS  31          1HZ       LYS  31  -8.807 -10.380   2.542
  264   2HZ   LYS  31          2HZ       LYS  31 -10.197  -9.929   1.689
  265   3HZ   LYS  31          3HZ       LYS  31 -10.148  -9.772   3.372
  266    H    VAL  32           H        VAL  32  -7.166  -3.235  -0.895
  267    HA   VAL  32           HA       VAL  32  -7.592  -1.906   1.551
  268    HB   VAL  32           HB       VAL  32  -5.781  -0.967  -0.674
  269   1HG1  VAL  32          1HG1      VAL  32  -6.384   0.327   1.619
  270   2HG1  VAL  32          2HG1      VAL  32  -4.830   0.454   0.795
  271   3HG1  VAL  32          3HG1      VAL  32  -5.019  -0.652   2.154
  272   1HG2  VAL  32          1HG2      VAL  32  -5.696  -3.430   0.658
  273   2HG2  VAL  32          2HG2      VAL  32  -4.445  -2.438   1.407
  274   3HG2  VAL  32          3HG2      VAL  32  -4.434  -2.704  -0.337
  275    H    THR  33           H        THR  33  -8.177  -0.899  -1.798
  276    HA   THR  33           HA       THR  33  -8.800   1.779  -1.311
  277    HB   THR  33           HB       THR  33  -9.824  -0.096  -3.451
  278    HG1  THR  33           HG1      THR  33  -7.705   1.781  -3.352
  279   1HG2  THR  33          1HG2      THR  33 -10.528   2.676  -2.932
  280   2HG2  THR  33          2HG2      THR  33 -11.264   1.498  -4.019
  281   3HG2  THR  33          3HG2      THR  33  -9.851   2.416  -4.539
  282    H    THR  34           H        THR  34 -10.886  -1.103  -1.231
  283    HA   THR  34           HA       THR  34 -13.270   0.383  -0.703
  284    HB   THR  34           HB       THR  34 -12.779  -2.542  -0.127
  285    HG1  THR  34           HG1      THR  34 -13.159  -2.952  -2.196
  286   1HG2  THR  34          1HG2      THR  34 -15.352  -2.098  -1.141
  287   2HG2  THR  34          2HG2      THR  34 -15.095  -0.884   0.111
  288   3HG2  THR  34          3HG2      THR  34 -14.900  -2.595   0.489
  289    H    VAL  35           H        VAL  35 -10.832  -1.169   1.321
  290    HA   VAL  35           HA       VAL  35 -12.279  -1.023   3.753
  291    HB   VAL  35           HB       VAL  35  -9.277  -1.065   3.394
  292   1HG1  VAL  35          1HG1      VAL  35 -10.457  -2.328   5.756
  293   2HG1  VAL  35          2HG1      VAL  35 -10.672  -0.580   5.693
  294   3HG1  VAL  35          3HG1      VAL  35  -9.053  -1.272   5.613
  295   1HG2  VAL  35          1HG2      VAL  35 -10.532  -3.556   4.190
  296   2HG2  VAL  35          2HG2      VAL  35  -9.375  -3.236   2.900
  297   3HG2  VAL  35          3HG2      VAL  35 -11.098  -3.003   2.614
  298    H    PHE  36           H        PHE  36  -9.723   1.096   2.415
  299    HA   PHE  36           HA       PHE  36 -10.413   3.090   4.458
  300   1HB   PHE  36          2HB       PHE  36  -7.997   3.008   2.650
  301   2HB   PHE  36          1HB       PHE  36  -8.263   4.114   3.992
  302    HD1  PHE  36           HD2      PHE  36  -9.237   2.332   6.096
  303    HD2  PHE  36           HD1      PHE  36  -6.157   1.741   3.218
  304    HE1  PHE  36           HE2      PHE  36  -8.126   0.747   7.615
  305    HE2  PHE  36           HE1      PHE  36  -5.043   0.156   4.731
  306    HZ   PHE  36           HZ       PHE  36  -6.027  -0.341   6.931
  307    H    GLY  37           H        GLY  37 -11.620   2.495   1.566
  308   1HA   GLY  37          2HA       GLY  37 -12.773   3.812   0.076
  309   2HA   GLY  37          1HA       GLY  37 -12.412   5.186   1.106
  310    H    GLN  38           H        GLN  38 -12.442   5.689  -1.509
  311    HA   GLN  38           HA       GLN  38  -9.589   5.984  -2.176
  312   1HB   GLN  38          2HB       GLN  38 -10.451   5.957  -4.637
  313   2HB   GLN  38          1HB       GLN  38 -10.166   4.441  -3.797
  314   1HG   GLN  38          2HG       GLN  38 -12.596   4.332  -3.288
  315   2HG   GLN  38          1HG       GLN  38 -12.823   5.773  -4.280
  316   1HE2  GLN  38          1HE2      GLN  38 -11.261   5.360  -6.418
  317   2HE2  GLN  38          2HE2      GLN  38 -11.751   3.948  -7.283
  318    HA   PRO  39           HA       PRO  39  -8.753   6.803  -4.155
  319   1HB   PRO  39          2HB       PRO  39  -7.208   8.816  -4.966
  320   2HB   PRO  39          1HB       PRO  39  -8.719   8.432  -5.797
  321   1HG   PRO  39          2HG       PRO  39  -8.123  10.628  -3.871
  322   2HG   PRO  39          1HG       PRO  39  -9.156  10.646  -5.309
  323   1HD   PRO  39          2HD       PRO  39 -10.018  10.341  -2.660
  324   2HD   PRO  39          1HD       PRO  39 -10.972   9.989  -4.113
  325    H    LEU  40           H        LEU  40  -6.637   6.281  -3.561
  326    HA   LEU  40           HA       LEU  40  -5.446   7.699  -1.286
  327   1HB   LEU  40          2HB       LEU  40  -6.122   4.773  -1.415
  328   2HB   LEU  40          1HB       LEU  40  -4.837   5.368  -0.381
  329    HG   LEU  40           HG       LEU  40  -7.685   6.343  -0.196
  330   1HD1  LEU  40          1HD1      LEU  40  -6.318   4.205   1.433
  331   2HD1  LEU  40          2HD1      LEU  40  -7.585   3.931   0.235
  332   3HD1  LEU  40          3HD1      LEU  40  -7.939   4.845   1.702
  333   1HD2  LEU  40          1HD2      LEU  40  -5.578   7.609   0.733
  334   2HD2  LEU  40          2HD2      LEU  40  -5.697   6.407   2.017
  335   3HD2  LEU  40          3HD2      LEU  40  -7.056   7.480   1.685
  336    H    ASP  41           H        ASP  41  -3.158   7.286  -1.018
  337    HA   ASP  41           HA       ASP  41  -1.884   6.292  -3.485
  338   1HB   ASP  41          2HB       ASP  41   0.021   7.813  -2.909
  339   2HB   ASP  41          1HB       ASP  41  -1.479   8.656  -3.291
  340    H    LEU  42           H        LEU  42  -0.373   4.734  -3.339
  341    HA   LEU  42           HA       LEU  42   0.086   3.548  -0.717
  342   1HB   LEU  42          2HB       LEU  42   0.769   2.579  -3.494
  343   2HB   LEU  42          1HB       LEU  42   1.077   1.680  -2.020
  344    HG   LEU  42           HG       LEU  42  -1.539   2.045  -1.688
  345   1HD1  LEU  42          1HD1      LEU  42  -2.327   3.160  -3.494
  346   2HD1  LEU  42          2HD1      LEU  42  -2.380   1.533  -4.175
  347   3HD1  LEU  42          3HD1      LEU  42  -1.026   2.601  -4.547
  348   1HD2  LEU  42          1HD2      LEU  42  -1.818  -0.176  -2.295
  349   2HD2  LEU  42          2HD2      LEU  42  -0.088  -0.076  -1.964
  350   3HD2  LEU  42          3HD2      LEU  42  -0.670  -0.061  -3.628
  351    H    HIS  43           H        HIS  43   1.684   4.538   0.382
  352    HA   HIS  43           HA       HIS  43   4.205   5.090  -1.038
  353   1HB   HIS  43          2HB       HIS  43   2.682   6.822   0.444
  354   2HB   HIS  43          1HB       HIS  43   3.869   6.284   1.627
  355    HD1  HIS  43           HD1      HIS  43   3.427   8.997  -0.446
  356    HD2  HIS  43           HD2      HIS  43   6.605   6.366   0.047
  357    HE1  HIS  43           HE1      HIS  43   5.449  10.217  -1.312
  358    HE2  HIS  43           HE2      HIS  43   7.339   8.567  -1.103
  359    H    TYR  44           H        TYR  44   5.876   3.814  -0.605
  360    HA   TYR  44           HA       TYR  44   5.984   2.467   2.013
  361   1HB   TYR  44          2HB       TYR  44   5.445   0.757   0.451
  362   2HB   TYR  44          1HB       TYR  44   6.587   1.374  -0.734
  363    HD1  TYR  44           HD1      TYR  44   9.029   1.075  -0.362
  364    HD2  TYR  44           HD2      TYR  44   6.133  -0.771   2.147
  365    HE1  TYR  44           HE1      TYR  44  10.746  -0.480   0.466
  366    HE2  TYR  44           HE2      TYR  44   7.841  -2.330   2.984
  367    HH   TYR  44           HH       TYR  44  10.191  -3.250   1.889
  368    H    MET  45           H        MET  45   7.823   2.730   3.136
  369    HA   MET  45           HA       MET  45  10.204   3.709   1.706
  370   1HB   MET  45          2HB       MET  45  10.734   5.131   3.665
  371   2HB   MET  45          1HB       MET  45   9.253   5.611   2.855
  372   1HG   MET  45          2HG       MET  45   8.434   5.683   4.935
  373   2HG   MET  45          1HG       MET  45   8.263   3.941   4.727
  374   1HE   MET  45          1HE       MET  45   8.424   3.418   7.529
  375   2HE   MET  45          2HE       MET  45   8.134   5.152   7.394
  376   3HE   MET  45          3HE       MET  45   9.402   4.552   8.463
  377    H    ASN  46           H        ASN  46  12.074   2.695   2.162
  378    HA   ASN  46           HA       ASN  46  12.066   0.271   3.607
  379   1HB   ASN  46          2HB       ASN  46  14.336   1.967   2.552
  380   2HB   ASN  46          1HB       ASN  46  14.582   0.402   3.321
  381   1HD2  ASN  46          1HD2      ASN  46  14.862   1.564   0.489
  382   2HD2  ASN  46          2HD2      ASN  46  14.115   0.363  -0.502
  383    H    ASN  47           H        ASN  47  13.705   3.349   4.336
  384    HA   ASN  47           HA       ASN  47  13.165   3.065   7.148
  385   1HB   ASN  47          2HB       ASN  47  15.631   3.264   7.752
  386   2HB   ASN  47          1HB       ASN  47  15.095   1.691   7.176
  387   1HD2  ASN  47          1HD2      ASN  47  15.662   1.045   5.043
  388   2HD2  ASN  47          2HD2      ASN  47  17.024   1.746   4.245
  389    H    GLU  48           H        GLU  48  15.289   4.768   4.836
  390    HA   GLU  48           HA       GLU  48  14.301   7.313   5.934
  391   1HB   GLU  48          2HB       GLU  48  17.098   6.413   5.426
  392   2HB   GLU  48          1HB       GLU  48  16.707   8.100   5.122
  393   1HG   GLU  48          2HG       GLU  48  17.002   8.507   7.272
  394   2HG   GLU  48          1HG       GLU  48  15.592   7.510   7.615
  395    H    LEU  49           H        LEU  49  14.031   5.436   3.332
  396    HA   LEU  49           HA       LEU  49  13.947   7.725   1.488
  397   1HB   LEU  49          2HB       LEU  49  15.091   4.986   1.024
  398   2HB   LEU  49          1HB       LEU  49  14.499   5.952  -0.312
  399    HG   LEU  49           HG       LEU  49  16.362   7.412   1.402
  400   1HD1  LEU  49          1HD1      LEU  49  18.346   6.180   0.445
  401   2HD1  LEU  49          2HD1      LEU  49  17.234   4.867   0.058
  402   3HD1  LEU  49          3HD1      LEU  49  17.476   5.355   1.736
  403   1HD2  LEU  49          1HD2      LEU  49  15.673   8.285  -0.724
  404   2HD2  LEU  49          2HD2      LEU  49  16.187   6.812  -1.546
  405   3HD2  LEU  49          3HD2      LEU  49  17.386   7.879  -0.815
  406    H    SER  50           H        SER  50  12.155   7.860   0.204
  407    HA   SER  50           HA       SER  50  10.117   5.767   0.581
  408   1HB   SER  50          2HB       SER  50   8.427   7.412   0.387
  409   2HB   SER  50          1HB       SER  50   9.652   8.143   1.422
  410    HG   SER  50           HG       SER  50  10.356   9.364  -0.308
  411    H    ILE  51           H        ILE  51   9.338   4.700  -1.133
  412    HA   ILE  51           HA       ILE  51   9.929   5.730  -3.830
  413    HB   ILE  51           HB       ILE  51  10.099   2.811  -3.076
  414   1HG1  ILE  51          2HG1      ILE  51  12.446   4.612  -3.681
  415   2HG1  ILE  51          1HG1      ILE  51  11.892   4.314  -2.036
  416   1HG2  ILE  51          1HG2      ILE  51  10.907   4.304  -5.569
  417   2HG2  ILE  51          2HG2      ILE  51   9.536   3.208  -5.401
  418   3HG2  ILE  51          3HG2      ILE  51  11.180   2.587  -5.272
  419   1HD1  ILE  51          1HD1      ILE  51  12.301   1.925  -2.337
  420   2HD1  ILE  51          2HD1      ILE  51  13.759   2.879  -2.607
  421   3HD1  ILE  51          3HD1      ILE  51  12.862   2.234  -3.981
  422    H    LEU  52           H        LEU  52   8.277   5.620  -5.262
  423    HA   LEU  52           HA       LEU  52   5.700   4.715  -4.284
  424   1HB   LEU  52          2HB       LEU  52   6.430   6.826  -5.822
  425   2HB   LEU  52          1HB       LEU  52   5.941   5.686  -7.061
  426    HG   LEU  52           HG       LEU  52   3.834   5.512  -5.342
  427   1HD1  LEU  52          1HD1      LEU  52   3.205   7.743  -4.662
  428   2HD1  LEU  52          2HD1      LEU  52   4.699   8.400  -5.330
  429   3HD1  LEU  52          3HD1      LEU  52   4.756   7.316  -3.941
  430   1HD2  LEU  52          1HD2      LEU  52   3.679   5.755  -7.749
  431   2HD2  LEU  52          2HD2      LEU  52   4.198   7.437  -7.637
  432   3HD2  LEU  52          3HD2      LEU  52   2.649   6.945  -6.952
  433    H    LEU  53           H        LEU  53   4.623   2.926  -4.919
  434    HA   LEU  53           HA       LEU  53   5.754   1.345  -7.134
  435   1HB   LEU  53          2HB       LEU  53   4.436  -0.049  -4.852
  436   2HB   LEU  53          1HB       LEU  53   5.677  -0.625  -5.948
  437    HG   LEU  53           HG       LEU  53   7.106   1.243  -4.661
  438   1HD1  LEU  53          1HD1      LEU  53   6.414   1.793  -2.594
  439   2HD1  LEU  53          2HD1      LEU  53   5.667   0.221  -2.307
  440   3HD1  LEU  53          3HD1      LEU  53   4.815   1.445  -3.249
  441   1HD2  LEU  53          1HD2      LEU  53   6.553  -1.610  -3.900
  442   2HD2  LEU  53          2HD2      LEU  53   7.780  -0.641  -3.081
  443   3HD2  LEU  53          3HD2      LEU  53   7.913  -0.955  -4.812
  444    H    LYS  54           H        LYS  54   4.195   2.155  -8.566
  445    HA   LYS  54           HA       LYS  54   1.409   1.388  -7.996
  446   1HB   LYS  54          2HB       LYS  54   2.344   3.833  -8.749
  447   2HB   LYS  54          1HB       LYS  54   1.945   3.138 -10.313
  448   1HG   LYS  54          2HG       LYS  54  -0.334   2.764  -9.614
  449   2HG   LYS  54          1HG       LYS  54   0.043   3.334  -7.988
  450   1HD   LYS  54          2HD       LYS  54   0.873   5.461  -9.385
  451   2HD   LYS  54          1HD       LYS  54  -0.358   4.859 -10.499
  452   1HE   LYS  54          2HE       LYS  54  -1.587   4.725  -8.022
  453   2HE   LYS  54          1HE       LYS  54  -0.653   6.216  -7.940
  454   1HZ   LYS  54          1HZ       LYS  54  -2.225   7.192  -9.133
  455   2HZ   LYS  54          2HZ       LYS  54  -3.079   5.741  -9.281
  456   3HZ   LYS  54          3HZ       LYS  54  -1.908   6.152 -10.430
  457    H    ASN  55           H        ASN  55   3.587  -0.376  -9.008
  458    HA   ASN  55           HA       ASN  55   2.101  -1.545 -11.192
  459   1HB   ASN  55          2HB       ASN  55   4.406   0.080 -11.723
  460   2HB   ASN  55          1HB       ASN  55   4.790  -1.593 -12.113
  461   1HD2  ASN  55          1HD2      ASN  55   2.329   0.901 -12.626
  462   2HD2  ASN  55          2HD2      ASN  55   1.898   0.389 -14.219
  463    H    GLN  56           H        GLN  56   2.735  -3.735 -11.644
  464    HA   GLN  56           HA       GLN  56   3.453  -5.218  -9.374
  465   1HB   GLN  56          2HB       GLN  56   2.119  -6.039 -11.353
  466   2HB   GLN  56          1HB       GLN  56   3.634  -6.169 -12.234
  467   1HG   GLN  56          2HG       GLN  56   3.631  -8.272 -11.495
  468   2HG   GLN  56          1HG       GLN  56   4.225  -7.566  -9.993
  469   1HE2  GLN  56          1HE2      GLN  56   3.196  -8.212  -8.247
  470   2HE2  GLN  56          2HE2      GLN  56   1.548  -8.723  -8.163
  471    H    ASP  57           H        ASP  57   5.363  -3.989 -12.058
  472    HA   ASP  57           HA       ASP  57   7.694  -5.494 -11.686
  473   1HB   ASP  57          2HB       ASP  57   6.975  -3.711 -13.525
  474   2HB   ASP  57          1HB       ASP  57   7.923  -2.633 -12.506
  475    H    ASP  58           H        ASP  58   6.827  -2.289 -10.374
  476    HA   ASP  58           HA       ASP  58   9.172  -1.919  -8.867
  477   1HB   ASP  58          2HB       ASP  58   7.006  -0.366  -9.424
  478   2HB   ASP  58          1HB       ASP  58   6.701  -0.763  -7.737
  479    H    LEU  59           H        LEU  59   6.046  -3.348  -8.022
  480    HA   LEU  59           HA       LEU  59   6.535  -3.761  -5.291
  481   1HB   LEU  59          2HB       LEU  59   4.335  -3.965  -6.555
  482   2HB   LEU  59          1HB       LEU  59   4.869  -5.562  -7.039
  483    HG   LEU  59           HG       LEU  59   5.090  -6.086  -4.553
  484   1HD1  LEU  59          1HD1      LEU  59   3.196  -3.796  -4.173
  485   2HD1  LEU  59          2HD1      LEU  59   4.937  -3.580  -3.990
  486   3HD1  LEU  59          3HD1      LEU  59   4.078  -4.726  -2.961
  487   1HD2  LEU  59          1HD2      LEU  59   3.260  -6.865  -6.060
  488   2HD2  LEU  59          2HD2      LEU  59   2.311  -5.470  -5.544
  489   3HD2  LEU  59          3HD2      LEU  59   2.784  -6.697  -4.370
  490    H    ASP  60           H        ASP  60   7.235  -5.778  -8.121
  491    HA   ASP  60           HA       ASP  60   8.088  -8.075  -6.745
  492   1HB   ASP  60          2HB       ASP  60   7.782  -7.391  -9.388
  493   2HB   ASP  60          1HB       ASP  60   9.531  -7.521  -9.242
  494    H    LYS  61           H        LYS  61   9.850  -5.191  -7.805
  495    HA   LYS  61           HA       LYS  61  12.432  -6.073  -7.108
  496   1HB   LYS  61          2HB       LYS  61  11.312  -3.269  -7.257
  497   2HB   LYS  61          1HB       LYS  61  13.021  -3.657  -7.118
  498   1HG   LYS  61          2HG       LYS  61  12.441  -5.119  -9.274
  499   2HG   LYS  61          1HG       LYS  61  11.206  -3.871  -9.441
  500   1HD   LYS  61          2HD       LYS  61  13.173  -3.200 -10.657
  501   2HD   LYS  61          1HD       LYS  61  12.982  -2.152  -9.249
  502   1HE   LYS  61          2HE       LYS  61  14.773  -3.107  -8.134
  503   2HE   LYS  61          1HE       LYS  61  14.694  -4.598  -9.072
  504   1HZ   LYS  61          1HZ       LYS  61  15.921  -3.723 -10.736
  505   2HZ   LYS  61          2HZ       LYS  61  16.505  -2.723  -9.504
  506   3HZ   LYS  61          3HZ       LYS  61  15.300  -2.160 -10.549
  507    H    ALA  62           H        ALA  62   9.891  -4.477  -5.248
  508    HA   ALA  62           HA       ALA  62  11.419  -3.843  -2.969
  509   1HB   ALA  62          1HB       ALA  62   9.156  -3.920  -1.793
  510   2HB   ALA  62          2HB       ALA  62   8.479  -4.316  -3.374
  511   3HB   ALA  62          3HB       ALA  62   9.329  -2.788  -3.135
  512    H    ILE  63           H        ILE  63   9.739  -6.791  -3.939
  513    HA   ILE  63           HA       ILE  63   9.851  -8.173  -1.501
  514    HB   ILE  63           HB       ILE  63  10.021  -9.383  -4.268
  515   1HG1  ILE  63          2HG1      ILE  63   7.517  -9.028  -2.626
  516   2HG1  ILE  63          1HG1      ILE  63   8.060  -7.792  -3.754
  517   1HG2  ILE  63          1HG2      ILE  63   8.730 -11.231  -2.917
  518   2HG2  ILE  63          2HG2      ILE  63   9.560 -10.498  -1.544
  519   3HG2  ILE  63          3HG2      ILE  63  10.491 -11.152  -2.891
  520   1HD1  ILE  63          1HD1      ILE  63   8.117 -10.150  -5.219
  521   2HD1  ILE  63          2HD1      ILE  63   6.918  -8.858  -5.317
  522   3HD1  ILE  63          3HD1      ILE  63   6.640 -10.240  -4.258
  523    H    ASP  64           H        ASP  64  12.174  -8.011  -4.180
  524    HA   ASP  64           HA       ASP  64  14.023  -9.889  -3.307
  525   1HB   ASP  64          2HB       ASP  64  14.667  -7.275  -4.694
  526   2HB   ASP  64          1HB       ASP  64  15.665  -8.724  -4.674
  527    H    ILE  65           H        ILE  65  13.694  -6.480  -2.405
  528    HA   ILE  65           HA       ILE  65  16.044  -6.328  -0.845
  529    HB   ILE  65           HB       ILE  65  13.531  -4.698  -0.457
  530   1HG1  ILE  65          2HG1      ILE  65  15.906  -4.128  -2.250
  531   2HG1  ILE  65          1HG1      ILE  65  14.316  -4.637  -2.810
  532   1HG2  ILE  65          1HG2      ILE  65  16.268  -4.593   0.628
  533   2HG2  ILE  65          2HG2      ILE  65  14.749  -4.019   1.315
  534   3HG2  ILE  65          3HG2      ILE  65  15.591  -3.049   0.108
  535   1HD1  ILE  65          1HD1      ILE  65  14.812  -2.115  -1.252
  536   2HD1  ILE  65          2HD1      ILE  65  13.327  -2.602  -2.071
  537   3HD1  ILE  65          3HD1      ILE  65  14.763  -2.201  -3.013
  538    H    LEU  66           H        LEU  66  12.658  -6.999   0.021
  539    HA   LEU  66           HA       LEU  66  13.081  -7.230   2.797
  540   1HB   LEU  66          2HB       LEU  66  10.975  -8.497   1.046
  541   2HB   LEU  66          1HB       LEU  66  10.937  -8.493   2.799
  542    HG   LEU  66           HG       LEU  66  11.218  -5.831   1.575
  543   1HD1  LEU  66          1HD1      LEU  66   9.714  -6.890  -0.041
  544   2HD1  LEU  66          2HD1      LEU  66   8.888  -5.660   0.913
  545   3HD1  LEU  66          3HD1      LEU  66   8.643  -7.369   1.275
  546   1HD2  LEU  66          1HD2      LEU  66   9.843  -5.171   3.354
  547   2HD2  LEU  66          2HD2      LEU  66  10.854  -6.451   4.024
  548   3HD2  LEU  66          3HD2      LEU  66   9.186  -6.795   3.565
  549    H    ASP  67           H        ASP  67  13.258  -9.599   0.177
  550    HA   ASP  67           HA       ASP  67  13.496 -11.930   1.700
  551   1HB   ASP  67          2HB       ASP  67  14.489 -11.162  -1.035
  552   2HB   ASP  67          1HB       ASP  67  14.876 -12.735  -0.346
  553    H    ARG  68           H        ARG  68  15.921  -9.539   0.768
  554    HA   ARG  68           HA       ARG  68  18.215 -10.965   1.550
  555   1HB   ARG  68          2HB       ARG  68  17.763  -7.976   1.539
  556   2HB   ARG  68          1HB       ARG  68  19.329  -8.769   1.631
  557   1HG   ARG  68          2HG       ARG  68  17.532  -9.386  -0.662
  558   2HG   ARG  68          1HG       ARG  68  18.411  -7.856  -0.639
  559   1HD   ARG  68          2HD       ARG  68  20.314  -8.859  -1.210
  560   2HD   ARG  68          1HD       ARG  68  20.142 -10.044   0.085
  561    HE   ARG  68           HE       ARG  68  18.457 -10.600  -2.162
  562   1HH1  ARG  68          1HH1      ARG  68  21.709 -10.969  -0.911
  563   2HH1  ARG  68          2HH1      ARG  68  22.048 -12.370  -1.868
  564   1HH2  ARG  68          1HH2      ARG  68  18.913 -12.445  -3.418
  565   2HH2  ARG  68          2HH2      ARG  68  20.464 -13.207  -3.291
  566    H    SER  69           H        SER  69  15.957  -8.983   3.383
  567    HA   SER  69           HA       SER  69  17.582  -9.166   5.785
  568   1HB   SER  69          2HB       SER  69  16.370  -7.070   5.292
  569   2HB   SER  69          1HB       SER  69  14.841  -7.941   5.395
  570    HG   SER  69           HG       SER  69  16.741  -7.607   7.484
  571    H    SER  70           H        SER  70  17.537 -10.993   6.922
  572    HA   SER  70           HA       SER  70  15.399 -12.883   6.755
  573   1HB   SER  70          2HB       SER  70  17.454 -12.940   8.943
  574   2HB   SER  70          1HB       SER  70  16.715 -14.285   8.077
  575    HG   SER  70           HG       SER  70  17.939 -13.691   6.247
  576    H    SER  71           H        SER  71  16.311 -10.349   9.017
  577    HA   SER  71           HA       SER  71  14.472 -11.138  11.063
  578   1HB   SER  71          2HB       SER  71  15.175  -9.227  12.246
  579   2HB   SER  71          1HB       SER  71  16.601  -9.721  11.339
  580    HG   SER  71           HG       SER  71  16.086  -8.107   9.800
  581    H    MET  72           H        MET  72  14.373  -8.860   8.361
  582    HA   MET  72           HA       MET  72  11.730  -7.921   9.143
  583   1HB   MET  72          2HB       MET  72  13.521  -7.184   6.824
  584   2HB   MET  72          1HB       MET  72  11.938  -6.478   7.109
  585   1HG   MET  72          2HG       MET  72  13.218  -6.142   9.521
  586   2HG   MET  72          1HG       MET  72  14.498  -5.885   8.338
  587   1HE   MET  72          1HE       MET  72  11.172  -4.661   9.853
  588   2HE   MET  72          2HE       MET  72  11.436  -2.929   9.639
  589   3HE   MET  72          3HE       MET  72  12.608  -3.897  10.533
  590    H    LYS  73           H        LYS  73  10.039  -9.143   8.658
  591    HA   LYS  73           HA       LYS  73   9.937 -10.409   6.000
  592   1HB   LYS  73          2HB       LYS  73   8.699 -12.291   6.983
  593   2HB   LYS  73          1HB       LYS  73  10.304 -12.138   7.683
  594   1HG   LYS  73          2HG       LYS  73   8.836 -10.660   9.420
  595   2HG   LYS  73          1HG       LYS  73   7.666 -11.887   8.933
  596   1HD   LYS  73          2HD       LYS  73   9.037 -13.644   9.688
  597   2HD   LYS  73          1HD       LYS  73  10.456 -12.598   9.791
  598   1HE   LYS  73          2HE       LYS  73   9.178 -11.304  11.567
  599   2HE   LYS  73          1HE       LYS  73   8.040 -12.649  11.583
  600   1HZ   LYS  73          1HZ       LYS  73   9.438 -13.368  13.184
  601   2HZ   LYS  73          2HZ       LYS  73  10.772 -12.513  12.588
  602   3HZ   LYS  73          3HZ       LYS  73  10.311 -13.973  11.867
  603    H    SER  74           H        SER  74   8.918  -7.812   6.828
  604    HA   SER  74           HA       SER  74   6.147  -8.204   6.029
  605   1HB   SER  74          2HB       SER  74   5.332  -6.638   7.793
  606   2HB   SER  74          1HB       SER  74   5.954  -8.154   8.443
  607    HG   SER  74           HG       SER  74   7.378  -7.049   9.505
  608    H    LEU  75           H        LEU  75   5.154  -6.310   5.141
  609    HA   LEU  75           HA       LEU  75   7.137  -4.379   4.152
  610   1HB   LEU  75          2HB       LEU  75   4.465  -5.263   3.069
  611   2HB   LEU  75          1HB       LEU  75   5.328  -3.874   2.439
  612    HG   LEU  75           HG       LEU  75   7.288  -5.568   2.102
  613   1HD1  LEU  75          1HD1      LEU  75   4.896  -7.384   2.315
  614   2HD1  LEU  75          2HD1      LEU  75   6.393  -7.459   3.244
  615   3HD1  LEU  75          3HD1      LEU  75   6.405  -7.831   1.521
  616   1HD2  LEU  75          1HD2      LEU  75   4.805  -5.467   0.397
  617   2HD2  LEU  75          2HD2      LEU  75   6.333  -6.178  -0.124
  618   3HD2  LEU  75          3HD2      LEU  75   6.247  -4.460   0.260
  619    H    ARG  76           H        ARG  76   7.160  -2.456   5.107
  620    HA   ARG  76           HA       ARG  76   4.832  -1.520   6.588
  621   1HB   ARG  76          2HB       ARG  76   7.341  -1.439   7.346
  622   2HB   ARG  76          1HB       ARG  76   7.397   0.018   6.363
  623   1HG   ARG  76          2HG       ARG  76   5.704   1.061   7.699
  624   2HG   ARG  76          1HG       ARG  76   5.433  -0.431   8.601
  625   1HD   ARG  76          2HD       ARG  76   8.216   0.424   8.632
  626   2HD   ARG  76          1HD       ARG  76   7.126   1.627   9.318
  627    HE   ARG  76           HE       ARG  76   6.320  -0.619  10.544
  628   1HH1  ARG  76          1HH1      ARG  76   9.505   0.773  10.104
  629   2HH1  ARG  76          2HH1      ARG  76  10.137   0.090  11.563
  630   1HH2  ARG  76          1HH2      ARG  76   7.163  -1.513  12.465
  631   2HH2  ARG  76          2HH2      ARG  76   8.810  -1.207  12.902
  632    H    ILE  77           H        ILE  77   3.380  -0.902   4.995
  633    HA   ILE  77           HA       ILE  77   4.237   1.285   3.216
  634    HB   ILE  77           HB       ILE  77   1.773  -0.428   2.897
  635   1HG1  ILE  77          2HG1      ILE  77   4.321  -0.696   1.302
  636   2HG1  ILE  77          1HG1      ILE  77   4.004  -1.673   2.733
  637   1HG2  ILE  77          1HG2      ILE  77   3.148   1.182   0.772
  638   2HG2  ILE  77          2HG2      ILE  77   1.950   1.905   1.847
  639   3HG2  ILE  77          3HG2      ILE  77   1.499   0.559   0.799
  640   1HD1  ILE  77          1HD1      ILE  77   3.440  -2.580   0.364
  641   2HD1  ILE  77          2HD1      ILE  77   1.989  -1.594   0.542
  642   3HD1  ILE  77          3HD1      ILE  77   2.338  -2.870   1.710
  643    H    LEU  78           H        LEU  78   3.528   3.261   3.675
  644    HA   LEU  78           HA       LEU  78   1.213   3.559   5.467
  645   1HB   LEU  78          2HB       LEU  78   3.412   4.507   6.186
  646   2HB   LEU  78          1HB       LEU  78   3.350   5.585   4.804
  647    HG   LEU  78           HG       LEU  78   0.916   5.973   6.135
  648   1HD1  LEU  78          1HD1      LEU  78   3.042   6.342   8.187
  649   2HD1  LEU  78          2HD1      LEU  78   2.291   4.756   8.010
  650   3HD1  LEU  78          3HD1      LEU  78   1.297   6.164   8.382
  651   1HD2  LEU  78          1HD2      LEU  78   1.542   8.146   6.050
  652   2HD2  LEU  78          2HD2      LEU  78   2.790   7.501   4.986
  653   3HD2  LEU  78          3HD2      LEU  78   3.156   7.825   6.681
  654    H    LEU  79           H        LEU  79  -0.639   4.119   4.530
  655    HA   LEU  79           HA       LEU  79  -0.543   5.647   2.016
  656   1HB   LEU  79          2HB       LEU  79  -2.782   4.764   1.547
  657   2HB   LEU  79          1HB       LEU  79  -1.594   3.490   1.737
  658    HG   LEU  79           HG       LEU  79  -2.558   3.575   4.254
  659   1HD1  LEU  79          1HD1      LEU  79  -4.297   5.020   4.248
  660   2HD1  LEU  79          2HD1      LEU  79  -5.160   3.606   3.647
  661   3HD1  LEU  79          3HD1      LEU  79  -4.591   4.833   2.519
  662   1HD2  LEU  79          1HD2      LEU  79  -2.431   1.731   2.383
  663   2HD2  LEU  79          2HD2      LEU  79  -4.160   2.055   2.259
  664   3HD2  LEU  79          3HD2      LEU  79  -3.469   1.527   3.794
  665    H    LEU  80           H        LEU  80  -1.473   7.600   1.884
  666    HA   LEU  80           HA       LEU  80  -3.004   8.529   4.223
  667   1HB   LEU  80          2HB       LEU  80  -2.135  10.777   3.804
  668   2HB   LEU  80          1HB       LEU  80  -0.853   9.631   4.138
  669    HG   LEU  80           HG       LEU  80  -0.900   9.548   1.421
  670   1HD1  LEU  80          1HD1      LEU  80  -2.018  12.163   2.276
  671   2HD1  LEU  80          2HD1      LEU  80  -2.335  11.213   0.826
  672   3HD1  LEU  80          3HD1      LEU  80  -0.846  12.147   0.957
  673   1HD2  LEU  80          1HD2      LEU  80   1.155   9.764   2.472
  674   2HD2  LEU  80          2HD2      LEU  80   0.656  11.190   3.379
  675   3HD2  LEU  80          3HD2      LEU  80   0.982  11.314   1.649
  676    H    SER  81           H        SER  81  -4.668  10.086   3.842
  677    HA   SER  81           HA       SER  81  -5.969   9.681   1.251
  678   1HB   SER  81          2HB       SER  81  -7.086  10.868   3.804
  679   2HB   SER  81          1HB       SER  81  -8.003  10.457   2.358
  680    HG   SER  81           HG       SER  81  -6.478   8.431   3.528
  681    H    GLN  82           H        GLN  82  -6.364  11.304  -0.166
  682    HA   GLN  82           HA       GLN  82  -5.134  13.871   0.385
  683   1HB   GLN  82          2HB       GLN  82  -5.543  14.349  -2.025
  684   2HB   GLN  82          1HB       GLN  82  -4.560  12.921  -1.743
  685   1HG   GLN  82          2HG       GLN  82  -7.244  12.064  -1.866
  686   2HG   GLN  82          1HG       GLN  82  -6.986  13.177  -3.210
  687   1HE2  GLN  82          1HE2      GLN  82  -6.050  10.152  -1.766
  688   2HE2  GLN  82          2HE2      GLN  82  -5.207   9.527  -3.137
  689    H    ASP  83           H        ASP  83  -7.953  12.705   1.160
  690    HA   ASP  83           HA       ASP  83  -9.956  13.556   1.758
  691   1HB   ASP  83          2HB       ASP  83  -8.248  15.515   2.359
  692   2HB   ASP  83          1HB       ASP  83  -9.160  16.354   1.108
  693    H    ARG  84           H        ARG  84  -9.672  12.657  -0.874
  694    HA   ARG  84           HA       ARG  84 -10.851  12.556  -2.808
  695   1HB   ARG  84          2HB       ARG  84 -12.540  14.757  -1.611
  696   2HB   ARG  84          1HB       ARG  84 -12.951  13.801  -3.026
  697   1HG   ARG  84          2HG       ARG  84 -12.417  11.943  -1.002
  698   2HG   ARG  84          1HG       ARG  84 -13.366  13.222  -0.241
  699   1HD   ARG  84          2HD       ARG  84 -14.791  11.450  -1.157
  700   2HD   ARG  84          1HD       ARG  84 -15.078  12.998  -1.949
  701    HE   ARG  84           HE       ARG  84 -13.177  11.559  -3.432
  702   1HH1  ARG  84          1HH1      ARG  84 -16.579  11.425  -2.621
  703   2HH1  ARG  84          2HH1      ARG  84 -17.025  10.629  -4.093
  704   1HH2  ARG  84          1HH2      ARG  84 -13.774  10.514  -5.376
  705   2HH2  ARG  84          2HH2      ARG  84 -15.435  10.113  -5.654
  706    H    ASN  85           H        ASN  85 -10.230  13.250  -4.739
  707    HA   ASN  85           HA       ASN  85  -8.699  15.632  -5.017
  708   1HB   ASN  85          2HB       ASN  85  -8.577  13.371  -6.346
  709   2HB   ASN  85          1HB       ASN  85  -9.781  14.132  -7.379
  710   1HD2  ASN  85          1HD2      ASN  85  -9.203  15.917  -8.624
  711   2HD2  ASN  85          2HD2      ASN  85  -7.554  16.347  -8.901
  712    H    LEU  86           H        LEU  86  -9.981  17.383  -4.513
  713    HA   LEU  86           HA       LEU  86 -12.532  17.865  -5.686
  714   1HB   LEU  86          2HB       LEU  86 -11.336  18.825  -3.519
  715   2HB   LEU  86          1HB       LEU  86 -10.858  20.093  -4.629
  716    HG   LEU  86           HG       LEU  86 -12.838  20.771  -3.440
  717   1HD1  LEU  86          1HD1      LEU  86 -12.553  21.274  -5.913
  718   2HD1  LEU  86          2HD1      LEU  86 -14.172  21.458  -5.241
  719   3HD1  LEU  86          3HD1      LEU  86 -13.771  20.031  -6.194
  720   1HD2  LEU  86          1HD2      LEU  86 -13.709  18.034  -4.059
  721   2HD2  LEU  86          2HD2      LEU  86 -14.953  19.273  -4.228
  722   3HD2  LEU  86          3HD2      LEU  86 -14.106  19.075  -2.693
  723    H    GLU  87           H        GLU  87 -12.993  18.614  -7.649
  724    HA   GLU  87           HA       GLU  87 -10.991  19.254  -9.546
  725   1HB   GLU  87          2HB       GLU  87 -13.992  19.556  -9.583
  726   2HB   GLU  87          1HB       GLU  87 -12.979  19.978 -10.957
  727   1HG   GLU  87          2HG       GLU  87 -12.080  17.580 -10.772
  728   2HG   GLU  87          1HG       GLU  87 -13.491  17.283  -9.759
  729    H    HIS  88           H        HIS  88 -10.275  21.185 -10.355
  730    HA   HIS  88           HA       HIS  88 -10.893  23.557  -8.763
  731   1HB   HIS  88          2HB       HIS  88  -8.600  22.659 -10.412
  732   2HB   HIS  88          1HB       HIS  88  -8.929  24.389 -10.423
  733    HD1  HIS  88           HD1      HIS  88  -7.172  25.330  -8.934
  734    HD2  HIS  88           HD2      HIS  88  -9.003  21.988  -7.273
  735    HE1  HIS  88           HE1      HIS  88  -6.233  25.133  -6.610
  736    HE2  HIS  88           HE2      HIS  88  -7.409  23.150  -5.598
  737    H    HIS  89           H        HIS  89 -11.821  25.380  -9.558
  738    HA   HIS  89           HA       HIS  89 -13.112  25.172 -12.159
  739   1HB   HIS  89          2HB       HIS  89 -13.834  26.289  -9.671
  740   2HB   HIS  89          1HB       HIS  89 -13.661  27.646 -10.777
  741    HD1  HIS  89           HD1      HIS  89 -16.176  25.542  -9.569
  742    HD2  HIS  89           HD2      HIS  89 -15.155  26.853 -13.378
  743    HE1  HIS  89           HE1      HIS  89 -18.253  25.254 -10.960
  744    HE2  HIS  89           HE2      HIS  89 -17.632  26.125 -13.242
  745    H    HIS  90           H        HIS  90 -13.384  27.692 -13.053
  746    HA   HIS  90           HA       HIS  90 -10.648  28.398 -13.805
  747   1HB   HIS  90          2HB       HIS  90 -12.467  27.914 -15.526
  748   2HB   HIS  90          1HB       HIS  90 -13.186  29.450 -15.052
  749    HD1  HIS  90           HD1      HIS  90  -9.580  28.495 -15.870
  750    HD2  HIS  90           HD2      HIS  90 -12.510  31.233 -16.964
  751    HE1  HIS  90           HE1      HIS  90  -8.494  30.004 -17.562
  752    HE2  HIS  90           HE2      HIS  90 -10.311  31.596 -18.275
  753    H    HIS  91           H        HIS  91  -9.818  30.463 -13.644
  754    HA   HIS  91           HA       HIS  91  -9.522  32.583 -12.883
  755   1HB   HIS  91          2HB       HIS  91 -11.961  32.819 -13.797
  756   2HB   HIS  91          1HB       HIS  91 -12.408  32.820 -12.097
  757    HD1  HIS  91           HD1      HIS  91 -12.986  35.307 -13.706
  758    HD2  HIS  91           HD2      HIS  91  -9.413  34.716 -11.667
  759    HE1  HIS  91           HE1      HIS  91 -12.040  37.605 -13.324
  760    HE2  HIS  91           HE2      HIS  91  -9.825  37.213 -12.193
  761    H    HIS  92           H        HIS  92 -12.115  31.299 -10.771
  762    HA   HIS  92           HA       HIS  92 -10.332  30.842  -8.586
  763   1HB   HIS  92          2HB       HIS  92 -11.425  32.517  -7.046
  764   2HB   HIS  92          1HB       HIS  92 -10.382  33.214  -8.279
  765    HD1  HIS  92           HD1      HIS  92 -11.385  35.363  -8.949
  766    HD2  HIS  92           HD2      HIS  92 -14.264  32.407  -8.450
  767    HE1  HIS  92           HE1      HIS  92 -13.569  36.440  -9.575
  768    HE2  HIS  92           HE2      HIS  92 -15.308  34.659  -9.178
  769    H    HIS  93           H        HIS  93 -11.701  30.420  -6.501
  770    HA   HIS  93           HA       HIS  93 -14.401  29.523  -7.000
  771   1HB   HIS  93          2HB       HIS  93 -13.847  27.172  -6.179
  772   2HB   HIS  93          1HB       HIS  93 -13.382  27.564  -7.828
  773    HD1  HIS  93           HD1      HIS  93 -11.165  28.821  -5.115
  774    HD2  HIS  93           HD2      HIS  93 -11.405  25.541  -7.651
  775    HE1  HIS  93           HE1      HIS  93  -8.932  27.685  -4.955
  776    HE2  HIS  93           HE2      HIS  93  -9.154  25.625  -6.388
  Start of MODEL   18
    1    H    GLN   1           H        GLN   1   8.220 -21.713   3.958
    2    HA   GLN   1           HA       GLN   1   8.477 -19.696   2.507
    3   1HB   GLN   1          2HB       GLN   1   8.323 -22.547   1.539
    4   2HB   GLN   1          1HB       GLN   1   8.901 -21.255   0.496
    5   1HG   GLN   1          2HG       GLN   1  10.729 -20.795   1.930
    6   2HG   GLN   1          1HG       GLN   1  10.082 -21.844   3.192
    7   1HE2  GLN   1          1HE2      GLN   1  11.996 -23.044   3.234
    8   2HE2  GLN   1          2HE2      GLN   1  12.386 -24.176   1.989
    9    H    SER   2           H        SER   2   5.718 -19.481   2.966
   10    HA   SER   2           HA       SER   2   4.826 -18.781   0.308
   11   1HB   SER   2          2HB       SER   2   2.516 -19.942   1.061
   12   2HB   SER   2          1HB       SER   2   3.732 -20.779   0.098
   13    HG   SER   2           HG       SER   2   3.335 -20.950   2.905
   14    H    ASP   3           H        ASP   3   2.847 -17.453   0.373
   15    HA   ASP   3           HA       ASP   3   1.515 -15.808   1.209
   16   1HB   ASP   3          2HB       ASP   3   1.242 -17.614   3.117
   17   2HB   ASP   3          1HB       ASP   3   2.200 -16.467   4.048
   18    H    VAL   4           H        VAL   4   1.686 -13.673   1.990
   19    HA   VAL   4           HA       VAL   4   4.386 -12.862   2.839
   20    HB   VAL   4           HB       VAL   4   2.668 -11.266   0.939
   21   1HG1  VAL   4          1HG1      VAL   4   4.205  -9.932   2.228
   22   2HG1  VAL   4          2HG1      VAL   4   4.779 -10.036   0.564
   23   3HG1  VAL   4          3HG1      VAL   4   5.538 -11.012   1.823
   24   1HG2  VAL   4          1HG2      VAL   4   4.668 -11.982  -0.643
   25   2HG2  VAL   4          2HG2      VAL   4   3.215 -12.969  -0.483
   26   3HG2  VAL   4          3HG2      VAL   4   4.674 -13.396   0.411
   27    H    ARG   5           H        ARG   5   4.500 -11.346   4.418
   28    HA   ARG   5           HA       ARG   5   1.972 -10.530   5.649
   29   1HB   ARG   5          2HB       ARG   5   4.679 -11.100   6.631
   30   2HB   ARG   5          1HB       ARG   5   3.970  -9.649   7.327
   31   1HG   ARG   5          2HG       ARG   5   2.908 -10.940   8.769
   32   2HG   ARG   5          1HG       ARG   5   1.948 -11.570   7.429
   33   1HD   ARG   5          2HD       ARG   5   3.117 -13.510   7.324
   34   2HD   ARG   5          1HD       ARG   5   4.636 -12.740   7.782
   35    HE   ARG   5           HE       ARG   5   2.736 -12.874   9.928
   36   1HH1  ARG   5          1HH1      ARG   5   5.248 -14.635   8.237
   37   2HH1  ARG   5          2HH1      ARG   5   5.624 -15.643   9.593
   38   1HH2  ARG   5          1HH2      ARG   5   3.234 -14.203  11.709
   39   2HH2  ARG   5          2HH2      ARG   5   4.479 -15.398  11.566
   40    H    ILE   6           H        ILE   6   1.190  -8.592   5.137
   41    HA   ILE   6           HA       ILE   6   3.095  -6.427   4.510
   42    HB   ILE   6           HB       ILE   6   0.259  -6.655   3.489
   43   1HG1  ILE   6          2HG1      ILE   6   1.607  -6.973   1.253
   44   2HG1  ILE   6          1HG1      ILE   6   2.873  -7.558   2.328
   45   1HG2  ILE   6          1HG2      ILE   6   0.651  -4.435   3.277
   46   2HG2  ILE   6          2HG2      ILE   6   1.459  -4.965   1.803
   47   3HG2  ILE   6          3HG2      ILE   6   2.402  -4.630   3.254
   48   1HD1  ILE   6          1HD1      ILE   6   0.763  -9.014   1.268
   49   2HD1  ILE   6          2HD1      ILE   6   0.340  -8.770   2.964
   50   3HD1  ILE   6          3HD1      ILE   6   1.877  -9.520   2.536
   51    H    LYS   7           H        LYS   7   3.002  -4.619   5.698
   52    HA   LYS   7           HA       LYS   7   0.823  -4.382   7.660
   53   1HB   LYS   7          2HB       LYS   7   3.201  -4.586   8.484
   54   2HB   LYS   7          1HB       LYS   7   3.516  -3.017   7.758
   55   1HG   LYS   7          2HG       LYS   7   2.444  -1.897   9.385
   56   2HG   LYS   7          1HG       LYS   7   1.189  -3.126   9.554
   57   1HD   LYS   7          2HD       LYS   7   3.004  -4.566  10.645
   58   2HD   LYS   7          1HD       LYS   7   3.943  -3.075  10.756
   59   1HE   LYS   7          2HE       LYS   7   2.195  -2.032  12.065
   60   2HE   LYS   7          1HE       LYS   7   1.171  -3.456  11.883
   61   1HZ   LYS   7          1HZ       LYS   7   2.222  -3.487  14.025
   62   2HZ   LYS   7          2HZ       LYS   7   3.758  -3.320  13.335
   63   3HZ   LYS   7          3HZ       LYS   7   2.869  -4.738  13.087
   64    H    PHE   8           H        PHE   8  -0.548  -2.735   7.563
   65    HA   PHE   8           HA       PHE   8   0.053  -0.514   5.716
   66   1HB   PHE   8          2HB       PHE   8  -2.567  -1.839   6.427
   67   2HB   PHE   8          1HB       PHE   8  -2.479  -0.290   5.597
   68    HD1  PHE   8           HD2      PHE   8  -1.582  -0.149   3.320
   69    HD2  PHE   8           HD1      PHE   8  -2.069  -3.885   5.298
   70    HE1  PHE   8           HE2      PHE   8  -1.377  -1.312   1.164
   71    HE2  PHE   8           HE1      PHE   8  -1.863  -5.057   3.145
   72    HZ   PHE   8           HZ       PHE   8  -1.517  -3.770   1.074
   73    H    GLU   9           H        GLU   9  -0.048   1.540   6.461
   74    HA   GLU   9           HA       GLU   9  -1.001   1.929   9.224
   75   1HB   GLU   9          2HB       GLU   9   1.572   2.228   8.411
   76   2HB   GLU   9          1HB       GLU   9   0.965   3.859   8.161
   77   1HG   GLU   9          2HG       GLU   9   0.602   4.220  10.392
   78   2HG   GLU   9          1HG       GLU   9   0.403   2.506  10.750
   79    H    HIS  10           H        HIS  10  -2.653   3.266   9.447
   80    HA   HIS  10           HA       HIS  10  -3.029   5.438   7.508
   81   1HB   HIS  10          2HB       HIS  10  -4.515   3.415   7.027
   82   2HB   HIS  10          1HB       HIS  10  -5.336   3.788   8.539
   83    HD1  HIS  10           HD1      HIS  10  -7.551   4.471   7.531
   84    HD2  HIS  10           HD2      HIS  10  -4.335   6.589   5.970
   85    HE1  HIS  10           HE1      HIS  10  -8.565   6.325   6.170
   86    HE2  HIS  10           HE2      HIS  10  -6.599   7.686   5.375
   87    H    ASN  11           H        ASN  11  -2.982   7.284   8.597
   88    HA   ASN  11           HA       ASN  11  -3.225   8.859  10.217
   89   1HB   ASN  11          2HB       ASN  11  -5.707   7.407  10.105
   90   2HB   ASN  11          1HB       ASN  11  -5.401   7.926  11.760
   91   1HD2  ASN  11          1HD2      ASN  11  -6.878   8.797   9.000
   92   2HD2  ASN  11          2HD2      ASN  11  -6.848  10.516   9.169
   93    H    GLY  12           H        GLY  12  -1.496   6.585  10.776
   94   1HA   GLY  12          2HA       GLY  12  -0.082   6.341  12.661
   95   2HA   GLY  12          1HA       GLY  12  -1.405   6.866  13.693
   96    H    GLU  13           H        GLU  13  -3.373   5.059  12.545
   97    HA   GLU  13           HA       GLU  13  -2.945   2.808  14.195
   98   1HB   GLU  13          2HB       GLU  13  -4.911   3.056  11.909
   99   2HB   GLU  13          1HB       GLU  13  -5.008   1.938  13.263
  100   1HG   GLU  13          2HG       GLU  13  -4.875   4.362  14.522
  101   2HG   GLU  13          1HG       GLU  13  -5.807   4.736  13.074
  102    H    ARG  14           H        ARG  14  -2.183   0.796  13.791
  103    HA   ARG  14           HA       ARG  14  -1.072   0.316  11.109
  104   1HB   ARG  14          2HB       ARG  14  -0.208  -0.554  13.852
  105   2HB   ARG  14          1HB       ARG  14   0.313  -1.437  12.424
  106   1HG   ARG  14          2HG       ARG  14   1.467   0.445  11.566
  107   2HG   ARG  14          1HG       ARG  14   0.737   1.518  12.764
  108   1HD   ARG  14          2HD       ARG  14   2.385  -0.812  13.651
  109   2HD   ARG  14          1HD       ARG  14   3.178   0.659  13.092
  110    HE   ARG  14           HE       ARG  14   1.745   0.283  15.561
  111   1HH1  ARG  14          1HH1      ARG  14   2.867   2.637  13.227
  112   2HH1  ARG  14          2HH1      ARG  14   2.882   3.943  14.363
  113   1HH2  ARG  14          1HH2      ARG  14   1.757   2.009  17.059
  114   2HH2  ARG  14          2HH2      ARG  14   2.253   3.587  16.541
  115    H    ARG  15           H        ARG  15  -1.546  -1.515   9.991
  116    HA   ARG  15           HA       ARG  15  -3.277  -3.520  11.272
  117   1HB   ARG  15          2HB       ARG  15  -3.902  -1.763   9.009
  118   2HB   ARG  15          1HB       ARG  15  -4.168  -3.466   8.663
  119   1HG   ARG  15          2HG       ARG  15  -5.529  -3.566  10.783
  120   2HG   ARG  15          1HG       ARG  15  -5.427  -1.804  10.827
  121   1HD   ARG  15          2HD       ARG  15  -6.942  -1.563   9.190
  122   2HD   ARG  15          1HD       ARG  15  -6.243  -2.863   8.228
  123    HE   ARG  15           HE       ARG  15  -8.510  -3.035   9.934
  124   1HH1  ARG  15          1HH1      ARG  15  -5.765  -4.879   8.784
  125   2HH1  ARG  15          2HH1      ARG  15  -6.548  -6.410   8.986
  126   1HH2  ARG  15          1HH2      ARG  15  -9.544  -5.058  10.195
  127   2HH2  ARG  15          2HH2      ARG  15  -8.696  -6.512   9.785
  128    H    ILE  16           H        ILE  16  -2.600  -5.547  10.957
  129    HA   ILE  16           HA       ILE  16  -0.592  -6.033   8.855
  130    HB   ILE  16           HB       ILE  16  -1.047  -7.709  11.325
  131   1HG1  ILE  16          2HG1      ILE  16   1.356  -6.525  11.747
  132   2HG1  ILE  16          1HG1      ILE  16   0.509  -5.225  10.916
  133   1HG2  ILE  16          1HG2      ILE  16   0.005  -8.897   9.489
  134   2HG2  ILE  16          2HG2      ILE  16   1.170  -8.620  10.785
  135   3HG2  ILE  16          3HG2      ILE  16   1.215  -7.624   9.331
  136   1HD1  ILE  16          1HD1      ILE  16   0.330  -6.011  13.630
  137   2HD1  ILE  16          2HD1      ILE  16  -1.240  -6.282  12.873
  138   3HD1  ILE  16          3HD1      ILE  16  -0.493  -4.685  12.807
  139    H    ILE  17           H        ILE  17  -1.171  -7.290   7.197
  140    HA   ILE  17           HA       ILE  17  -3.195  -9.368   7.626
  141    HB   ILE  17           HB       ILE  17  -3.262  -7.559   5.211
  142   1HG1  ILE  17          2HG1      ILE  17  -5.167  -7.562   7.561
  143   2HG1  ILE  17          1HG1      ILE  17  -3.871  -6.390   7.360
  144   1HG2  ILE  17          1HG2      ILE  17  -4.337  -9.398   4.447
  145   2HG2  ILE  17          2HG2      ILE  17  -5.690  -8.708   5.343
  146   3HG2  ILE  17          3HG2      ILE  17  -4.712  -9.985   6.067
  147   1HD1  ILE  17          1HD1      ILE  17  -6.053  -5.535   6.646
  148   2HD1  ILE  17          2HD1      ILE  17  -6.137  -6.806   5.426
  149   3HD1  ILE  17          3HD1      ILE  17  -4.880  -5.571   5.329
  150    H    ALA  18           H        ALA  18  -2.712 -11.254   6.717
  151    HA   ALA  18           HA       ALA  18  -0.262 -11.457   5.155
  152   1HB   ALA  18          1HB       ALA  18  -2.005 -13.533   6.475
  153   2HB   ALA  18          2HB       ALA  18  -0.436 -12.945   7.026
  154   3HB   ALA  18          3HB       ALA  18  -0.551 -13.904   5.554
  155    H    PHE  19           H        PHE  19  -0.170 -12.006   3.042
  156    HA   PHE  19           HA       PHE  19  -2.712 -12.629   1.677
  157   1HB   PHE  19          2HB       PHE  19  -0.445 -10.835   0.943
  158   2HB   PHE  19          1HB       PHE  19  -1.256 -11.701  -0.356
  159    HD1  PHE  19           HD2      PHE  19  -3.863 -11.531  -0.365
  160    HD2  PHE  19           HD1      PHE  19  -1.279  -8.800   1.629
  161    HE1  PHE  19           HE2      PHE  19  -5.640  -9.831  -0.398
  162    HE2  PHE  19           HE1      PHE  19  -3.051  -7.096   1.601
  163    HZ   PHE  19           HZ       PHE  19  -5.235  -7.609   0.585
  164    H    SER  20           H        SER  20  -2.819 -14.629   0.904
  165    HA   SER  20           HA       SER  20  -0.514 -16.323   0.760
  166   1HB   SER  20          2HB       SER  20  -2.091 -18.052   0.025
  167   2HB   SER  20          1HB       SER  20  -2.729 -17.186   1.422
  168    HG   SER  20           HG       SER  20  -4.328 -17.420  -0.167
  169    H    ARG  21           H        ARG  21   0.732 -16.808  -0.950
  170    HA   ARG  21           HA       ARG  21   0.463 -15.304  -3.367
  171   1HB   ARG  21          2HB       ARG  21   2.436 -17.147  -2.185
  172   2HB   ARG  21          1HB       ARG  21   2.379 -17.152  -3.943
  173   1HG   ARG  21          2HG       ARG  21   2.823 -14.799  -4.024
  174   2HG   ARG  21          1HG       ARG  21   2.695 -14.672  -2.269
  175   1HD   ARG  21          2HD       ARG  21   4.639 -16.645  -3.260
  176   2HD   ARG  21          1HD       ARG  21   5.025 -14.962  -3.613
  177    HE   ARG  21           HE       ARG  21   4.374 -14.973  -0.961
  178   1HH1  ARG  21          1HH1      ARG  21   6.690 -16.716  -2.921
  179   2HH1  ARG  21          2HH1      ARG  21   7.847 -16.866  -1.640
  180   1HH2  ARG  21          1HH2      ARG  21   5.901 -15.174   0.728
  181   2HH2  ARG  21          2HH2      ARG  21   7.401 -15.988   0.429
  182    HA   PRO  22           HA       PRO  22   1.346 -15.568  -5.493
  183   1HB   PRO  22          2HB       PRO  22   0.151 -15.139  -7.865
  184   2HB   PRO  22          1HB       PRO  22   1.247 -16.501  -7.603
  185   1HG   PRO  22          2HG       PRO  22  -1.745 -16.453  -7.622
  186   2HG   PRO  22          1HG       PRO  22  -0.642 -17.641  -8.337
  187   1HD   PRO  22          2HD       PRO  22  -1.918 -17.998  -5.943
  188   2HD   PRO  22          1HD       PRO  22  -0.370 -18.759  -6.357
  189    H    VAL  23           H        VAL  23   0.943 -13.301  -6.120
  190    HA   VAL  23           HA       VAL  23  -1.727 -12.250  -5.701
  191    HB   VAL  23           HB       VAL  23  -0.861 -12.443  -3.406
  192   1HG1  VAL  23          1HG1      VAL  23   1.491 -11.176  -4.614
  193   2HG1  VAL  23          2HG1      VAL  23   1.362 -12.227  -3.204
  194   3HG1  VAL  23          3HG1      VAL  23   1.012 -10.506  -3.055
  195   1HG2  VAL  23          1HG2      VAL  23  -1.371 -10.213  -2.684
  196   2HG2  VAL  23          2HG2      VAL  23  -2.391 -10.596  -4.070
  197   3HG2  VAL  23          3HG2      VAL  23  -0.980  -9.559  -4.274
  198    H    LYS  24           H        LYS  24  -1.951 -10.027  -6.326
  199    HA   LYS  24           HA       LYS  24   0.363  -8.864  -7.718
  200   1HB   LYS  24          2HB       LYS  24  -1.276  -8.152  -9.539
  201   2HB   LYS  24          1HB       LYS  24  -0.810  -9.846  -9.508
  202   1HG   LYS  24          2HG       LYS  24  -3.260  -9.075  -8.024
  203   2HG   LYS  24          1HG       LYS  24  -3.329  -9.074  -9.789
  204   1HD   LYS  24          2HD       LYS  24  -2.028 -11.445  -8.704
  205   2HD   LYS  24          1HD       LYS  24  -3.693 -11.261  -8.148
  206   1HE   LYS  24          2HE       LYS  24  -3.124 -10.852 -11.038
  207   2HE   LYS  24          1HE       LYS  24  -3.092 -12.499 -10.414
  208   1HZ   LYS  24          1HZ       LYS  24  -5.370 -11.683  -9.365
  209   2HZ   LYS  24          2HZ       LYS  24  -5.280 -12.350 -10.916
  210   3HZ   LYS  24          3HZ       LYS  24  -5.345 -10.672 -10.724
  211    H    TYR  25           H        TYR  25   0.031  -6.542  -8.292
  212    HA   TYR  25           HA       TYR  25  -0.637  -5.010  -6.059
  213   1HB   TYR  25          2HB       TYR  25   0.829  -4.349  -8.050
  214   2HB   TYR  25          1HB       TYR  25  -0.667  -3.936  -8.879
  215    HD1  TYR  25           HD2      TYR  25  -2.256  -2.293  -7.545
  216    HD2  TYR  25           HD1      TYR  25   1.922  -2.699  -6.847
  217    HE1  TYR  25           HE2      TYR  25  -2.218  -0.070  -6.501
  218    HE2  TYR  25           HE1      TYR  25   1.967  -0.475  -5.802
  219    HH   TYR  25           HH       TYR  25  -0.151   1.784  -6.180
  220    H    GLU  26           H        GLU  26  -2.526  -5.648  -9.004
  221    HA   GLU  26           HA       GLU  26  -4.691  -3.969  -8.471
  222   1HB   GLU  26          2HB       GLU  26  -4.219  -6.346 -10.170
  223   2HB   GLU  26          1HB       GLU  26  -5.899  -5.999  -9.791
  224   1HG   GLU  26          2HG       GLU  26  -5.682  -4.799 -11.702
  225   2HG   GLU  26          1HG       GLU  26  -5.213  -3.567 -10.528
  226    H    ASP  27           H        ASP  27  -4.183  -7.366  -7.551
  227    HA   ASP  27           HA       ASP  27  -6.707  -7.692  -6.317
  228   1HB   ASP  27          2HB       ASP  27  -4.917  -9.466  -7.069
  229   2HB   ASP  27          1HB       ASP  27  -4.330  -9.277  -5.420
  230    H    VAL  28           H        VAL  28  -3.506  -6.858  -5.009
  231    HA   VAL  28           HA       VAL  28  -4.345  -6.790  -2.299
  232    HB   VAL  28           HB       VAL  28  -2.005  -5.312  -3.519
  233   1HG1  VAL  28          1HG1      VAL  28  -1.301  -4.815  -1.440
  234   2HG1  VAL  28          2HG1      VAL  28  -1.854  -6.351  -0.772
  235   3HG1  VAL  28          3HG1      VAL  28  -2.998  -5.031  -1.012
  236   1HG2  VAL  28          1HG2      VAL  28  -0.782  -7.204  -3.559
  237   2HG2  VAL  28          2HG2      VAL  28  -2.355  -7.993  -3.662
  238   3HG2  VAL  28          3HG2      VAL  28  -1.541  -7.851  -2.105
  239    H    GLU  29           H        GLU  29  -3.896  -4.238  -4.738
  240    HA   GLU  29           HA       GLU  29  -4.599  -2.080  -3.073
  241   1HB   GLU  29          2HB       GLU  29  -3.488  -2.106  -5.433
  242   2HB   GLU  29          1HB       GLU  29  -5.145  -2.058  -6.023
  243   1HG   GLU  29          2HG       GLU  29  -5.240  -0.058  -4.234
  244   2HG   GLU  29          1HG       GLU  29  -3.540   0.023  -4.690
  245    H    HIS  30           H        HIS  30  -6.566  -4.137  -5.205
  246    HA   HIS  30           HA       HIS  30  -8.963  -2.716  -5.054
  247   1HB   HIS  30          2HB       HIS  30  -8.185  -5.485  -5.709
  248   2HB   HIS  30          1HB       HIS  30  -9.847  -5.293  -5.163
  249    HD1  HIS  30           HD1      HIS  30  -7.517  -3.813  -7.781
  250    HD2  HIS  30           HD2      HIS  30 -11.559  -4.525  -7.121
  251    HE1  HIS  30           HE1      HIS  30  -8.671  -3.180  -9.924
  252    HE2  HIS  30           HE2      HIS  30 -11.124  -3.544  -9.473
  253    H    LYS  31           H        LYS  31  -7.618  -5.135  -2.843
  254    HA   LYS  31           HA       LYS  31  -9.900  -5.272  -1.156
  255   1HB   LYS  31          2HB       LYS  31  -8.035  -6.985  -1.332
  256   2HB   LYS  31          1HB       LYS  31  -7.057  -5.896  -0.357
  257   1HG   LYS  31          2HG       LYS  31  -7.872  -6.983   1.403
  258   2HG   LYS  31          1HG       LYS  31  -9.375  -6.108   1.104
  259   1HD   LYS  31          2HD       LYS  31 -10.430  -7.936   0.283
  260   2HD   LYS  31          1HD       LYS  31  -8.973  -8.556  -0.495
  261   1HE   LYS  31          2HE       LYS  31  -9.322  -8.597   2.489
  262   2HE   LYS  31          1HE       LYS  31  -9.938  -9.892   1.464
  263   1HZ   LYS  31          1HZ       LYS  31  -7.899 -10.721   1.176
  264   2HZ   LYS  31          2HZ       LYS  31  -7.440  -9.771   2.497
  265   3HZ   LYS  31          3HZ       LYS  31  -7.194  -9.203   0.924
  266    H    VAL  32           H        VAL  32  -6.791  -3.535  -0.858
  267    HA   VAL  32           HA       VAL  32  -7.410  -2.300   1.611
  268    HB   VAL  32           HB       VAL  32  -5.499  -1.292  -0.501
  269   1HG1  VAL  32          1HG1      VAL  32  -6.120   0.335   1.277
  270   2HG1  VAL  32          2HG1      VAL  32  -4.410  -0.097   1.278
  271   3HG1  VAL  32          3HG1      VAL  32  -5.498  -0.800   2.476
  272   1HG2  VAL  32          1HG2      VAL  32  -3.774  -2.529   0.651
  273   2HG2  VAL  32          2HG2      VAL  32  -5.061  -3.631   0.167
  274   3HG2  VAL  32          3HG2      VAL  32  -4.937  -3.105   1.843
  275    H    THR  33           H        THR  33  -7.793  -1.199  -1.743
  276    HA   THR  33           HA       THR  33  -8.607   1.419  -1.188
  277    HB   THR  33           HB       THR  33  -9.350  -0.387  -3.500
  278    HG1  THR  33           HG1      THR  33  -7.567   0.333  -4.403
  279   1HG2  THR  33          1HG2      THR  33  -9.661   1.802  -4.719
  280   2HG2  THR  33          2HG2      THR  33  -9.772   2.558  -3.130
  281   3HG2  THR  33          3HG2      THR  33 -10.947   1.331  -3.607
  282    H    THR  34           H        THR  34 -10.476  -1.598  -1.339
  283    HA   THR  34           HA       THR  34 -13.008  -0.311  -1.008
  284    HB   THR  34           HB       THR  34 -12.288  -3.191  -0.436
  285    HG1  THR  34           HG1      THR  34 -11.837  -2.996  -2.532
  286   1HG2  THR  34          1HG2      THR  34 -14.891  -2.848  -1.527
  287   2HG2  THR  34          2HG2      THR  34 -14.726  -1.822  -0.102
  288   3HG2  THR  34          3HG2      THR  34 -14.416  -3.553   0.018
  289    H    VAL  35           H        VAL  35 -10.591  -1.584   1.210
  290    HA   VAL  35           HA       VAL  35 -12.232  -1.643   3.515
  291    HB   VAL  35           HB       VAL  35  -9.232  -1.283   3.389
  292   1HG1  VAL  35          1HG1      VAL  35  -9.656  -2.560   5.702
  293   2HG1  VAL  35          2HG1      VAL  35 -11.156  -1.635   5.610
  294   3HG1  VAL  35          3HG1      VAL  35  -9.601  -0.802   5.573
  295   1HG2  VAL  35          1HG2      VAL  35 -10.143  -3.900   4.181
  296   2HG2  VAL  35          2HG2      VAL  35  -9.032  -3.441   2.890
  297   3HG2  VAL  35          3HG2      VAL  35 -10.769  -3.475   2.587
  298    H    PHE  36           H        PHE  36  -9.736   0.757   2.564
  299    HA   PHE  36           HA       PHE  36 -10.911   2.647   4.457
  300   1HB   PHE  36          2HB       PHE  36  -8.364   2.842   2.846
  301   2HB   PHE  36          1HB       PHE  36  -8.894   3.997   4.062
  302    HD1  PHE  36           HD1      PHE  36  -9.698   2.526   6.320
  303    HD2  PHE  36           HD2      PHE  36  -6.581   1.610   3.569
  304    HE1  PHE  36           HE1      PHE  36  -8.554   1.216   8.058
  305    HE2  PHE  36           HE2      PHE  36  -5.433   0.299   5.303
  306    HZ   PHE  36           HZ       PHE  36  -6.419   0.100   7.548
  307    H    GLY  37           H        GLY  37 -11.703   1.925   1.396
  308   1HA   GLY  37          2HA       GLY  37 -13.032   3.132  -0.063
  309   2HA   GLY  37          1HA       GLY  37 -12.766   4.562   0.921
  310    H    GLN  38           H        GLN  38 -12.729   5.292  -1.484
  311    HA   GLN  38           HA       GLN  38  -9.902   5.453  -2.284
  312   1HB   GLN  38          2HB       GLN  38 -10.697   5.517  -4.681
  313   2HB   GLN  38          1HB       GLN  38 -10.833   3.959  -3.882
  314   1HG   GLN  38          2HG       GLN  38 -13.013   3.880  -4.262
  315   2HG   GLN  38          1HG       GLN  38 -13.257   5.474  -3.553
  316   1HE2  GLN  38          1HE2      GLN  38 -13.557   3.698  -6.321
  317   2HE2  GLN  38          2HE2      GLN  38 -13.610   4.981  -7.474
  318    HA   PRO  39           HA       PRO  39  -9.009   6.329  -4.083
  319   1HB   PRO  39          2HB       PRO  39  -7.398   8.301  -4.871
  320   2HB   PRO  39          1HB       PRO  39  -8.929   7.990  -5.695
  321   1HG   PRO  39          2HG       PRO  39  -8.215  10.147  -3.776
  322   2HG   PRO  39          1HG       PRO  39  -9.321  10.192  -5.159
  323   1HD   PRO  39          2HD       PRO  39 -10.018   9.851  -2.438
  324   2HD   PRO  39          1HD       PRO  39 -11.085   9.657  -3.842
  325    H    LEU  40           H        LEU  40  -6.909   5.714  -3.496
  326    HA   LEU  40           HA       LEU  40  -5.689   7.058  -1.192
  327   1HB   LEU  40          2HB       LEU  40  -6.442   4.157  -1.401
  328   2HB   LEU  40          1HB       LEU  40  -5.128   4.677  -0.361
  329    HG   LEU  40           HG       LEU  40  -7.864   5.885  -0.095
  330   1HD1  LEU  40          1HD1      LEU  40  -7.845   3.318   0.008
  331   2HD1  LEU  40          2HD1      LEU  40  -8.587   4.209   1.337
  332   3HD1  LEU  40          3HD1      LEU  40  -6.970   3.533   1.523
  333   1HD2  LEU  40          1HD2      LEU  40  -5.623   5.452   1.876
  334   2HD2  LEU  40          2HD2      LEU  40  -7.137   6.309   2.172
  335   3HD2  LEU  40          3HD2      LEU  40  -5.960   6.962   1.031
  336    H    ASP  41           H        ASP  41  -3.464   7.018  -1.148
  337    HA   ASP  41           HA       ASP  41  -2.153   5.742  -3.462
  338   1HB   ASP  41          2HB       ASP  41  -1.209   8.193  -1.959
  339   2HB   ASP  41          1HB       ASP  41  -0.497   7.514  -3.417
  340    H    LEU  42           H        LEU  42  -0.655   4.239  -3.063
  341    HA   LEU  42           HA       LEU  42   0.125   3.740  -0.292
  342   1HB   LEU  42          2HB       LEU  42   0.826   2.056  -2.691
  343   2HB   LEU  42          1HB       LEU  42   0.831   1.579  -1.005
  344    HG   LEU  42           HG       LEU  42  -1.653   2.252  -2.583
  345   1HD1  LEU  42          1HD1      LEU  42  -1.931  -0.335  -2.122
  346   2HD1  LEU  42          2HD1      LEU  42  -0.168  -0.281  -2.151
  347   3HD1  LEU  42          3HD1      LEU  42  -1.091   0.273  -3.548
  348   1HD2  LEU  42          1HD2      LEU  42  -2.841   1.276  -0.692
  349   2HD2  LEU  42          2HD2      LEU  42  -1.865   2.652  -0.177
  350   3HD2  LEU  42          3HD2      LEU  42  -1.312   1.008   0.145
  351    H    HIS  43           H        HIS  43   1.900   4.712   0.435
  352    HA   HIS  43           HA       HIS  43   4.135   5.170  -1.423
  353   1HB   HIS  43          2HB       HIS  43   2.939   7.122  -0.199
  354   2HB   HIS  43          1HB       HIS  43   3.822   6.567   1.219
  355    HD1  HIS  43           HD1      HIS  43   4.812   9.121   0.865
  356    HD2  HIS  43           HD2      HIS  43   6.057   6.173  -1.782
  357    HE1  HIS  43           HE1      HIS  43   6.914  10.013  -0.193
  358    HE2  HIS  43           HE2      HIS  43   7.587   8.255  -1.872
  359    H    TYR  44           H        TYR  44   5.859   3.912  -1.167
  360    HA   TYR  44           HA       TYR  44   6.176   2.352   1.259
  361   1HB   TYR  44          2HB       TYR  44   6.528   1.644  -1.290
  362   2HB   TYR  44          1HB       TYR  44   8.160   2.215  -0.962
  363    HD1  TYR  44           HD2      TYR  44   5.730   0.354   1.166
  364    HD2  TYR  44           HD1      TYR  44   9.521   0.350  -0.756
  365    HE1  TYR  44           HE2      TYR  44   6.259  -1.802   2.229
  366    HE2  TYR  44           HE1      TYR  44  10.063  -1.805   0.299
  367    HH   TYR  44           HH       TYR  44   8.737  -3.000   2.836
  368    H    MET  45           H        MET  45   7.618   2.753   2.823
  369    HA   MET  45           HA       MET  45   9.743   4.725   2.297
  370   1HB   MET  45          2HB       MET  45   7.682   4.672   4.429
  371   2HB   MET  45          1HB       MET  45   9.308   5.121   4.926
  372   1HG   MET  45          2HG       MET  45   8.212   7.133   4.440
  373   2HG   MET  45          1HG       MET  45   9.269   6.826   3.065
  374   1HE   MET  45          1HE       MET  45   5.771   6.797   4.525
  375   2HE   MET  45          2HE       MET  45   4.755   7.179   3.135
  376   3HE   MET  45          3HE       MET  45   5.932   8.356   3.718
  377    H    ASN  46           H        ASN  46  11.641   3.729   2.434
  378    HA   ASN  46           HA       ASN  46  11.992   1.238   3.793
  379   1HB   ASN  46          2HB       ASN  46  13.587   2.985   2.056
  380   2HB   ASN  46          1HB       ASN  46  14.539   2.162   3.287
  381   1HD2  ASN  46          1HD2      ASN  46  14.812  -0.032   3.182
  382   2HD2  ASN  46          2HD2      ASN  46  14.312  -0.980   1.828
  383    H    ASN  47           H        ASN  47  13.327   4.496   4.324
  384    HA   ASN  47           HA       ASN  47  13.036   4.463   7.110
  385   1HB   ASN  47          2HB       ASN  47  15.297   2.978   6.213
  386   2HB   ASN  47          1HB       ASN  47  15.896   4.458   6.954
  387   1HD2  ASN  47          1HD2      ASN  47  16.790   2.835   8.483
  388   2HD2  ASN  47          2HD2      ASN  47  15.798   2.353   9.815
  389    H    GLU  48           H        GLU  48  15.442   5.522   4.703
  390    HA   GLU  48           HA       GLU  48  15.131   8.281   5.677
  391   1HB   GLU  48          2HB       GLU  48  17.407   6.710   4.703
  392   2HB   GLU  48          1HB       GLU  48  17.302   8.315   3.993
  393   1HG   GLU  48          2HG       GLU  48  18.230   9.162   5.805
  394   2HG   GLU  48          1HG       GLU  48  16.843   8.629   6.750
  395    H    LEU  49           H        LEU  49  14.754   6.224   2.869
  396    HA   LEU  49           HA       LEU  49  14.014   8.581   1.267
  397   1HB   LEU  49          2HB       LEU  49  15.928   6.904   0.592
  398   2HB   LEU  49          1HB       LEU  49  14.586   5.923   0.033
  399    HG   LEU  49           HG       LEU  49  14.600   8.741  -0.876
  400   1HD1  LEU  49          1HD1      LEU  49  16.874   8.488  -1.236
  401   2HD1  LEU  49          2HD1      LEU  49  16.174   7.972  -2.770
  402   3HD1  LEU  49          3HD1      LEU  49  16.728   6.769  -1.604
  403   1HD2  LEU  49          1HD2      LEU  49  13.139   6.544  -1.486
  404   2HD2  LEU  49          2HD2      LEU  49  14.359   6.497  -2.760
  405   3HD2  LEU  49          3HD2      LEU  49  13.349   7.928  -2.558
  406    H    SER  50           H        SER  50  12.215   8.383  -0.174
  407    HA   SER  50           HA       SER  50  10.219   6.404   0.708
  408   1HB   SER  50          2HB       SER  50   9.360   9.005  -0.490
  409   2HB   SER  50          1HB       SER  50   8.546   7.997   0.705
  410    HG   SER  50           HG       SER  50   9.623   8.958   2.268
  411    H    ILE  51           H        ILE  51   9.510   5.055  -0.797
  412    HA   ILE  51           HA       ILE  51   9.919   5.748  -3.638
  413    HB   ILE  51           HB       ILE  51   9.698   2.967  -2.485
  414   1HG1  ILE  51          2HG1      ILE  51  12.287   4.083  -3.488
  415   2HG1  ILE  51          1HG1      ILE  51  11.771   4.492  -1.855
  416   1HG2  ILE  51          1HG2      ILE  51  11.010   3.533  -5.081
  417   2HG2  ILE  51          2HG2      ILE  51   9.253   3.661  -5.013
  418   3HG2  ILE  51          3HG2      ILE  51  10.044   2.149  -4.572
  419   1HD1  ILE  51          1HD1      ILE  51  12.639   1.891  -2.980
  420   2HD1  ILE  51          2HD1      ILE  51  11.441   1.881  -1.683
  421   3HD1  ILE  51          3HD1      ILE  51  13.013   2.640  -1.428
  422    H    LEU  52           H        LEU  52   8.192   5.743  -4.977
  423    HA   LEU  52           HA       LEU  52   5.579   5.115  -3.814
  424   1HB   LEU  52          2HB       LEU  52   6.400   7.268  -5.265
  425   2HB   LEU  52          1HB       LEU  52   5.691   6.271  -6.520
  426    HG   LEU  52           HG       LEU  52   3.767   6.192  -4.553
  427   1HD1  LEU  52          1HD1      LEU  52   5.119   7.964  -3.364
  428   2HD1  LEU  52          2HD1      LEU  52   3.431   8.359  -3.684
  429   3HD1  LEU  52          3HD1      LEU  52   4.704   9.044  -4.693
  430   1HD2  LEU  52          1HD2      LEU  52   2.442   7.399  -6.063
  431   2HD2  LEU  52          2HD2      LEU  52   3.636   6.583  -7.073
  432   3HD2  LEU  52          3HD2      LEU  52   3.822   8.297  -6.695
  433    H    LEU  53           H        LEU  53   4.276   3.521  -4.549
  434    HA   LEU  53           HA       LEU  53   5.408   1.673  -6.516
  435   1HB   LEU  53          2HB       LEU  53   2.977   1.284  -4.765
  436   2HB   LEU  53          1HB       LEU  53   3.821   0.054  -5.684
  437    HG   LEU  53           HG       LEU  53   4.497  -0.323  -3.485
  438   1HD1  LEU  53          1HD1      LEU  53   6.844   0.171  -3.412
  439   2HD1  LEU  53          2HD1      LEU  53   6.646   1.483  -4.574
  440   3HD1  LEU  53          3HD1      LEU  53   6.385  -0.188  -5.076
  441   1HD2  LEU  53          1HD2      LEU  53   5.366   2.445  -2.891
  442   2HD2  LEU  53          2HD2      LEU  53   4.698   1.210  -1.824
  443   3HD2  LEU  53          3HD2      LEU  53   3.632   2.122  -2.893
  444    H    LYS  54           H        LYS  54   4.910   3.182  -8.282
  445    HA   LYS  54           HA       LYS  54   2.165   3.732  -8.926
  446   1HB   LYS  54          2HB       LYS  54   3.041   4.704 -10.992
  447   2HB   LYS  54          1HB       LYS  54   3.922   5.292  -9.591
  448   1HG   LYS  54          2HG       LYS  54   5.710   3.650 -10.085
  449   2HG   LYS  54          1HG       LYS  54   4.838   3.199 -11.551
  450   1HD   LYS  54          2HD       LYS  54   5.477   5.054 -12.650
  451   2HD   LYS  54          1HD       LYS  54   5.284   6.081 -11.231
  452   1HE   LYS  54          2HE       LYS  54   7.538   6.184 -11.354
  453   2HE   LYS  54          1HE       LYS  54   7.430   4.666 -10.465
  454   1HZ   LYS  54          1HZ       LYS  54   8.934   4.428 -12.305
  455   2HZ   LYS  54          2HZ       LYS  54   7.765   4.966 -13.403
  456   3HZ   LYS  54          3HZ       LYS  54   7.558   3.489 -12.604
  457    H    ASN  55           H        ASN  55   4.551   1.346  -9.922
  458    HA   ASN  55           HA       ASN  55   2.454   0.003 -11.502
  459   1HB   ASN  55          2HB       ASN  55   5.411   0.256 -12.058
  460   2HB   ASN  55          1HB       ASN  55   4.412  -0.973 -12.825
  461   1HD2  ASN  55          1HD2      ASN  55   5.660   2.057 -13.160
  462   2HD2  ASN  55          2HD2      ASN  55   4.573   2.680 -14.350
  463    H    GLN  56           H        GLN  56   2.823  -2.381 -11.721
  464    HA   GLN  56           HA       GLN  56   2.994  -3.604  -9.201
  465   1HB   GLN  56          2HB       GLN  56   2.002  -4.416 -11.546
  466   2HB   GLN  56          1HB       GLN  56   3.552  -5.244 -11.626
  467   1HG   GLN  56          2HG       GLN  56   2.084  -5.523  -9.092
  468   2HG   GLN  56          1HG       GLN  56   1.340  -6.277 -10.499
  469   1HE2  GLN  56          1HE2      GLN  56   1.796  -8.179  -9.066
  470   2HE2  GLN  56          2HE2      GLN  56   3.320  -8.968  -9.264
  471    H    ASP  57           H        ASP  57   5.389  -3.127 -11.735
  472    HA   ASP  57           HA       ASP  57   7.405  -4.851 -10.928
  473   1HB   ASP  57          2HB       ASP  57   7.648  -2.076 -12.122
  474   2HB   ASP  57          1HB       ASP  57   8.971  -3.233 -12.007
  475    H    ASP  58           H        ASP  58   6.859  -1.478  -9.917
  476    HA   ASP  58           HA       ASP  58   9.023  -1.264  -8.162
  477   1HB   ASP  58          2HB       ASP  58   7.205   0.491  -9.047
  478   2HB   ASP  58          1HB       ASP  58   6.502   0.161  -7.465
  479    H    LEU  59           H        LEU  59   5.674  -2.259  -7.543
  480    HA   LEU  59           HA       LEU  59   5.967  -2.647  -4.754
  481   1HB   LEU  59          2HB       LEU  59   3.805  -2.392  -5.965
  482   2HB   LEU  59          1HB       LEU  59   4.036  -3.987  -6.649
  483    HG   LEU  59           HG       LEU  59   4.213  -4.657  -4.078
  484   1HD1  LEU  59          1HD1      LEU  59   2.708  -3.375  -2.703
  485   2HD1  LEU  59          2HD1      LEU  59   2.359  -2.282  -4.044
  486   3HD1  LEU  59          3HD1      LEU  59   3.971  -2.315  -3.329
  487   1HD2  LEU  59          1HD2      LEU  59   1.481  -4.145  -5.185
  488   2HD2  LEU  59          2HD2      LEU  59   2.081  -5.537  -4.283
  489   3HD2  LEU  59          3HD2      LEU  59   2.558  -5.303  -5.964
  490    H    ASP  60           H        ASP  60   6.276  -4.814  -7.540
  491    HA   ASP  60           HA       ASP  60   6.650  -7.195  -6.061
  492   1HB   ASP  60          2HB       ASP  60   6.106  -6.844  -8.595
  493   2HB   ASP  60          1HB       ASP  60   7.856  -6.813  -8.782
  494    H    LYS  61           H        LYS  61   8.945  -4.847  -7.410
  495    HA   LYS  61           HA       LYS  61  11.297  -6.268  -6.787
  496   1HB   LYS  61          2HB       LYS  61  10.684  -3.831  -7.996
  497   2HB   LYS  61          1HB       LYS  61  11.605  -3.380  -6.568
  498   1HG   LYS  61          2HG       LYS  61  12.568  -5.484  -8.474
  499   2HG   LYS  61          1HG       LYS  61  12.885  -3.767  -8.730
  500   1HD   LYS  61          2HD       LYS  61  14.285  -3.614  -6.910
  501   2HD   LYS  61          1HD       LYS  61  13.520  -4.965  -6.073
  502   1HE   LYS  61          2HE       LYS  61  15.711  -5.639  -6.792
  503   2HE   LYS  61          1HE       LYS  61  14.505  -6.503  -7.746
  504   1HZ   LYS  61          1HZ       LYS  61  15.863  -5.823  -9.410
  505   2HZ   LYS  61          2HZ       LYS  61  16.421  -4.462  -8.575
  506   3HZ   LYS  61          3HZ       LYS  61  14.906  -4.428  -9.327
  507    H    ALA  62           H        ALA  62   9.284  -4.059  -4.917
  508    HA   ALA  62           HA       ALA  62  11.026  -3.691  -2.732
  509   1HB   ALA  62          1HB       ALA  62   9.285  -2.612  -1.691
  510   2HB   ALA  62          2HB       ALA  62   8.067  -3.701  -2.354
  511   3HB   ALA  62          3HB       ALA  62   8.808  -2.476  -3.383
  512    H    ILE  63           H        ILE  63   8.579  -6.153  -3.427
  513    HA   ILE  63           HA       ILE  63   8.613  -7.402  -0.893
  514    HB   ILE  63           HB       ILE  63   8.017  -8.727  -3.544
  515   1HG1  ILE  63          2HG1      ILE  63   5.848  -7.729  -1.762
  516   2HG1  ILE  63          1HG1      ILE  63   6.724  -6.533  -2.710
  517   1HG2  ILE  63          1HG2      ILE  63   8.372 -10.242  -1.623
  518   2HG2  ILE  63          2HG2      ILE  63   6.723 -10.301  -2.248
  519   3HG2  ILE  63          3HG2      ILE  63   7.072  -9.417  -0.763
  520   1HD1  ILE  63          1HD1      ILE  63   4.732  -8.480  -3.536
  521   2HD1  ILE  63          2HD1      ILE  63   6.162  -8.465  -4.565
  522   3HD1  ILE  63          3HD1      ILE  63   5.246  -6.981  -4.307
  523    H    ASP  64           H        ASP  64  10.464  -7.980  -3.867
  524    HA   ASP  64           HA       ASP  64  11.810 -10.296  -3.127
  525   1HB   ASP  64          2HB       ASP  64  12.345  -8.071  -5.026
  526   2HB   ASP  64          1HB       ASP  64  13.707  -9.107  -4.610
  527    H    ILE  65           H        ILE  65  12.510  -6.929  -2.335
  528    HA   ILE  65           HA       ILE  65  15.050  -7.371  -1.169
  529    HB   ILE  65           HB       ILE  65  13.105  -5.171  -0.461
  530   1HG1  ILE  65          2HG1      ILE  65  15.305  -4.778  -2.442
  531   2HG1  ILE  65          1HG1      ILE  65  13.851  -5.609  -2.983
  532   1HG2  ILE  65          1HG2      ILE  65  15.006  -3.942   0.276
  533   2HG2  ILE  65          2HG2      ILE  65  16.116  -5.152  -0.368
  534   3HG2  ILE  65          3HG2      ILE  65  15.099  -5.538   1.020
  535   1HD1  ILE  65          1HD1      ILE  65  13.149  -3.541  -3.457
  536   2HD1  ILE  65          2HD1      ILE  65  14.286  -2.786  -2.340
  537   3HD1  ILE  65          3HD1      ILE  65  12.775  -3.466  -1.736
  538    H    LEU  66           H        LEU  66  11.764  -7.325   0.177
  539    HA   LEU  66           HA       LEU  66  12.472  -7.554   2.888
  540   1HB   LEU  66          2HB       LEU  66  10.208  -6.977   2.031
  541   2HB   LEU  66          1HB       LEU  66  10.001  -8.644   1.537
  542    HG   LEU  66           HG       LEU  66  10.715  -8.301   4.372
  543   1HD1  LEU  66          1HD1      LEU  66   9.132  -6.350   3.701
  544   2HD1  LEU  66          2HD1      LEU  66   8.784  -7.306   5.140
  545   3HD1  LEU  66          3HD1      LEU  66   7.901  -7.612   3.646
  546   1HD2  LEU  66          1HD2      LEU  66   8.772  -9.904   4.566
  547   2HD2  LEU  66          2HD2      LEU  66  10.145 -10.469   3.614
  548   3HD2  LEU  66          3HD2      LEU  66   8.692  -9.886   2.804
  549    H    ASP  67           H        ASP  67  11.809 -10.040   0.428
  550    HA   ASP  67           HA       ASP  67  12.061 -12.268   2.151
  551   1HB   ASP  67          2HB       ASP  67  11.285 -11.955  -0.435
  552   2HB   ASP  67          1HB       ASP  67  12.884 -12.657  -0.658
  553    H    ARG  68           H        ARG  68  14.405 -10.392   0.328
  554    HA   ARG  68           HA       ARG  68  16.596 -12.166   0.602
  555   1HB   ARG  68          2HB       ARG  68  16.168  -9.905  -0.821
  556   2HB   ARG  68          1HB       ARG  68  17.152  -9.262   0.485
  557   1HG   ARG  68          2HG       ARG  68  19.016 -10.378  -0.180
  558   2HG   ARG  68          1HG       ARG  68  18.103 -11.723  -0.865
  559   1HD   ARG  68          2HD       ARG  68  17.322 -10.037  -2.633
  560   2HD   ARG  68          1HD       ARG  68  18.636  -9.015  -2.050
  561    HE   ARG  68           HE       ARG  68  20.122 -10.378  -3.123
  562   1HH1  ARG  68          1HH1      ARG  68  17.064 -12.071  -2.856
  563   2HH1  ARG  68          2HH1      ARG  68  17.560 -13.383  -3.873
  564   1HH2  ARG  68          1HH2      ARG  68  20.773 -12.111  -4.463
  565   2HH2  ARG  68          2HH2      ARG  68  19.668 -13.405  -4.787
  566    H    SER  69           H        SER  69  15.270  -9.648   2.667
  567    HA   SER  69           HA       SER  69  17.479 -10.019   4.565
  568   1HB   SER  69          2HB       SER  69  16.944  -7.692   3.855
  569   2HB   SER  69          1HB       SER  69  15.334  -7.878   4.552
  570    HG   SER  69           HG       SER  69  16.202  -7.958   6.560
  571    H    SER  70           H        SER  70  17.093 -11.608   5.984
  572    HA   SER  70           HA       SER  70  14.432 -12.370   6.760
  573   1HB   SER  70          2HB       SER  70  16.164 -14.073   6.524
  574   2HB   SER  70          1HB       SER  70  17.130 -13.298   7.779
  575    HG   SER  70           HG       SER  70  14.500 -14.235   8.258
  576    H    SER  71           H        SER  71  16.503  -9.925   7.858
  577    HA   SER  71           HA       SER  71  15.635 -10.087  10.628
  578   1HB   SER  71          2HB       SER  71  17.201  -8.361  11.095
  579   2HB   SER  71          1HB       SER  71  17.987  -9.423   9.929
  580    HG   SER  71           HG       SER  71  16.773  -7.627   8.483
  581    H    MET  72           H        MET  72  13.476  -9.758   8.911
  582    HA   MET  72           HA       MET  72  12.512  -7.124   9.750
  583   1HB   MET  72          2HB       MET  72  13.247  -7.536   7.166
  584   2HB   MET  72          1HB       MET  72  11.559  -8.025   7.100
  585   1HG   MET  72          2HG       MET  72  11.192  -5.852   6.726
  586   2HG   MET  72          1HG       MET  72  11.358  -5.711   8.475
  587   1HE   MET  72          1HE       MET  72  13.240  -3.545   9.317
  588   2HE   MET  72          2HE       MET  72  14.756  -4.429   9.146
  589   3HE   MET  72          3HE       MET  72  13.302  -5.268   9.686
  590    H    LYS  73           H        LYS  73   9.955  -7.163   8.883
  591    HA   LYS  73           HA       LYS  73   8.830  -9.731   9.776
  592   1HB   LYS  73          2HB       LYS  73   7.965  -6.979  10.682
  593   2HB   LYS  73          1HB       LYS  73   7.073  -8.456  11.007
  594   1HG   LYS  73          2HG       LYS  73   8.719  -9.266  12.459
  595   2HG   LYS  73          1HG       LYS  73   9.925  -8.122  11.866
  596   1HD   LYS  73          2HD       LYS  73   7.913  -6.474  12.754
  597   2HD   LYS  73          1HD       LYS  73   7.881  -7.792  13.927
  598   1HE   LYS  73          2HE       LYS  73  10.539  -6.708  13.201
  599   2HE   LYS  73          1HE       LYS  73   9.488  -5.664  14.158
  600   1HZ   LYS  73          1HZ       LYS  73   9.604  -7.029  15.947
  601   2HZ   LYS  73          2HZ       LYS  73  11.102  -7.414  15.263
  602   3HZ   LYS  73          3HZ       LYS  73   9.779  -8.439  15.028
  603    H    SER  74           H        SER  74   7.544  -6.575   8.693
  604    HA   SER  74           HA       SER  74   6.218  -7.963   6.463
  605   1HB   SER  74          2HB       SER  74   4.795  -5.669   7.721
  606   2HB   SER  74          1HB       SER  74   4.141  -7.124   6.972
  607    HG   SER  74           HG       SER  74   4.230  -6.710   9.477
  608    H    LEU  75           H        LEU  75   5.044  -5.924   5.150
  609    HA   LEU  75           HA       LEU  75   7.339  -4.366   4.239
  610   1HB   LEU  75          2HB       LEU  75   4.685  -5.099   3.078
  611   2HB   LEU  75          1HB       LEU  75   5.468  -3.639   2.505
  612    HG   LEU  75           HG       LEU  75   7.521  -5.368   2.258
  613   1HD1  LEU  75          1HD1      LEU  75   6.937  -7.521   1.803
  614   2HD1  LEU  75          2HD1      LEU  75   5.301  -7.092   1.302
  615   3HD1  LEU  75          3HD1      LEU  75   5.714  -7.143   3.015
  616   1HD2  LEU  75          1HD2      LEU  75   7.294  -4.977   0.046
  617   2HD2  LEU  75          2HD2      LEU  75   6.047  -3.857   0.595
  618   3HD2  LEU  75          3HD2      LEU  75   5.598  -5.462   0.021
  619    H    ARG  76           H        ARG  76   7.658  -2.334   4.891
  620    HA   ARG  76           HA       ARG  76   5.690  -0.955   6.461
  621   1HB   ARG  76          2HB       ARG  76   8.068  -0.785   7.008
  622   2HB   ARG  76          1HB       ARG  76   8.395  -0.054   5.444
  623   1HG   ARG  76          2HG       ARG  76   8.348   1.586   7.264
  624   2HG   ARG  76          1HG       ARG  76   7.121   1.902   6.038
  625   1HD   ARG  76          2HD       ARG  76   5.412   1.520   7.468
  626   2HD   ARG  76          1HD       ARG  76   6.254   0.207   8.288
  627    HE   ARG  76           HE       ARG  76   6.211   2.980   9.041
  628   1HH1  ARG  76          1HH1      ARG  76   8.035  -0.004   9.256
  629   2HH1  ARG  76          2HH1      ARG  76   8.834   0.443  10.726
  630   1HH2  ARG  76          1HH2      ARG  76   7.270   3.568  10.978
  631   2HH2  ARG  76          2HH2      ARG  76   8.399   2.474  11.705
  632    H    ILE  77           H        ILE  77   3.995  -0.814   4.874
  633    HA   ILE  77           HA       ILE  77   4.448   1.150   2.734
  634    HB   ILE  77           HB       ILE  77   2.023  -0.612   3.100
  635   1HG1  ILE  77          2HG1      ILE  77   4.314  -1.114   1.196
  636   2HG1  ILE  77          1HG1      ILE  77   4.204  -1.882   2.776
  637   1HG2  ILE  77          1HG2      ILE  77   1.271   0.913   1.614
  638   2HG2  ILE  77          2HG2      ILE  77   2.156  -0.092   0.468
  639   3HG2  ILE  77          3HG2      ILE  77   2.892   1.381   1.101
  640   1HD1  ILE  77          1HD1      ILE  77   1.781  -2.490   1.812
  641   2HD1  ILE  77          2HD1      ILE  77   3.207  -3.502   1.584
  642   3HD1  ILE  77          3HD1      ILE  77   2.695  -2.401   0.306
  643    H    LEU  78           H        LEU  78   3.743   3.161   3.002
  644    HA   LEU  78           HA       LEU  78   1.802   3.707   5.141
  645   1HB   LEU  78          2HB       LEU  78   3.944   5.338   3.819
  646   2HB   LEU  78          1HB       LEU  78   2.625   6.130   4.656
  647    HG   LEU  78           HG       LEU  78   4.493   6.006   6.146
  648   1HD1  LEU  78          1HD1      LEU  78   2.649   3.809   7.037
  649   2HD1  LEU  78          2HD1      LEU  78   2.162   5.503   7.001
  650   3HD1  LEU  78          3HD1      LEU  78   3.505   4.994   8.023
  651   1HD2  LEU  78          1HD2      LEU  78   5.554   3.915   6.782
  652   2HD2  LEU  78          2HD2      LEU  78   5.687   4.170   5.042
  653   3HD2  LEU  78          3HD2      LEU  78   4.506   3.025   5.677
  654    H    LEU  79           H        LEU  79  -0.241   4.020   4.533
  655    HA   LEU  79           HA       LEU  79  -0.761   5.028   1.820
  656   1HB   LEU  79          2HB       LEU  79  -2.976   4.065   1.995
  657   2HB   LEU  79          1HB       LEU  79  -1.755   2.848   2.314
  658    HG   LEU  79           HG       LEU  79  -2.368   3.782   4.841
  659   1HD1  LEU  79          1HD1      LEU  79  -4.769   3.790   5.022
  660   2HD1  LEU  79          2HD1      LEU  79  -4.937   3.527   3.286
  661   3HD1  LEU  79          3HD1      LEU  79  -4.265   5.041   3.888
  662   1HD2  LEU  79          1HD2      LEU  79  -3.006   1.392   3.213
  663   2HD2  LEU  79          2HD2      LEU  79  -3.888   1.600   4.725
  664   3HD2  LEU  79          3HD2      LEU  79  -2.126   1.530   4.736
  665    H    LEU  80           H        LEU  80  -1.594   6.985   1.534
  666    HA   LEU  80           HA       LEU  80  -2.729   8.368   3.880
  667   1HB   LEU  80          2HB       LEU  80  -1.119   9.540   1.609
  668   2HB   LEU  80          1HB       LEU  80  -1.867  10.466   2.897
  669    HG   LEU  80           HG       LEU  80  -0.408   8.913   4.447
  670   1HD1  LEU  80          1HD1      LEU  80   0.717   8.499   1.741
  671   2HD1  LEU  80          2HD1      LEU  80   0.706   7.433   3.145
  672   3HD1  LEU  80          3HD1      LEU  80   1.863   8.762   3.057
  673   1HD2  LEU  80          1HD2      LEU  80   1.238  10.938   3.048
  674   2HD2  LEU  80          2HD2      LEU  80   0.927  10.717   4.769
  675   3HD2  LEU  80          3HD2      LEU  80  -0.286  11.488   3.747
  676    H    SER  81           H        SER  81  -4.742   9.097   3.689
  677    HA   SER  81           HA       SER  81  -6.026   8.983   1.058
  678   1HB   SER  81          2HB       SER  81  -6.916   7.906   3.320
  679   2HB   SER  81          1HB       SER  81  -7.580   9.522   3.553
  680    HG   SER  81           HG       SER  81  -9.081   8.994   2.195
  681    H    GLN  82           H        GLN  82  -6.692  10.747   0.005
  682    HA   GLN  82           HA       GLN  82  -6.171  13.341   1.205
  683   1HB   GLN  82          2HB       GLN  82  -6.321  14.271  -1.000
  684   2HB   GLN  82          1HB       GLN  82  -5.351  12.808  -1.100
  685   1HG   GLN  82          2HG       GLN  82  -8.008  12.025  -1.564
  686   2HG   GLN  82          1HG       GLN  82  -7.749  13.496  -2.499
  687   1HE2  GLN  82          1HE2      GLN  82  -5.670  10.739  -1.659
  688   2HE2  GLN  82          2HE2      GLN  82  -5.233  10.355  -3.286
  689    H    ASP  83           H        ASP  83  -8.651  11.384   1.404
  690    HA   ASP  83           HA       ASP  83 -10.692  13.469   1.098
  691   1HB   ASP  83          2HB       ASP  83 -10.706  10.532   0.701
  692   2HB   ASP  83          1HB       ASP  83 -12.154  11.219   1.432
  693    H    ARG  84           H        ARG  84 -11.621  14.273   2.886
  694    HA   ARG  84           HA       ARG  84 -11.113  12.896   5.432
  695   1HB   ARG  84          2HB       ARG  84 -11.104  15.720   4.623
  696   2HB   ARG  84          1HB       ARG  84 -11.971  15.413   6.121
  697   1HG   ARG  84          2HG       ARG  84  -9.526  13.974   6.213
  698   2HG   ARG  84          1HG       ARG  84  -9.178  15.626   5.698
  699   1HD   ARG  84          2HD       ARG  84 -10.860  16.181   7.682
  700   2HD   ARG  84          1HD       ARG  84 -10.288  14.617   8.263
  701    HE   ARG  84           HE       ARG  84  -8.133  16.320   7.499
  702   1HH1  ARG  84          1HH1      ARG  84 -10.410  15.690  10.087
  703   2HH1  ARG  84          2HH1      ARG  84  -9.384  16.351  11.315
  704   1HH2  ARG  84          1HH2      ARG  84  -6.787  17.192   9.123
  705   2HH2  ARG  84          2HH2      ARG  84  -7.328  17.203  10.768
  706    H    ASN  85           H        ASN  85 -12.852  11.505   5.471
  707    HA   ASN  85           HA       ASN  85 -15.491  12.786   5.745
  708   1HB   ASN  85          2HB       ASN  85 -14.706  10.311   4.242
  709   2HB   ASN  85          1HB       ASN  85 -16.317  10.423   4.939
  710   1HD2  ASN  85          1HD2      ASN  85 -15.982  10.163   2.239
  711   2HD2  ASN  85          2HD2      ASN  85 -16.440  11.631   1.450
  712    H    LEU  86           H        LEU  86 -17.034  10.916   6.759
  713    HA   LEU  86           HA       LEU  86 -17.622   9.778   8.631
  714   1HB   LEU  86          2HB       LEU  86 -15.331   8.536   7.768
  715   2HB   LEU  86          1HB       LEU  86 -14.923   8.945   9.424
  716    HG   LEU  86           HG       LEU  86 -17.432   7.445   8.690
  717   1HD1  LEU  86          1HD1      LEU  86 -15.901   5.899   7.996
  718   2HD1  LEU  86          2HD1      LEU  86 -15.968   5.515   9.716
  719   3HD1  LEU  86          3HD1      LEU  86 -14.644   6.490   9.081
  720   1HD2  LEU  86          1HD2      LEU  86 -15.996   7.361  11.313
  721   2HD2  LEU  86          2HD2      LEU  86 -17.693   7.044  10.953
  722   3HD2  LEU  86          3HD2      LEU  86 -17.084   8.699  10.940
  723    H    GLU  87           H        GLU  87 -17.353  12.438   8.977
  724    HA   GLU  87           HA       GLU  87 -15.639  13.074  11.200
  725   1HB   GLU  87          2HB       GLU  87 -17.951  14.712  10.156
  726   2HB   GLU  87          1HB       GLU  87 -16.578  15.277  11.096
  727   1HG   GLU  87          2HG       GLU  87 -15.243  15.444   9.299
  728   2HG   GLU  87          1HG       GLU  87 -15.880  13.979   8.556
  729    H    HIS  88           H        HIS  88 -19.123  12.569  10.738
  730    HA   HIS  88           HA       HIS  88 -19.440  11.553  13.387
  731   1HB   HIS  88          2HB       HIS  88 -19.665  14.346  13.124
  732   2HB   HIS  88          1HB       HIS  88 -21.316  13.750  13.231
  733    HD1  HIS  88           HD1      HIS  88 -19.432  15.336  15.427
  734    HD2  HIS  88           HD2      HIS  88 -20.770  11.403  15.499
  735    HE1  HIS  88           HE1      HIS  88 -19.387  14.655  17.848
  736    HE2  HIS  88           HE2      HIS  88 -20.118  12.243  17.855
  737    H    HIS  89           H        HIS  89 -21.934  11.305  13.838
  738    HA   HIS  89           HA       HIS  89 -23.028  10.001  11.495
  739   1HB   HIS  89          2HB       HIS  89 -23.187   9.586  14.285
  740   2HB   HIS  89          1HB       HIS  89 -24.818   9.971  13.750
  741    HD1  HIS  89           HD1      HIS  89 -25.912   7.726  13.750
  742    HD2  HIS  89           HD2      HIS  89 -22.235   7.686  11.811
  743    HE1  HIS  89           HE1      HIS  89 -25.708   5.432  12.739
  744    HE2  HIS  89           HE2      HIS  89 -23.481   5.433  11.560
  745    H    HIS  90           H        HIS  90 -23.915  12.652  13.691
  746    HA   HIS  90           HA       HIS  90 -25.327  14.420  13.464
  747   1HB   HIS  90          2HB       HIS  90 -24.532  13.782  10.699
  748   2HB   HIS  90          1HB       HIS  90 -26.045  14.670  10.829
  749    HD1  HIS  90           HD1      HIS  90 -22.722  15.027  12.650
  750    HD2  HIS  90           HD2      HIS  90 -25.459  17.273  10.481
  751    HE1  HIS  90           HE1      HIS  90 -21.822  17.375  12.665
  752    HE2  HIS  90           HE2      HIS  90 -23.508  18.724  11.365
  753    H    HIS  91           H        HIS  91 -27.544  14.991  12.099
  754    HA   HIS  91           HA       HIS  91 -29.312  12.719  12.693
  755   1HB   HIS  91          2HB       HIS  91 -31.098  14.350  13.003
  756   2HB   HIS  91          1HB       HIS  91 -29.727  14.738  14.033
  757    HD1  HIS  91           HD1      HIS  91 -31.981  16.187  11.598
  758    HD2  HIS  91           HD2      HIS  91 -28.122  16.966  12.927
  759    HE1  HIS  91           HE1      HIS  91 -31.494  18.552  10.898
  760    HE2  HIS  91           HE2      HIS  91 -29.106  18.953  11.597
  761    H    HIS  92           H        HIS  92 -27.846  13.082  10.163
  762    HA   HIS  92           HA       HIS  92 -29.968  12.481   8.388
  763   1HB   HIS  92          2HB       HIS  92 -29.571  14.356   6.784
  764   2HB   HIS  92          1HB       HIS  92 -30.337  14.852   8.288
  765    HD1  HIS  92           HD1      HIS  92 -26.867  14.812   6.727
  766    HD2  HIS  92           HD2      HIS  92 -29.104  16.936   9.508
  767    HE1  HIS  92           HE1      HIS  92 -25.435  16.768   7.385
  768    HE2  HIS  92           HE2      HIS  92 -26.870  18.113   8.960
  769    H    HIS  93           H        HIS  93 -29.242  11.228   6.775
  770    HA   HIS  93           HA       HIS  93 -27.841  10.010   5.480
  771   1HB   HIS  93          2HB       HIS  93 -26.469  12.668   5.575
  772   2HB   HIS  93          1HB       HIS  93 -25.618  11.311   4.850
  773    HD1  HIS  93           HD1      HIS  93 -27.752   9.948   3.237
  774    HD2  HIS  93           HD2      HIS  93 -27.436  14.085   3.484
  775    HE1  HIS  93           HE1      HIS  93 -28.919  10.834   1.195
  776    HE2  HIS  93           HE2      HIS  93 -28.780  13.342   1.403
  Start of MODEL   19
    1    H    GLN   1           H        GLN   1   7.013 -18.595  -2.135
    2    HA   GLN   1           HA       GLN   1   4.654 -18.307  -2.131
    3   1HB   GLN   1          2HB       GLN   1   5.819 -20.215  -3.259
    4   2HB   GLN   1          1HB       GLN   1   5.490 -21.205  -1.845
    5   1HG   GLN   1          2HG       GLN   1   3.146 -21.117  -2.231
    6   2HG   GLN   1          1HG       GLN   1   3.339 -19.883  -3.479
    7   1HE2  GLN   1          1HE2      GLN   1   2.563 -20.921  -5.234
    8   2HE2  GLN   1          2HE2      GLN   1   3.208 -22.395  -5.862
    9    H    SER   2           H        SER   2   4.366 -17.395   0.135
   10    HA   SER   2           HA       SER   2   2.531 -19.121   1.581
   11   1HB   SER   2          2HB       SER   2   4.947 -17.872   2.921
   12   2HB   SER   2          1HB       SER   2   3.605 -18.631   3.775
   13    HG   SER   2           HG       SER   2   5.591 -19.806   2.171
   14    H    ASP   3           H        ASP   3   1.506 -17.808   3.460
   15    HA   ASP   3           HA       ASP   3   0.341 -15.485   2.367
   16   1HB   ASP   3          2HB       ASP   3  -0.639 -15.163   4.657
   17   2HB   ASP   3          1HB       ASP   3  -0.919 -16.758   3.969
   18    H    VAL   4           H        VAL   4   1.544 -13.743   1.932
   19    HA   VAL   4           HA       VAL   4   3.721 -12.907   3.612
   20    HB   VAL   4           HB       VAL   4   2.461 -11.366   1.341
   21   1HG1  VAL   4          1HG1      VAL   4   5.026 -11.140   2.866
   22   2HG1  VAL   4          2HG1      VAL   4   3.849  -9.888   2.469
   23   3HG1  VAL   4          3HG1      VAL   4   4.903 -10.539   1.213
   24   1HG2  VAL   4          1HG2      VAL   4   4.221 -12.348  -0.076
   25   2HG2  VAL   4          2HG2      VAL   4   3.098 -13.562   0.535
   26   3HG2  VAL   4          3HG2      VAL   4   4.695 -13.392   1.264
   27    H    ARG   5           H        ARG   5   3.700 -11.463   5.220
   28    HA   ARG   5           HA       ARG   5   1.170 -10.247   5.966
   29   1HB   ARG   5          2HB       ARG   5   3.754 -10.791   7.321
   30   2HB   ARG   5          1HB       ARG   5   2.853  -9.387   7.878
   31   1HG   ARG   5          2HG       ARG   5   0.890 -10.837   8.245
   32   2HG   ARG   5          1HG       ARG   5   1.870 -12.231   7.785
   33   1HD   ARG   5          2HD       ARG   5   2.781 -12.351   9.811
   34   2HD   ARG   5          1HD       ARG   5   3.210 -10.641   9.782
   35    HE   ARG   5           HE       ARG   5   0.452 -10.937  10.297
   36   1HH1  ARG   5          1HH1      ARG   5   3.565 -11.363  11.831
   37   2HH1  ARG   5          2HH1      ARG   5   2.950 -11.107  13.429
   38   1HH2  ARG   5          1HH2      ARG   5  -0.356 -10.599  12.400
   39   2HH2  ARG   5          2HH2      ARG   5   0.723 -10.674  13.753
   40    H    ILE   6           H        ILE   6   0.620  -8.233   5.475
   41    HA   ILE   6           HA       ILE   6   2.752  -6.323   4.756
   42    HB   ILE   6           HB       ILE   6  -0.084  -6.287   3.717
   43   1HG1  ILE   6          2HG1      ILE   6   1.996  -6.833   1.752
   44   2HG1  ILE   6          1HG1      ILE   6   1.921  -8.084   2.989
   45   1HG2  ILE   6          1HG2      ILE   6   0.573  -4.139   3.411
   46   2HG2  ILE   6          2HG2      ILE   6   1.292  -4.833   1.959
   47   3HG2  ILE   6          3HG2      ILE   6   2.289  -4.548   3.385
   48   1HD1  ILE   6          1HD1      ILE   6  -0.108  -8.815   2.319
   49   2HD1  ILE   6          2HD1      ILE   6   0.448  -8.147   0.784
   50   3HD1  ILE   6          3HD1      ILE   6  -0.642  -7.215   1.808
   51    H    LYS   7           H        LYS   7   2.916  -4.594   6.040
   52    HA   LYS   7           HA       LYS   7   0.777  -4.061   7.960
   53   1HB   LYS   7          2HB       LYS   7   3.615  -3.033   7.799
   54   2HB   LYS   7          1HB       LYS   7   2.463  -2.573   9.044
   55   1HG   LYS   7          2HG       LYS   7   2.424  -5.340   9.092
   56   2HG   LYS   7          1HG       LYS   7   4.121  -4.933   8.831
   57   1HD   LYS   7          2HD       LYS   7   4.050  -3.433  10.774
   58   2HD   LYS   7          1HD       LYS   7   2.361  -3.868  11.040
   59   1HE   LYS   7          2HE       LYS   7   3.152  -5.467  12.388
   60   2HE   LYS   7          1HE       LYS   7   3.601  -6.315  10.910
   61   1HZ   LYS   7          1HZ       LYS   7   5.609  -6.289  11.913
   62   2HZ   LYS   7          2HZ       LYS   7   5.283  -4.903  12.824
   63   3HZ   LYS   7          3HZ       LYS   7   5.718  -4.759  11.197
   64    H    PHE   8           H        PHE   8  -0.649  -2.508   7.614
   65    HA   PHE   8           HA       PHE   8   0.047  -0.320   5.766
   66   1HB   PHE   8          2HB       PHE   8  -2.593  -1.664   6.345
   67   2HB   PHE   8          1HB       PHE   8  -2.490  -0.112   5.524
   68    HD1  PHE   8           HD1      PHE   8  -0.877  -0.066   3.442
   69    HD2  PHE   8           HD2      PHE   8  -2.613  -3.591   5.083
   70    HE1  PHE   8           HE1      PHE   8  -0.549  -1.223   1.296
   71    HE2  PHE   8           HE2      PHE   8  -2.286  -4.752   2.938
   72    HZ   PHE   8           HZ       PHE   8  -1.251  -3.570   1.042
   73    H    GLU   9           H        GLU   9  -0.021   1.726   6.495
   74    HA   GLU   9           HA       GLU   9  -1.179   2.190   9.166
   75   1HB   GLU   9          2HB       GLU   9   1.297   3.364   7.903
   76   2HB   GLU   9          1HB       GLU   9   0.544   4.044   9.339
   77   1HG   GLU   9          2HG       GLU   9   1.681   2.631  10.592
   78   2HG   GLU   9          1HG       GLU   9   0.869   1.281   9.804
   79    H    HIS  10           H        HIS  10  -2.721   3.672   9.315
   80    HA   HIS  10           HA       HIS  10  -2.953   5.717   7.213
   81   1HB   HIS  10          2HB       HIS  10  -4.591   3.868   6.840
   82   2HB   HIS  10          1HB       HIS  10  -5.281   4.209   8.423
   83    HD1  HIS  10           HD1      HIS  10  -7.561   4.937   7.574
   84    HD2  HIS  10           HD2      HIS  10  -4.428   7.102   5.908
   85    HE1  HIS  10           HE1      HIS  10  -8.641   6.851   6.353
   86    HE2  HIS  10           HE2      HIS  10  -6.717   8.222   5.471
   87    H    ASN  11           H        ASN  11  -2.778   7.657   8.109
   88    HA   ASN  11           HA       ASN  11  -2.844   9.381   9.589
   89   1HB   ASN  11          2HB       ASN  11  -5.394   7.923  10.229
   90   2HB   ASN  11          1HB       ASN  11  -4.930   9.363  11.126
   91   1HD2  ASN  11          1HD2      ASN  11  -6.786  10.419  10.336
   92   2HD2  ASN  11          2HD2      ASN  11  -6.846  11.034   8.724
   93    H    GLY  12           H        GLY  12  -1.288   7.028  10.355
   94   1HA   GLY  12          2HA       GLY  12   0.129   6.871  12.251
   95   2HA   GLY  12          1HA       GLY  12  -1.136   7.601  13.226
   96    H    GLU  13           H        GLU  13  -3.181   5.748  12.079
   97    HA   GLU  13           HA       GLU  13  -3.006   3.742  14.054
   98   1HB   GLU  13          2HB       GLU  13  -4.949   4.658  12.167
   99   2HB   GLU  13          1HB       GLU  13  -4.825   2.908  12.034
  100   1HG   GLU  13          2HG       GLU  13  -5.193   4.324  14.657
  101   2HG   GLU  13          1HG       GLU  13  -6.540   3.784  13.652
  102    H    ARG  14           H        ARG  14  -2.699   1.514  13.886
  103    HA   ARG  14           HA       ARG  14  -1.089   0.693  11.563
  104   1HB   ARG  14          2HB       ARG  14  -0.084  -0.996  13.053
  105   2HB   ARG  14          1HB       ARG  14   0.164   0.639  13.646
  106   1HG   ARG  14          2HG       ARG  14  -1.775   0.285  15.188
  107   2HG   ARG  14          1HG       ARG  14  -1.790  -1.404  14.679
  108   1HD   ARG  14          2HD       ARG  14  -0.517  -1.472  16.609
  109   2HD   ARG  14          1HD       ARG  14   0.710  -1.377  15.348
  110    HE   ARG  14           HE       ARG  14   1.319   0.683  16.138
  111   1HH1  ARG  14          1HH1      ARG  14  -1.793  -0.166  17.499
  112   2HH1  ARG  14          2HH1      ARG  14  -1.800   1.150  18.625
  113   1HH2  ARG  14          1HH2      ARG  14   1.302   2.424  17.616
  114   2HH2  ARG  14          2HH2      ARG  14  -0.041   2.621  18.691
  115    H    ARG  15           H        ARG  15  -1.512  -1.218  10.492
  116    HA   ARG  15           HA       ARG  15  -3.735  -2.874  11.424
  117   1HB   ARG  15          2HB       ARG  15  -4.047  -0.960   9.395
  118   2HB   ARG  15          1HB       ARG  15  -3.928  -2.506   8.562
  119   1HG   ARG  15          2HG       ARG  15  -5.670  -3.236  10.409
  120   2HG   ARG  15          1HG       ARG  15  -6.012  -1.505  10.424
  121   1HD   ARG  15          2HD       ARG  15  -7.479  -2.199   8.809
  122   2HD   ARG  15          1HD       ARG  15  -6.071  -1.823   7.817
  123    HE   ARG  15           HE       ARG  15  -6.187  -4.562   8.702
  124   1HH1  ARG  15          1HH1      ARG  15  -7.172  -2.303   6.214
  125   2HH1  ARG  15          2HH1      ARG  15  -7.384  -3.530   5.012
  126   1HH2  ARG  15          1HH2      ARG  15  -6.473  -6.174   7.107
  127   2HH2  ARG  15          2HH2      ARG  15  -6.989  -5.723   5.517
  128    H    ILE  16           H        ILE  16  -3.574  -5.011  10.893
  129    HA   ILE  16           HA       ILE  16  -1.196  -5.813   9.339
  130    HB   ILE  16           HB       ILE  16  -2.535  -7.460  11.484
  131   1HG1  ILE  16          2HG1      ILE  16  -0.098  -6.706  12.511
  132   2HG1  ILE  16          1HG1      ILE  16  -0.630  -5.235  11.704
  133   1HG2  ILE  16          1HG2      ILE  16  -1.318  -9.015  10.391
  134   2HG2  ILE  16          2HG2      ILE  16  -0.001  -8.344  11.352
  135   3HG2  ILE  16          3HG2      ILE  16  -0.228  -7.823   9.682
  136   1HD1  ILE  16          1HD1      ILE  16  -1.968  -6.724  13.933
  137   2HD1  ILE  16          2HD1      ILE  16  -2.813  -5.515  12.965
  138   3HD1  ILE  16          3HD1      ILE  16  -1.393  -5.056  13.907
  139    H    ILE  17           H        ILE  17  -1.472  -7.106   7.612
  140    HA   ILE  17           HA       ILE  17  -3.911  -8.682   7.342
  141    HB   ILE  17           HB       ILE  17  -4.264  -6.394   6.302
  142   1HG1  ILE  17          2HG1      ILE  17  -5.573  -8.465   5.753
  143   2HG1  ILE  17          1HG1      ILE  17  -5.525  -7.266   4.466
  144   1HG2  ILE  17          1HG2      ILE  17  -3.087  -5.640   4.534
  145   2HG2  ILE  17          2HG2      ILE  17  -2.775  -7.257   3.901
  146   3HG2  ILE  17          3HG2      ILE  17  -1.830  -6.642   5.256
  147   1HD1  ILE  17          1HD1      ILE  17  -4.998  -8.971   3.143
  148   2HD1  ILE  17          2HD1      ILE  17  -4.584 -10.014   4.503
  149   3HD1  ILE  17          3HD1      ILE  17  -3.392  -8.880   3.866
  150    H    ALA  18           H        ALA  18  -3.535 -10.628   6.435
  151    HA   ALA  18           HA       ALA  18  -0.872 -11.103   5.281
  152   1HB   ALA  18          1HB       ALA  18  -1.692 -13.580   5.668
  153   2HB   ALA  18          2HB       ALA  18  -2.778 -12.798   6.817
  154   3HB   ALA  18          3HB       ALA  18  -1.033 -12.618   6.991
  155    H    PHE  19           H        PHE  19  -0.650 -11.561   3.183
  156    HA   PHE  19           HA       PHE  19  -3.073 -12.199   1.627
  157   1HB   PHE  19          2HB       PHE  19  -0.778 -10.401   1.127
  158   2HB   PHE  19          1HB       PHE  19  -1.313 -11.347  -0.256
  159    HD1  PHE  19           HD1      PHE  19  -3.507 -10.991  -1.236
  160    HD2  PHE  19           HD2      PHE  19  -2.178  -8.679   2.084
  161    HE1  PHE  19           HE1      PHE  19  -5.305  -9.362  -1.653
  162    HE2  PHE  19           HE2      PHE  19  -3.974  -7.050   1.672
  163    HZ   PHE  19           HZ       PHE  19  -5.540  -7.391  -0.198
  164    H    SER  20           H        SER  20  -3.166 -14.198   0.831
  165    HA   SER  20           HA       SER  20  -0.830 -15.903   0.836
  166   1HB   SER  20          2HB       SER  20  -3.760 -16.286   0.438
  167   2HB   SER  20          1HB       SER  20  -2.674 -17.491  -0.254
  168    HG   SER  20           HG       SER  20  -3.489 -17.387   2.205
  169    H    ARG  21           H        ARG  21   0.437 -16.359  -0.860
  170    HA   ARG  21           HA       ARG  21  -0.023 -15.053  -3.381
  171   1HB   ARG  21          2HB       ARG  21   2.190 -16.474  -2.065
  172   2HB   ARG  21          1HB       ARG  21   2.114 -16.720  -3.806
  173   1HG   ARG  21          2HG       ARG  21   2.277 -14.373  -4.215
  174   2HG   ARG  21          1HG       ARG  21   2.111 -14.011  -2.495
  175   1HD   ARG  21          2HD       ARG  21   4.362 -15.663  -3.616
  176   2HD   ARG  21          1HD       ARG  21   4.455 -13.912  -3.444
  177    HE   ARG  21           HE       ARG  21   3.703 -14.876  -0.972
  178   1HH1  ARG  21          1HH1      ARG  21   6.424 -15.306  -3.129
  179   2HH1  ARG  21          2HH1      ARG  21   7.557 -15.575  -1.847
  180   1HH2  ARG  21          1HH2      ARG  21   5.201 -15.239   0.716
  181   2HH2  ARG  21          2HH2      ARG  21   6.864 -15.534   0.333
  182    HA   PRO  22           HA       PRO  22   1.056 -15.525  -5.496
  183   1HB   PRO  22          2HB       PRO  22  -0.109 -15.490  -7.923
  184   2HB   PRO  22          1HB       PRO  22   1.097 -16.702  -7.480
  185   1HG   PRO  22          2HG       PRO  22  -1.886 -16.932  -7.552
  186   2HG   PRO  22          1HG       PRO  22  -0.660 -18.090  -8.099
  187   1HD   PRO  22          2HD       PRO  22  -1.962 -18.288  -5.705
  188   2HD   PRO  22          1HD       PRO  22  -0.330 -18.923  -5.990
  189    H    VAL  23           H        VAL  23   0.598 -13.466  -5.044
  190    HA   VAL  23           HA       VAL  23  -2.203 -12.591  -5.058
  191    HB   VAL  23           HB       VAL  23  -0.997 -12.336  -2.930
  192   1HG1  VAL  23          1HG1      VAL  23   0.785 -10.441  -4.455
  193   2HG1  VAL  23          2HG1      VAL  23   1.255 -12.001  -3.780
  194   3HG1  VAL  23          3HG1      VAL  23   0.794 -10.678  -2.708
  195   1HG2  VAL  23          1HG2      VAL  23  -1.828 -10.230  -2.408
  196   2HG2  VAL  23          2HG2      VAL  23  -2.784 -10.701  -3.814
  197   3HG2  VAL  23          3HG2      VAL  23  -1.439  -9.573  -3.997
  198    H    LYS  24           H        LYS  24  -2.849 -10.680  -6.070
  199    HA   LYS  24           HA       LYS  24  -1.003  -9.690  -8.143
  200   1HB   LYS  24          2HB       LYS  24  -3.808 -10.480  -8.180
  201   2HB   LYS  24          1HB       LYS  24  -3.570  -8.868  -8.840
  202   1HG   LYS  24          2HG       LYS  24  -3.325 -10.130 -10.723
  203   2HG   LYS  24          1HG       LYS  24  -1.647 -10.039 -10.185
  204   1HD   LYS  24          2HD       LYS  24  -2.961 -12.254  -8.916
  205   2HD   LYS  24          1HD       LYS  24  -3.189 -12.346 -10.662
  206   1HE   LYS  24          2HE       LYS  24  -1.009 -12.758 -11.055
  207   2HE   LYS  24          1HE       LYS  24  -0.466 -11.655  -9.792
  208   1HZ   LYS  24          1HZ       LYS  24  -1.064 -14.505  -9.641
  209   2HZ   LYS  24          2HZ       LYS  24  -1.490 -13.573  -8.294
  210   3HZ   LYS  24          3HZ       LYS  24   0.116 -13.601  -8.831
  211    H    TYR  25           H        TYR  25  -0.817  -7.478  -8.522
  212    HA   TYR  25           HA       TYR  25  -0.990  -5.764  -6.306
  213   1HB   TYR  25          2HB       TYR  25   0.566  -5.380  -8.170
  214   2HB   TYR  25          1HB       TYR  25  -0.790  -5.049  -9.242
  215    HD1  TYR  25           HD1      TYR  25   0.714  -3.844  -6.039
  216    HD2  TYR  25           HD2      TYR  25  -1.433  -2.842  -9.575
  217    HE1  TYR  25           HE1      TYR  25   0.837  -1.464  -5.435
  218    HE2  TYR  25           HE2      TYR  25  -1.315  -0.460  -8.979
  219    HH   TYR  25           HH       TYR  25  -1.053   0.881  -6.795
  220    H    GLU  26           H        GLU  26  -3.161  -6.250  -9.057
  221    HA   GLU  26           HA       GLU  26  -4.907  -4.101  -8.566
  222   1HB   GLU  26          2HB       GLU  26  -4.738  -6.131 -10.453
  223   2HB   GLU  26          1HB       GLU  26  -6.246  -6.473  -9.613
  224   1HG   GLU  26          2HG       GLU  26  -6.092  -3.676 -10.172
  225   2HG   GLU  26          1HG       GLU  26  -5.772  -4.587 -11.645
  226    H    ASP  27           H        ASP  27  -4.955  -7.462  -7.421
  227    HA   ASP  27           HA       ASP  27  -7.414  -7.292  -6.048
  228   1HB   ASP  27          2HB       ASP  27  -5.678  -9.327  -6.618
  229   2HB   ASP  27          1HB       ASP  27  -5.419  -9.124  -4.889
  230    H    VAL  28           H        VAL  28  -4.061  -6.817  -4.945
  231    HA   VAL  28           HA       VAL  28  -4.754  -6.372  -2.226
  232    HB   VAL  28           HB       VAL  28  -2.287  -5.384  -3.664
  233   1HG1  VAL  28          1HG1      VAL  28  -1.474  -5.860  -1.161
  234   2HG1  VAL  28          2HG1      VAL  28  -3.155  -5.439  -0.835
  235   3HG1  VAL  28          3HG1      VAL  28  -2.109  -4.297  -1.681
  236   1HG2  VAL  28          1HG2      VAL  28  -2.962  -7.956  -3.596
  237   2HG2  VAL  28          2HG2      VAL  28  -2.246  -7.832  -1.989
  238   3HG2  VAL  28          3HG2      VAL  28  -1.294  -7.416  -3.414
  239    H    GLU  29           H        GLU  29  -4.046  -4.151  -4.915
  240    HA   GLU  29           HA       GLU  29  -4.359  -1.777  -3.428
  241   1HB   GLU  29          2HB       GLU  29  -3.242  -1.990  -5.674
  242   2HB   GLU  29          1HB       GLU  29  -4.845  -2.108  -6.393
  243   1HG   GLU  29          2HG       GLU  29  -4.948   0.162  -4.786
  244   2HG   GLU  29          1HG       GLU  29  -3.362   0.218  -5.550
  245    H    HIS  30           H        HIS  30  -6.648  -3.606  -5.449
  246    HA   HIS  30           HA       HIS  30  -8.815  -1.845  -5.239
  247   1HB   HIS  30          2HB       HIS  30  -8.694  -3.769  -6.813
  248   2HB   HIS  30          1HB       HIS  30  -8.915  -4.864  -5.454
  249    HD1  HIS  30           HD1      HIS  30 -10.934  -1.716  -5.679
  250    HD2  HIS  30           HD2      HIS  30 -11.357  -5.778  -6.447
  251    HE1  HIS  30           HE1      HIS  30 -13.394  -2.076  -6.056
  252    HE2  HIS  30           HE2      HIS  30 -13.632  -4.550  -6.472
  253    H    LYS  31           H        LYS  31  -7.841  -4.565  -3.177
  254    HA   LYS  31           HA       LYS  31 -10.035  -4.451  -1.407
  255   1HB   LYS  31          2HB       LYS  31  -7.984  -6.180  -1.741
  256   2HB   LYS  31          1HB       LYS  31  -7.422  -5.323  -0.313
  257   1HG   LYS  31          2HG       LYS  31  -9.377  -5.933   0.913
  258   2HG   LYS  31          1HG       LYS  31 -10.139  -6.593  -0.534
  259   1HD   LYS  31          2HD       LYS  31  -8.957  -8.519  -0.445
  260   2HD   LYS  31          1HD       LYS  31  -7.506  -7.726   0.172
  261   1HE   LYS  31          2HE       LYS  31  -8.085  -8.055   2.325
  262   2HE   LYS  31          1HE       LYS  31  -9.794  -7.757   2.018
  263   1HZ   LYS  31          1HZ       LYS  31 -10.155  -9.946   1.419
  264   2HZ   LYS  31          2HZ       LYS  31  -9.045 -10.106   2.685
  265   3HZ   LYS  31          3HZ       LYS  31  -8.524 -10.250   1.081
  266    H    VAL  32           H        VAL  32  -6.753  -3.055  -1.143
  267    HA   VAL  32           HA       VAL  32  -7.185  -1.836   1.365
  268    HB   VAL  32           HB       VAL  32  -5.256  -0.920  -0.773
  269   1HG1  VAL  32          1HG1      VAL  32  -5.284  -0.492   2.215
  270   2HG1  VAL  32          2HG1      VAL  32  -5.571   0.732   0.977
  271   3HG1  VAL  32          3HG1      VAL  32  -3.980  -0.013   1.128
  272   1HG2  VAL  32          1HG2      VAL  32  -5.297  -3.401   0.369
  273   2HG2  VAL  32          2HG2      VAL  32  -4.226  -2.518   1.454
  274   3HG2  VAL  32          3HG2      VAL  32  -3.861  -2.601  -0.269
  275    H    THR  33           H        THR  33  -7.620  -0.637  -1.944
  276    HA   THR  33           HA       THR  33  -8.176   2.036  -1.286
  277    HB   THR  33           HB       THR  33  -9.143   0.391  -3.636
  278    HG1  THR  33           HG1      THR  33  -6.916   2.118  -3.303
  279   1HG2  THR  33          1HG2      THR  33  -8.851   3.366  -3.653
  280   2HG2  THR  33          2HG2      THR  33 -10.368   2.601  -3.182
  281   3HG2  THR  33          3HG2      THR  33  -9.703   2.317  -4.789
  282    H    THR  34           H        THR  34 -10.298  -0.812  -1.482
  283    HA   THR  34           HA       THR  34 -12.698   0.686  -1.061
  284    HB   THR  34           HB       THR  34 -12.317  -2.261  -0.523
  285    HG1  THR  34           HG1      THR  34 -12.701  -0.878  -2.951
  286   1HG2  THR  34          1HG2      THR  34 -14.776  -1.756  -1.739
  287   2HG2  THR  34          2HG2      THR  34 -14.601  -0.535  -0.481
  288   3HG2  THR  34          3HG2      THR  34 -14.477  -2.244  -0.069
  289    H    VAL  35           H        VAL  35 -10.519  -1.124   1.082
  290    HA   VAL  35           HA       VAL  35 -12.121  -0.914   3.396
  291    HB   VAL  35           HB       VAL  35  -9.106  -1.130   3.290
  292   1HG1  VAL  35          1HG1      VAL  35 -10.026  -0.465   5.480
  293   2HG1  VAL  35          2HG1      VAL  35  -9.282  -2.062   5.517
  294   3HG1  VAL  35          3HG1      VAL  35 -11.038  -1.909   5.474
  295   1HG2  VAL  35          1HG2      VAL  35  -9.271  -3.287   2.742
  296   2HG2  VAL  35          2HG2      VAL  35 -10.932  -2.933   2.268
  297   3HG2  VAL  35          3HG2      VAL  35 -10.591  -3.561   3.881
  298    H    PHE  36           H        PHE  36  -9.259   1.010   2.423
  299    HA   PHE  36           HA       PHE  36  -9.810   2.943   4.508
  300   1HB   PHE  36          2HB       PHE  36  -7.653   2.840   2.398
  301   2HB   PHE  36          1HB       PHE  36  -7.762   4.070   3.652
  302    HD1  PHE  36           HD2      PHE  36  -7.422   3.462   6.017
  303    HD2  PHE  36           HD1      PHE  36  -6.817   0.662   2.867
  304    HE1  PHE  36           HE2      PHE  36  -6.141   2.022   7.546
  305    HE2  PHE  36           HE1      PHE  36  -5.536  -0.781   4.393
  306    HZ   PHE  36           HZ       PHE  36  -5.198  -0.101   6.732
  307    H    GLY  37           H        GLY  37 -10.945   2.553   1.353
  308   1HA   GLY  37          2HA       GLY  37 -12.440   3.981   0.265
  309   2HA   GLY  37          1HA       GLY  37 -11.970   5.270   1.361
  310    H    GLN  38           H        GLN  38 -12.230   6.119  -1.093
  311    HA   GLN  38           HA       GLN  38  -9.466   6.442  -2.035
  312   1HB   GLN  38          2HB       GLN  38 -10.317   6.445  -4.398
  313   2HB   GLN  38          1HB       GLN  38 -10.367   4.882  -3.599
  314   1HG   GLN  38          2HG       GLN  38 -12.474   4.727  -4.255
  315   2HG   GLN  38          1HG       GLN  38 -12.857   5.986  -3.082
  316   1HE2  GLN  38          1HE2      GLN  38 -11.405   5.793  -6.327
  317   2HE2  GLN  38          2HE2      GLN  38 -12.340   7.079  -7.003
  318    HA   PRO  39           HA       PRO  39  -8.696   7.426  -3.875
  319   1HB   PRO  39          2HB       PRO  39  -7.172   9.519  -4.503
  320   2HB   PRO  39          1HB       PRO  39  -8.680   9.195  -5.368
  321   1HG   PRO  39          2HG       PRO  39  -8.106  11.213  -3.246
  322   2HG   PRO  39          1HG       PRO  39  -9.133  11.354  -4.684
  323   1HD   PRO  39          2HD       PRO  39 -10.015  10.812  -2.085
  324   2HD   PRO  39          1HD       PRO  39 -10.950  10.560  -3.572
  325    H    LEU  40           H        LEU  40  -6.573   6.867  -3.323
  326    HA   LEU  40           HA       LEU  40  -5.404   8.106  -0.937
  327   1HB   LEU  40          2HB       LEU  40  -6.098   5.210  -1.304
  328   2HB   LEU  40          1HB       LEU  40  -4.760   5.678  -0.272
  329    HG   LEU  40           HG       LEU  40  -7.574   6.694   0.112
  330   1HD1  LEU  40          1HD1      LEU  40  -7.178   4.147   0.318
  331   2HD1  LEU  40          2HD1      LEU  40  -8.010   4.994   1.622
  332   3HD1  LEU  40          3HD1      LEU  40  -6.308   4.569   1.792
  333   1HD2  LEU  40          1HD2      LEU  40  -5.363   7.806   1.062
  334   2HD2  LEU  40          2HD2      LEU  40  -5.538   6.532   2.269
  335   3HD2  LEU  40          3HD2      LEU  40  -6.838   7.697   2.022
  336    H    ASP  41           H        ASP  41  -3.112   7.661  -0.671
  337    HA   ASP  41           HA       ASP  41  -1.802   6.973  -3.223
  338   1HB   ASP  41          2HB       ASP  41  -1.217   9.069  -1.168
  339   2HB   ASP  41          1HB       ASP  41   0.122   8.384  -2.084
  340    H    LEU  42           H        LEU  42  -0.729   5.113  -3.193
  341    HA   LEU  42           HA       LEU  42  -0.099   3.788  -0.709
  342   1HB   LEU  42          2HB       LEU  42   0.558   2.982  -3.547
  343   2HB   LEU  42          1HB       LEU  42   0.704   1.960  -2.129
  344    HG   LEU  42           HG       LEU  42  -1.926   3.116  -3.046
  345   1HD1  LEU  42          1HD1      LEU  42  -1.393   0.264  -3.508
  346   2HD1  LEU  42          2HD1      LEU  42  -0.498   1.375  -4.547
  347   3HD1  LEU  42          3HD1      LEU  42  -2.260   1.438  -4.499
  348   1HD2  LEU  42          1HD2      LEU  42  -2.729   1.088  -1.712
  349   2HD2  LEU  42          2HD2      LEU  42  -2.105   2.465  -0.804
  350   3HD2  LEU  42          3HD2      LEU  42  -1.097   1.038  -1.043
  351    H    HIS  43           H        HIS  43   1.550   4.748   0.388
  352    HA   HIS  43           HA       HIS  43   4.036   5.328  -1.064
  353   1HB   HIS  43          2HB       HIS  43   2.685   6.507   1.272
  354   2HB   HIS  43          1HB       HIS  43   4.428   6.330   1.449
  355    HD1  HIS  43           HD1      HIS  43   5.238   8.666   1.126
  356    HD2  HIS  43           HD2      HIS  43   2.544   7.518  -1.822
  357    HE1  HIS  43           HE1      HIS  43   5.220  10.551  -0.538
  358    HE2  HIS  43           HE2      HIS  43   3.626   9.808  -2.343
  359    H    TYR  44           H        TYR  44   5.474   3.736  -1.045
  360    HA   TYR  44           HA       TYR  44   5.582   1.866   1.197
  361   1HB   TYR  44          2HB       TYR  44   5.511   0.798  -0.937
  362   2HB   TYR  44          1HB       TYR  44   6.753   1.856  -1.588
  363    HD1  TYR  44           HD1      TYR  44   9.117   1.566  -0.854
  364    HD2  TYR  44           HD2      TYR  44   6.072  -1.206   0.209
  365    HE1  TYR  44           HE1      TYR  44  10.838  -0.108  -0.315
  366    HE2  TYR  44           HE2      TYR  44   7.782  -2.886   0.757
  367    HH   TYR  44           HH       TYR  44  10.343  -2.737   1.499
  368    H    MET  45           H        MET  45   6.936   2.315   2.820
  369    HA   MET  45           HA       MET  45   9.295   3.981   2.293
  370   1HB   MET  45          2HB       MET  45   7.413   4.275   4.207
  371   2HB   MET  45          1HB       MET  45   8.570   3.279   5.078
  372   1HG   MET  45          2HG       MET  45  10.334   4.935   4.490
  373   2HG   MET  45          1HG       MET  45   9.072   5.958   3.808
  374   1HE   MET  45          1HE       MET  45   7.059   7.206   5.636
  375   2HE   MET  45          2HE       MET  45   8.513   7.802   4.836
  376   3HE   MET  45          3HE       MET  45   8.249   8.135   6.546
  377    H    ASN  46           H        ASN  46  11.262   3.113   2.259
  378    HA   ASN  46           HA       ASN  46  11.621   0.312   2.855
  379   1HB   ASN  46          2HB       ASN  46  13.024   2.350   1.354
  380   2HB   ASN  46          1HB       ASN  46  14.142   1.470   2.392
  381   1HD2  ASN  46          1HD2      ASN  46  13.782   1.493  -0.549
  382   2HD2  ASN  46          2HD2      ASN  46  13.562  -0.162  -0.989
  383    H    ASN  47           H        ASN  47  12.668   3.396   4.223
  384    HA   ASN  47           HA       ASN  47  12.848   2.377   6.848
  385   1HB   ASN  47          2HB       ASN  47  15.093   1.740   5.382
  386   2HB   ASN  47          1HB       ASN  47  15.571   3.238   6.171
  387   1HD2  ASN  47          1HD2      ASN  47  14.970  -0.101   6.548
  388   2HD2  ASN  47          2HD2      ASN  47  15.312  -0.205   8.239
  389    H    GLU  48           H        GLU  48  14.663   4.777   4.932
  390    HA   GLU  48           HA       GLU  48  13.660   6.868   6.745
  391   1HB   GLU  48          2HB       GLU  48  16.283   6.262   5.773
  392   2HB   GLU  48          1HB       GLU  48  15.812   7.850   5.183
  393   1HG   GLU  48          2HG       GLU  48  15.202   7.428   8.004
  394   2HG   GLU  48          1HG       GLU  48  16.919   7.313   7.621
  395    H    LEU  49           H        LEU  49  13.945   5.892   3.387
  396    HA   LEU  49           HA       LEU  49  12.650   8.386   2.531
  397   1HB   LEU  49          2HB       LEU  49  14.733   6.750   1.415
  398   2HB   LEU  49          1HB       LEU  49  13.392   6.828   0.290
  399    HG   LEU  49           HG       LEU  49  15.099   8.547  -0.144
  400   1HD1  LEU  49          1HD1      LEU  49  12.688  10.023   0.806
  401   2HD1  LEU  49          2HD1      LEU  49  12.531   8.824  -0.477
  402   3HD1  LEU  49          3HD1      LEU  49  13.607  10.206  -0.688
  403   1HD2  LEU  49          1HD2      LEU  49  15.362  10.428   1.392
  404   2HD2  LEU  49          2HD2      LEU  49  15.854   8.913   2.146
  405   3HD2  LEU  49          3HD2      LEU  49  14.297   9.635   2.554
  406    H    SER  50           H        SER  50  10.918   8.279   1.001
  407    HA   SER  50           HA       SER  50   9.353   5.788   1.182
  408   1HB   SER  50          2HB       SER  50   8.447   7.875   2.349
  409   2HB   SER  50          1HB       SER  50   8.186   8.537   0.736
  410    HG   SER  50           HG       SER  50   6.806   6.571   2.086
  411    H    ILE  51           H        ILE  51   8.687   4.830  -0.646
  412    HA   ILE  51           HA       ILE  51   9.014   6.280  -3.196
  413    HB   ILE  51           HB       ILE  51   9.518   3.325  -2.824
  414   1HG1  ILE  51          2HG1      ILE  51  11.632   5.445  -3.237
  415   2HG1  ILE  51          1HG1      ILE  51  11.185   4.852  -1.641
  416   1HG2  ILE  51          1HG2      ILE  51  10.804   3.991  -5.081
  417   2HG2  ILE  51          2HG2      ILE  51   9.497   5.174  -5.125
  418   3HG2  ILE  51          3HG2      ILE  51   9.125   3.454  -5.045
  419   1HD1  ILE  51          1HD1      ILE  51  13.209   3.831  -2.928
  420   2HD1  ILE  51          2HD1      ILE  51  11.958   2.895  -3.746
  421   3HD1  ILE  51          3HD1      ILE  51  12.131   2.797  -1.992
  422    H    LEU  52           H        LEU  52   7.316   6.174  -4.591
  423    HA   LEU  52           HA       LEU  52   4.881   4.910  -3.670
  424   1HB   LEU  52          2HB       LEU  52   5.030   7.209  -4.736
  425   2HB   LEU  52          1HB       LEU  52   5.296   6.389  -6.263
  426    HG   LEU  52           HG       LEU  52   2.879   5.677  -4.659
  427   1HD1  LEU  52          1HD1      LEU  52   2.577   7.870  -6.610
  428   2HD1  LEU  52          2HD1      LEU  52   3.300   8.290  -5.058
  429   3HD1  LEU  52          3HD1      LEU  52   1.702   7.547  -5.114
  430   1HD2  LEU  52          1HD2      LEU  52   1.974   5.573  -7.051
  431   2HD2  LEU  52          2HD2      LEU  52   3.141   4.345  -6.561
  432   3HD2  LEU  52          3HD2      LEU  52   3.658   5.705  -7.556
  433    H    LEU  53           H        LEU  53   3.979   3.074  -4.423
  434    HA   LEU  53           HA       LEU  53   5.504   1.485  -6.319
  435   1HB   LEU  53          2HB       LEU  53   2.947   0.690  -4.935
  436   2HB   LEU  53          1HB       LEU  53   4.152  -0.362  -5.650
  437    HG   LEU  53           HG       LEU  53   4.686   1.361  -3.231
  438   1HD1  LEU  53          1HD1      LEU  53   4.016  -1.577  -3.282
  439   2HD1  LEU  53          2HD1      LEU  53   2.886  -0.302  -2.822
  440   3HD1  LEU  53          3HD1      LEU  53   4.342  -0.578  -1.865
  441   1HD2  LEU  53          1HD2      LEU  53   6.610   0.564  -4.664
  442   2HD2  LEU  53          2HD2      LEU  53   6.166  -1.076  -4.194
  443   3HD2  LEU  53          3HD2      LEU  53   6.662   0.091  -2.967
  444    H    LYS  54           H        LYS  54   5.154   1.809  -8.415
  445    HA   LYS  54           HA       LYS  54   2.707   2.900  -9.424
  446   1HB   LYS  54          2HB       LYS  54   5.224   3.026 -10.301
  447   2HB   LYS  54          1HB       LYS  54   4.681   1.666 -11.270
  448   1HG   LYS  54          2HG       LYS  54   3.911   3.151 -12.724
  449   2HG   LYS  54          1HG       LYS  54   2.655   3.534 -11.547
  450   1HD   LYS  54          2HD       LYS  54   4.173   5.238 -10.561
  451   2HD   LYS  54          1HD       LYS  54   5.332   4.898 -11.847
  452   1HE   LYS  54          2HE       LYS  54   4.181   6.774 -12.618
  453   2HE   LYS  54          1HE       LYS  54   3.407   5.432 -13.457
  454   1HZ   LYS  54          1HZ       LYS  54   1.787   5.509 -11.457
  455   2HZ   LYS  54          2HZ       LYS  54   1.620   6.644 -12.701
  456   3HZ   LYS  54          3HZ       LYS  54   2.371   7.083 -11.251
  457    H    ASN  55           H        ASN  55   4.376  -0.142 -10.248
  458    HA   ASN  55           HA       ASN  55   1.767  -1.475 -10.364
  459   1HB   ASN  55          2HB       ASN  55   2.323  -2.565 -12.477
  460   2HB   ASN  55          1HB       ASN  55   2.362  -0.819 -12.669
  461   1HD2  ASN  55          1HD2      ASN  55   4.389   0.231 -12.852
  462   2HD2  ASN  55          2HD2      ASN  55   5.787  -0.639 -13.377
  463    H    GLN  56           H        GLN  56   2.559  -3.998 -11.144
  464    HA   GLN  56           HA       GLN  56   3.450  -5.139  -8.784
  465   1HB   GLN  56          2HB       GLN  56   2.330  -6.226 -10.868
  466   2HB   GLN  56          1HB       GLN  56   3.984  -6.494 -11.403
  467   1HG   GLN  56          2HG       GLN  56   3.975  -8.364 -10.222
  468   2HG   GLN  56          1HG       GLN  56   3.963  -7.367  -8.769
  469   1HE2  GLN  56          1HE2      GLN  56   2.878  -9.221  -7.838
  470   2HE2  GLN  56          2HE2      GLN  56   1.168  -9.384  -8.031
  471    H    ASP  57           H        ASP  57   5.347  -3.917 -11.477
  472    HA   ASP  57           HA       ASP  57   7.771  -5.192 -11.035
  473   1HB   ASP  57          2HB       ASP  57   7.285  -3.680 -12.956
  474   2HB   ASP  57          1HB       ASP  57   7.421  -2.305 -11.868
  475    H    ASP  58           H        ASP  58   6.455  -2.303  -9.448
  476    HA   ASP  58           HA       ASP  58   8.760  -1.720  -7.905
  477   1HB   ASP  58          2HB       ASP  58   5.955  -0.808  -7.990
  478   2HB   ASP  58          1HB       ASP  58   6.714  -0.698  -6.406
  479    H    LEU  59           H        LEU  59   5.759  -3.471  -7.136
  480    HA   LEU  59           HA       LEU  59   6.441  -4.111  -4.476
  481   1HB   LEU  59          2HB       LEU  59   4.153  -4.208  -5.445
  482   2HB   LEU  59          1HB       LEU  59   4.626  -5.636  -6.344
  483    HG   LEU  59           HG       LEU  59   5.176  -5.970  -3.523
  484   1HD1  LEU  59          1HD1      LEU  59   2.254  -5.805  -4.054
  485   2HD1  LEU  59          2HD1      LEU  59   3.133  -4.327  -3.658
  486   3HD1  LEU  59          3HD1      LEU  59   3.137  -5.685  -2.531
  487   1HD2  LEU  59          1HD2      LEU  59   4.690  -7.576  -5.625
  488   2HD2  LEU  59          2HD2      LEU  59   3.092  -7.555  -4.878
  489   3HD2  LEU  59          3HD2      LEU  59   4.495  -8.076  -3.946
  490    H    ASP  60           H        ASP  60   6.972  -5.808  -7.539
  491    HA   ASP  60           HA       ASP  60   7.914  -8.233  -6.473
  492   1HB   ASP  60          2HB       ASP  60   8.183  -6.853  -9.113
  493   2HB   ASP  60          1HB       ASP  60   9.219  -8.236  -8.776
  494    H    LYS  61           H        LYS  61   9.621  -5.255  -7.371
  495    HA   LYS  61           HA       LYS  61  12.224  -6.213  -6.853
  496   1HB   LYS  61          2HB       LYS  61  10.970  -3.646  -7.443
  497   2HB   LYS  61          1HB       LYS  61  12.317  -3.491  -6.321
  498   1HG   LYS  61          2HG       LYS  61  13.667  -4.860  -7.965
  499   2HG   LYS  61          1HG       LYS  61  12.339  -4.618  -9.101
  500   1HD   LYS  61          2HD       LYS  61  13.263  -2.163  -7.791
  501   2HD   LYS  61          1HD       LYS  61  14.480  -2.947  -8.800
  502   1HE   LYS  61          2HE       LYS  61  13.500  -1.806 -10.472
  503   2HE   LYS  61          1HE       LYS  61  12.306  -3.100 -10.412
  504   1HZ   LYS  61          1HZ       LYS  61  12.084  -0.328  -9.540
  505   2HZ   LYS  61          2HZ       LYS  61  11.295  -1.480  -8.588
  506   3HZ   LYS  61          3HZ       LYS  61  10.919  -1.342 -10.232
  507    H    ALA  62           H        ALA  62   9.763  -4.741  -4.801
  508    HA   ALA  62           HA       ALA  62  11.359  -4.269  -2.529
  509   1HB   ALA  62          1HB       ALA  62   8.987  -4.661  -1.385
  510   2HB   ALA  62          2HB       ALA  62   8.452  -4.501  -3.058
  511   3HB   ALA  62          3HB       ALA  62   9.367  -3.200  -2.297
  512    H    ILE  63           H        ILE  63   9.578  -7.143  -3.593
  513    HA   ILE  63           HA       ILE  63   9.905  -8.649  -1.223
  514    HB   ILE  63           HB       ILE  63   9.654  -9.733  -4.035
  515   1HG1  ILE  63          2HG1      ILE  63   7.335  -9.464  -2.161
  516   2HG1  ILE  63          1HG1      ILE  63   7.871  -8.044  -3.050
  517   1HG2  ILE  63          1HG2      ILE  63   9.353 -11.785  -3.157
  518   2HG2  ILE  63          2HG2      ILE  63   8.483 -11.175  -1.750
  519   3HG2  ILE  63          3HG2      ILE  63  10.245 -11.122  -1.789
  520   1HD1  ILE  63          1HD1      ILE  63   7.643 -10.285  -4.822
  521   2HD1  ILE  63          2HD1      ILE  63   6.822  -8.725  -4.869
  522   3HD1  ILE  63          3HD1      ILE  63   6.144 -10.049  -3.923
  523    H    ASP  64           H        ASP  64  11.829  -8.436  -4.197
  524    HA   ASP  64           HA       ASP  64  13.708 -10.413  -3.637
  525   1HB   ASP  64          2HB       ASP  64  13.374  -9.019  -5.787
  526   2HB   ASP  64          1HB       ASP  64  14.451  -7.849  -5.031
  527    H    ILE  65           H        ILE  65  13.685  -6.986  -2.710
  528    HA   ILE  65           HA       ILE  65  16.240  -7.031  -1.455
  529    HB   ILE  65           HB       ILE  65  13.963  -5.126  -0.885
  530   1HG1  ILE  65          2HG1      ILE  65  16.237  -4.612  -2.793
  531   2HG1  ILE  65          1HG1      ILE  65  14.751  -5.381  -3.336
  532   1HG2  ILE  65          1HG2      ILE  65  16.808  -5.258  -0.091
  533   2HG2  ILE  65          2HG2      ILE  65  15.421  -4.565   0.752
  534   3HG2  ILE  65          3HG2      ILE  65  16.195  -3.672  -0.558
  535   1HD1  ILE  65          1HD1      ILE  65  13.465  -3.461  -2.767
  536   2HD1  ILE  65          2HD1      ILE  65  14.855  -2.927  -3.715
  537   3HD1  ILE  65          3HD1      ILE  65  14.843  -2.712  -1.964
  538    H    LEU  66           H        LEU  66  12.938  -7.553  -0.310
  539    HA   LEU  66           HA       LEU  66  13.458  -7.573   2.444
  540   1HB   LEU  66          2HB       LEU  66  11.220  -7.707   1.021
  541   2HB   LEU  66          1HB       LEU  66  11.413  -9.424   1.319
  542    HG   LEU  66           HG       LEU  66  11.375  -9.035   3.731
  543   1HD1  LEU  66          1HD1      LEU  66  12.201  -7.002   4.291
  544   2HD1  LEU  66          2HD1      LEU  66  10.490  -6.572   4.265
  545   3HD1  LEU  66          3HD1      LEU  66  11.510  -6.207   2.876
  546   1HD2  LEU  66          1HD2      LEU  66   9.152  -8.182   1.972
  547   2HD2  LEU  66          2HD2      LEU  66   8.991  -7.838   3.693
  548   3HD2  LEU  66          3HD2      LEU  66   9.234  -9.497   3.145
  549    H    ASP  67           H        ASP  67  13.475 -10.231   0.070
  550    HA   ASP  67           HA       ASP  67  14.040 -12.321   1.863
  551   1HB   ASP  67          2HB       ASP  67  14.428 -11.952  -1.089
  552   2HB   ASP  67          1HB       ASP  67  15.132 -13.353  -0.293
  553    H    ARG  68           H        ARG  68  16.135 -10.032   0.206
  554    HA   ARG  68           HA       ARG  68  18.607 -11.256   0.767
  555   1HB   ARG  68          2HB       ARG  68  17.946  -9.203  -0.769
  556   2HB   ARG  68          1HB       ARG  68  18.383  -8.281   0.663
  557   1HG   ARG  68          2HG       ARG  68  20.570  -9.641   0.603
  558   2HG   ARG  68          1HG       ARG  68  20.107 -10.016  -1.059
  559   1HD   ARG  68          2HD       ARG  68  19.821  -7.193  -0.473
  560   2HD   ARG  68          1HD       ARG  68  21.463  -7.757  -0.169
  561    HE   ARG  68           HE       ARG  68  20.164  -7.481  -2.715
  562   1HH1  ARG  68          1HH1      ARG  68  22.695  -9.176  -0.981
  563   2HH1  ARG  68          2HH1      ARG  68  23.624  -9.501  -2.406
  564   1HH2  ARG  68          1HH2      ARG  68  21.393  -7.914  -4.586
  565   2HH2  ARG  68          2HH2      ARG  68  22.884  -8.784  -4.453
  566    H    SER  69           H        SER  69  16.543  -9.145   2.683
  567    HA   SER  69           HA       SER  69  18.492  -8.569   4.689
  568   1HB   SER  69          2HB       SER  69  16.514  -7.135   4.292
  569   2HB   SER  69          1HB       SER  69  15.473  -8.433   4.879
  570    HG   SER  69           HG       SER  69  17.358  -6.891   6.314
  571    H    SER  70           H        SER  70  18.605  -9.369   6.828
  572    HA   SER  70           HA       SER  70  18.112 -12.204   7.034
  573   1HB   SER  70          2HB       SER  70  19.196 -10.414   9.211
  574   2HB   SER  70          1HB       SER  70  19.455 -12.145   8.996
  575    HG   SER  70           HG       SER  70  20.689  -9.992   7.759
  576    H    SER  71           H        SER  71  16.755  -9.256   8.395
  577    HA   SER  71           HA       SER  71  15.222 -10.577  10.413
  578   1HB   SER  71          2HB       SER  71  14.043  -8.364  10.599
  579   2HB   SER  71          1HB       SER  71  15.795  -8.271  10.773
  580    HG   SER  71           HG       SER  71  15.917  -7.154   8.976
  581    H    MET  72           H        MET  72  14.016  -8.704   7.610
  582    HA   MET  72           HA       MET  72  12.130  -8.901   6.350
  583   1HB   MET  72          2HB       MET  72  13.373 -10.845   5.501
  584   2HB   MET  72          1HB       MET  72  12.667 -11.852   6.758
  585   1HG   MET  72          2HG       MET  72  10.697 -12.056   5.681
  586   2HG   MET  72          1HG       MET  72  10.755 -10.416   5.038
  587   1HE   MET  72          1HE       MET  72  10.335 -13.075   2.128
  588   2HE   MET  72          2HE       MET  72   9.584 -12.702   3.681
  589   3HE   MET  72          3HE       MET  72  10.708 -14.055   3.546
  590    H    LYS  73           H        LYS  73  10.831  -7.945   8.031
  591    HA   LYS  73           HA       LYS  73   8.913  -9.857   9.183
  592   1HB   LYS  73          2HB       LYS  73   8.711  -8.195  11.115
  593   2HB   LYS  73          1HB       LYS  73  10.161  -9.186  11.066
  594   1HG   LYS  73          2HG       LYS  73  11.525  -7.419  10.620
  595   2HG   LYS  73          1HG       LYS  73  10.272  -6.526   9.760
  596   1HD   LYS  73          2HD       LYS  73  10.514  -5.290  11.705
  597   2HD   LYS  73          1HD       LYS  73   9.150  -6.340  12.093
  598   1HE   LYS  73          2HE       LYS  73  10.601  -7.839  13.314
  599   2HE   LYS  73          1HE       LYS  73  12.018  -6.908  12.835
  600   1HZ   LYS  73          1HZ       LYS  73  11.371  -5.117  14.183
  601   2HZ   LYS  73          2HZ       LYS  73  11.112  -6.487  15.139
  602   3HZ   LYS  73          3HZ       LYS  73   9.803  -5.715  14.398
  603    H    SER  74           H        SER  74   7.525  -9.457   7.416
  604    HA   SER  74           HA       SER  74   5.729  -8.499   6.406
  605   1HB   SER  74          2HB       SER  74   5.095  -8.011   8.820
  606   2HB   SER  74          1HB       SER  74   5.762  -6.399   8.579
  607    HG   SER  74           HG       SER  74   3.355  -7.335   7.879
  608    H    LEU  75           H        LEU  75   4.911  -6.141   5.641
  609    HA   LEU  75           HA       LEU  75   7.293  -4.843   4.494
  610   1HB   LEU  75          2HB       LEU  75   4.523  -5.300   3.447
  611   2HB   LEU  75          1HB       LEU  75   5.489  -3.977   2.821
  612    HG   LEU  75           HG       LEU  75   7.285  -5.862   2.443
  613   1HD1  LEU  75          1HD1      LEU  75   6.468  -7.817   3.239
  614   2HD1  LEU  75          2HD1      LEU  75   5.755  -7.892   1.628
  615   3HD1  LEU  75          3HD1      LEU  75   4.787  -7.346   2.998
  616   1HD2  LEU  75          1HD2      LEU  75   6.773  -5.717   0.240
  617   2HD2  LEU  75          2HD2      LEU  75   5.692  -4.450   0.822
  618   3HD2  LEU  75          3HD2      LEU  75   5.065  -6.067   0.498
  619    H    ARG  76           H        ARG  76   7.673  -2.741   4.871
  620    HA   ARG  76           HA       ARG  76   5.874  -1.321   6.659
  621   1HB   ARG  76          2HB       ARG  76   8.707  -1.008   5.794
  622   2HB   ARG  76          1HB       ARG  76   7.855   0.442   6.313
  623   1HG   ARG  76          2HG       ARG  76   7.237  -0.864   8.407
  624   2HG   ARG  76          1HG       ARG  76   8.447  -2.039   7.890
  625   1HD   ARG  76          2HD       ARG  76  10.154  -0.722   8.495
  626   2HD   ARG  76          1HD       ARG  76   9.396   0.725   7.830
  627    HE   ARG  76           HE       ARG  76   8.706   1.248   9.935
  628   1HH1  ARG  76          1HH1      ARG  76   9.328  -2.197   9.832
  629   2HH1  ARG  76          2HH1      ARG  76   9.035  -2.427  11.524
  630   1HH2  ARG  76          1HH2      ARG  76   8.315   0.940  12.164
  631   2HH2  ARG  76          2HH2      ARG  76   8.460  -0.643  12.848
  632    H    ILE  77           H        ILE  77   4.119  -0.850   5.310
  633    HA   ILE  77           HA       ILE  77   4.653   1.207   3.263
  634    HB   ILE  77           HB       ILE  77   2.315  -0.699   3.217
  635   1HG1  ILE  77          2HG1      ILE  77   4.902  -0.865   1.650
  636   2HG1  ILE  77          1HG1      ILE  77   4.410  -1.962   2.936
  637   1HG2  ILE  77          1HG2      ILE  77   3.402   1.327   1.279
  638   2HG2  ILE  77          2HG2      ILE  77   1.797   1.255   2.006
  639   3HG2  ILE  77          3HG2      ILE  77   2.272   0.061   0.799
  640   1HD1  ILE  77          1HD1      ILE  77   2.818  -1.585   0.418
  641   2HD1  ILE  77          2HD1      ILE  77   2.666  -2.863   1.626
  642   3HD1  ILE  77          3HD1      ILE  77   4.091  -2.795   0.587
  643    H    LEU  78           H        LEU  78   3.719   3.121   3.603
  644    HA   LEU  78           HA       LEU  78   1.511   3.273   5.555
  645   1HB   LEU  78          2HB       LEU  78   3.683   4.289   6.263
  646   2HB   LEU  78          1HB       LEU  78   3.553   5.402   4.917
  647    HG   LEU  78           HG       LEU  78   1.136   5.556   6.425
  648   1HD1  LEU  78          1HD1      LEU  78   2.879   4.623   8.162
  649   2HD1  LEU  78          2HD1      LEU  78   1.750   5.905   8.598
  650   3HD1  LEU  78          3HD1      LEU  78   3.417   6.303   8.182
  651   1HD2  LEU  78          1HD2      LEU  78   2.199   7.284   4.975
  652   2HD2  LEU  78          2HD2      LEU  78   3.409   7.527   6.236
  653   3HD2  LEU  78          3HD2      LEU  78   1.711   7.875   6.563
  654    H    LEU  79           H        LEU  79  -0.381   3.774   4.648
  655    HA   LEU  79           HA       LEU  79  -0.401   5.170   2.075
  656   1HB   LEU  79          2HB       LEU  79  -2.747   4.493   1.915
  657   2HB   LEU  79          1HB       LEU  79  -1.686   3.120   2.164
  658    HG   LEU  79           HG       LEU  79  -2.415   3.687   4.730
  659   1HD1  LEU  79          1HD1      LEU  79  -4.486   4.547   4.939
  660   2HD1  LEU  79          2HD1      LEU  79  -5.051   3.852   3.420
  661   3HD1  LEU  79          3HD1      LEU  79  -4.082   5.328   3.411
  662   1HD2  LEU  79          1HD2      LEU  79  -4.068   1.930   2.938
  663   2HD2  LEU  79          2HD2      LEU  79  -3.669   1.699   4.641
  664   3HD2  LEU  79          3HD2      LEU  79  -2.420   1.515   3.410
  665    H    LEU  80           H        LEU  80  -0.979   7.235   1.870
  666    HA   LEU  80           HA       LEU  80  -2.165   8.571   4.212
  667   1HB   LEU  80          2HB       LEU  80  -0.537   9.859   2.026
  668   2HB   LEU  80          1HB       LEU  80  -1.070  10.598   3.522
  669    HG   LEU  80           HG       LEU  80   0.434   8.350   4.289
  670   1HD1  LEU  80          1HD1      LEU  80   2.165   9.959   2.477
  671   2HD1  LEU  80          2HD1      LEU  80   1.219   8.628   1.808
  672   3HD1  LEU  80          3HD1      LEU  80   2.388   8.321   3.092
  673   1HD2  LEU  80          1HD2      LEU  80   0.174  10.686   5.300
  674   2HD2  LEU  80          2HD2      LEU  80   1.478  11.161   4.211
  675   3HD2  LEU  80          3HD2      LEU  80   1.753   9.910   5.424
  676    H    SER  81           H        SER  81  -3.808  10.078   3.926
  677    HA   SER  81           HA       SER  81  -5.352   9.722   1.472
  678   1HB   SER  81          2HB       SER  81  -7.044  11.125   2.974
  679   2HB   SER  81          1HB       SER  81  -6.835   9.391   3.203
  680    HG   SER  81           HG       SER  81  -6.723  10.753   5.145
  681    H    GLN  82           H        GLN  82  -6.118  11.449   0.231
  682    HA   GLN  82           HA       GLN  82  -4.409  13.775   0.271
  683   1HB   GLN  82          2HB       GLN  82  -5.258  12.385  -1.797
  684   2HB   GLN  82          1HB       GLN  82  -6.643  13.463  -1.685
  685   1HG   GLN  82          2HG       GLN  82  -5.117  14.366  -3.272
  686   2HG   GLN  82          1HG       GLN  82  -5.081  15.388  -1.836
  687   1HE2  GLN  82          1HE2      GLN  82  -3.179  15.780  -0.899
  688   2HE2  GLN  82          2HE2      GLN  82  -1.692  14.992  -1.291
  689    H    ASP  83           H        ASP  83  -6.980  13.121   2.011
  690    HA   ASP  83           HA       ASP  83  -8.362  15.668   1.665
  691   1HB   ASP  83          2HB       ASP  83  -9.127  13.051   2.617
  692   2HB   ASP  83          1HB       ASP  83  -9.501  14.268   3.833
  693    H    ARG  84           H        ARG  84  -6.298  16.721   2.400
  694    HA   ARG  84           HA       ARG  84  -6.324  16.978   5.332
  695   1HB   ARG  84          2HB       ARG  84  -4.000  16.571   3.490
  696   2HB   ARG  84          1HB       ARG  84  -3.780  17.550   4.932
  697   1HG   ARG  84          2HG       ARG  84  -4.323  15.736   6.358
  698   2HG   ARG  84          1HG       ARG  84  -4.889  14.757   5.002
  699   1HD   ARG  84          2HD       ARG  84  -2.753  14.302   4.264
  700   2HD   ARG  84          1HD       ARG  84  -2.076  15.749   5.011
  701    HE   ARG  84           HE       ARG  84  -3.018  13.957   6.992
  702   1HH1  ARG  84          1HH1      ARG  84  -0.383  14.395   4.727
  703   2HH1  ARG  84          2HH1      ARG  84   0.747  13.495   5.681
  704   1HH2  ARG  84          1HH2      ARG  84  -1.522  12.770   8.239
  705   2HH2  ARG  84          2HH2      ARG  84   0.101  12.574   7.671
  706    H    ASN  85           H        ASN  85  -7.320  18.898   5.585
  707    HA   ASN  85           HA       ASN  85  -6.754  21.110   3.791
  708   1HB   ASN  85          2HB       ASN  85  -8.786  20.532   5.882
  709   2HB   ASN  85          1HB       ASN  85  -8.376  22.226   5.626
  710   1HD2  ASN  85          1HD2      ASN  85  -8.793  19.408   3.488
  711   2HD2  ASN  85          2HD2      ASN  85  -9.921  20.176   2.428
  712    H    LEU  86           H        LEU  86  -6.915  20.983   7.361
  713    HA   LEU  86           HA       LEU  86  -5.146  23.196   7.652
  714   1HB   LEU  86          2HB       LEU  86  -6.745  21.517   9.376
  715   2HB   LEU  86          1HB       LEU  86  -5.156  21.763  10.071
  716    HG   LEU  86           HG       LEU  86  -6.550  24.185   9.076
  717   1HD1  LEU  86          1HD1      LEU  86  -8.225  22.646  10.328
  718   2HD1  LEU  86          2HD1      LEU  86  -8.112  24.351  10.768
  719   3HD1  LEU  86          3HD1      LEU  86  -7.321  23.129  11.763
  720   1HD2  LEU  86          1HD2      LEU  86  -4.596  24.794  10.073
  721   2HD2  LEU  86          2HD2      LEU  86  -4.600  23.421  11.178
  722   3HD2  LEU  86          3HD2      LEU  86  -5.638  24.811  11.495
  723    H    GLU  87           H        GLU  87  -4.724  19.719   7.603
  724    HA   GLU  87           HA       GLU  87  -2.026  19.787   8.590
  725   1HB   GLU  87          2HB       GLU  87  -3.995  17.804   8.165
  726   2HB   GLU  87          1HB       GLU  87  -2.624  17.371   7.155
  727   1HG   GLU  87          2HG       GLU  87  -2.503  17.924  10.112
  728   2HG   GLU  87          1HG       GLU  87  -2.524  16.328   9.363
  729    H    HIS  88           H        HIS  88  -0.699  20.965   7.319
  730    HA   HIS  88           HA       HIS  88   0.284  19.786   4.939
  731   1HB   HIS  88          2HB       HIS  88  -1.945  21.278   4.427
  732   2HB   HIS  88          1HB       HIS  88  -0.681  22.487   4.228
  733    HD1  HIS  88           HD1      HIS  88   0.726  22.368   2.124
  734    HD2  HIS  88           HD2      HIS  88  -1.796  19.094   2.582
  735    HE1  HIS  88           HE1      HIS  88   0.824  21.130  -0.064
  736    HE2  HIS  88           HE2      HIS  88  -0.639  19.106   0.269
  737    H    HIS  89           H        HIS  89   1.437  20.519   7.354
  738    HA   HIS  89           HA       HIS  89   3.686  21.983   6.504
  739   1HB   HIS  89          2HB       HIS  89   3.458  23.956   8.023
  740   2HB   HIS  89          1HB       HIS  89   2.332  23.962   6.673
  741    HD1  HIS  89           HD1      HIS  89   1.473  25.741   8.802
  742    HD2  HIS  89           HD2      HIS  89   0.631  21.675   8.989
  743    HE1  HIS  89           HE1      HIS  89  -0.481  25.532  10.370
  744    HE2  HIS  89           HE2      HIS  89  -0.991  23.064  10.449
  745    H    HIS  90           H        HIS  90   5.315  22.248   8.187
  746    HA   HIS  90           HA       HIS  90   4.953  21.311  10.831
  747   1HB   HIS  90          2HB       HIS  90   4.774  19.150   9.519
  748   2HB   HIS  90          1HB       HIS  90   6.459  19.374   9.065
  749    HD1  HIS  90           HD1      HIS  90   7.888  17.913  10.447
  750    HD2  HIS  90           HD2      HIS  90   4.678  19.417  12.621
  751    HE1  HIS  90           HE1      HIS  90   8.163  17.001  12.775
  752    HE2  HIS  90           HE2      HIS  90   6.173  17.867  14.054
  753    H    HIS  91           H        HIS  91   7.388  21.336   8.213
  754    HA   HIS  91           HA       HIS  91   8.929  23.354   9.489
  755   1HB   HIS  91          2HB       HIS  91   9.435  21.129  10.755
  756   2HB   HIS  91          1HB       HIS  91  10.395  20.738   9.334
  757    HD1  HIS  91           HD1      HIS  91  10.191  24.163  10.947
  758    HD2  HIS  91           HD2      HIS  91  12.885  21.041  10.428
  759    HE1  HIS  91           HE1      HIS  91  12.392  25.024  11.806
  760    HE2  HIS  91           HE2      HIS  91  13.974  23.074  11.598
  761    H    HIS  92           H        HIS  92  10.149  24.403   8.037
  762    HA   HIS  92           HA       HIS  92  11.206  24.977   6.114
  763   1HB   HIS  92          2HB       HIS  92  12.500  22.883   6.475
  764   2HB   HIS  92          1HB       HIS  92  11.313  22.018   5.506
  765    HD1  HIS  92           HD1      HIS  92  11.775  21.909   3.064
  766    HD2  HIS  92           HD2      HIS  92  13.888  24.971   4.918
  767    HE1  HIS  92           HE1      HIS  92  13.292  22.847   1.291
  768    HE2  HIS  92           HE2      HIS  92  14.579  24.684   2.441
  769    H    HIS  93           H        HIS  93   9.859  26.069   4.846
  770    HA   HIS  93           HA       HIS  93   7.764  24.628   3.386
  771   1HB   HIS  93          2HB       HIS  93   6.806  26.876   2.939
  772   2HB   HIS  93          1HB       HIS  93   6.951  26.530   4.658
  773    HD1  HIS  93           HD1      HIS  93   9.018  28.311   1.993
  774    HD2  HIS  93           HD2      HIS  93   8.039  28.597   6.021
  775    HE1  HIS  93           HE1      HIS  93  10.111  30.423   2.801
  776    HE2  HIS  93           HE2      HIS  93   9.436  30.620   5.221
  Start of MODEL   20
    1    H    GLN   1           H        GLN   1   7.672 -19.217   2.986
    2    HA   GLN   1           HA       GLN   1   6.873 -21.272   3.637
    3   1HB   GLN   1          2HB       GLN   1   7.314 -20.356   6.168
    4   2HB   GLN   1          1HB       GLN   1   5.558 -20.320   6.107
    5   1HG   GLN   1          2HG       GLN   1   5.418 -22.521   6.314
    6   2HG   GLN   1          1HG       GLN   1   6.601 -22.792   5.036
    7   1HE2  GLN   1          1HE2      GLN   1   8.887 -21.813   5.969
    8   2HE2  GLN   1          2HE2      GLN   1   9.363 -22.597   7.433
    9    H    SER   2           H        SER   2   5.889 -19.152   2.062
   10    HA   SER   2           HA       SER   2   4.030 -18.515   0.942
   11   1HB   SER   2          2HB       SER   2   2.830 -20.779   2.536
   12   2HB   SER   2          1HB       SER   2   1.911 -19.858   1.344
   13    HG   SER   2           HG       SER   2   3.033 -20.753  -0.239
   14    H    ASP   3           H        ASP   3   1.983 -17.345   1.165
   15    HA   ASP   3           HA       ASP   3   0.650 -15.766   2.097
   16   1HB   ASP   3          2HB       ASP   3   1.116 -17.614   4.376
   17   2HB   ASP   3          1HB       ASP   3   0.488 -16.016   4.765
   18    H    VAL   4           H        VAL   4   1.322 -13.735   2.073
   19    HA   VAL   4           HA       VAL   4   3.689 -13.007   3.661
   20    HB   VAL   4           HB       VAL   4   2.487 -11.407   1.401
   21   1HG1  VAL   4          1HG1      VAL   4   5.152 -11.321   2.805
   22   2HG1  VAL   4          2HG1      VAL   4   3.883 -10.094   2.844
   23   3HG1  VAL   4          3HG1      VAL   4   4.762 -10.409   1.347
   24   1HG2  VAL   4          1HG2      VAL   4   3.126 -13.475   0.413
   25   2HG2  VAL   4          2HG2      VAL   4   4.632 -13.522   1.327
   26   3HG2  VAL   4          3HG2      VAL   4   4.410 -12.320   0.056
   27    H    ARG   5           H        ARG   5   3.519 -11.653   5.330
   28    HA   ARG   5           HA       ARG   5   0.912 -10.568   6.011
   29   1HB   ARG   5          2HB       ARG   5   3.509 -10.381   7.551
   30   2HB   ARG   5          1HB       ARG   5   1.902 -10.018   8.162
   31   1HG   ARG   5          2HG       ARG   5   1.732 -12.109   8.857
   32   2HG   ARG   5          1HG       ARG   5   1.809 -12.655   7.180
   33   1HD   ARG   5          2HD       ARG   5   4.388 -11.941   8.414
   34   2HD   ARG   5          1HD       ARG   5   3.588 -13.359   9.091
   35    HE   ARG   5           HE       ARG   5   3.470 -13.816   6.433
   36   1HH1  ARG   5          1HH1      ARG   5   6.115 -12.977   8.576
   37   2HH1  ARG   5          2HH1      ARG   5   7.306 -13.796   7.623
   38   1HH2  ARG   5          1HH2      ARG   5   5.046 -14.892   5.186
   39   2HH2  ARG   5          2HH2      ARG   5   6.700 -14.880   5.700
   40    H    ILE   6           H        ILE   6   0.313  -8.628   5.309
   41    HA   ILE   6           HA       ILE   6   2.381  -6.618   4.732
   42    HB   ILE   6           HB       ILE   6  -0.505  -6.517   3.858
   43   1HG1  ILE   6          2HG1      ILE   6   0.588  -8.549   2.953
   44   2HG1  ILE   6          1HG1      ILE   6   0.199  -7.382   1.694
   45   1HG2  ILE   6          1HG2      ILE   6   1.960  -4.952   3.226
   46   2HG2  ILE   6          2HG2      ILE   6   0.345  -4.381   3.643
   47   3HG2  ILE   6          3HG2      ILE   6   0.654  -5.065   2.048
   48   1HD1  ILE   6          1HD1      ILE   6   2.917  -7.781   2.924
   49   2HD1  ILE   6          2HD1      ILE   6   2.513  -6.661   1.621
   50   3HD1  ILE   6          3HD1      ILE   6   2.389  -8.401   1.359
   51    H    LYS   7           H        LYS   7   2.593  -4.903   6.011
   52    HA   LYS   7           HA       LYS   7   0.517  -4.378   8.014
   53   1HB   LYS   7          2HB       LYS   7   3.112  -4.731   8.469
   54   2HB   LYS   7          1HB       LYS   7   3.169  -3.014   8.098
   55   1HG   LYS   7          2HG       LYS   7   1.751  -2.473   9.907
   56   2HG   LYS   7          1HG       LYS   7   1.297  -4.161  10.153
   57   1HD   LYS   7          2HD       LYS   7   4.094  -3.087  10.515
   58   2HD   LYS   7          1HD       LYS   7   2.927  -3.277  11.825
   59   1HE   LYS   7          2HE       LYS   7   2.804  -5.737  10.787
   60   2HE   LYS   7          1HE       LYS   7   4.450  -5.322  10.317
   61   1HZ   LYS   7          1HZ       LYS   7   4.516  -4.574  12.847
   62   2HZ   LYS   7          2HZ       LYS   7   4.871  -6.154  12.360
   63   3HZ   LYS   7          3HZ       LYS   7   3.337  -5.785  12.972
   64    H    PHE   8           H        PHE   8  -0.874  -2.814   7.582
   65    HA   PHE   8           HA       PHE   8  -0.018  -0.572   5.873
   66   1HB   PHE   8          2HB       PHE   8  -2.764  -1.730   6.390
   67   2HB   PHE   8          1HB       PHE   8  -2.490  -0.228   5.514
   68    HD1  PHE   8           HD1      PHE   8  -0.588  -0.535   3.588
   69    HD2  PHE   8           HD2      PHE   8  -3.155  -3.577   5.098
   70    HE1  PHE   8           HE1      PHE   8  -0.313  -1.800   1.497
   71    HE2  PHE   8           HE2      PHE   8  -2.880  -4.848   3.010
   72    HZ   PHE   8           HZ       PHE   8  -1.459  -3.961   1.207
   73    H    GLU   9           H        GLU   9  -0.035   1.458   6.654
   74    HA   GLU   9           HA       GLU   9  -1.217   1.890   9.317
   75   1HB   GLU   9          2HB       GLU   9   1.411   2.733   8.173
   76   2HB   GLU   9          1HB       GLU   9   0.629   3.780   9.351
   77   1HG   GLU   9          2HG       GLU   9   1.103   2.424  11.059
   78   2HG   GLU   9          1HG       GLU   9   0.713   0.970  10.143
   79    H    HIS  10           H        HIS  10  -2.577   3.557   9.582
   80    HA   HIS  10           HA       HIS  10  -2.696   5.670   7.559
   81   1HB   HIS  10          2HB       HIS  10  -4.428   3.607   7.353
   82   2HB   HIS  10          1HB       HIS  10  -5.322   4.631   8.469
   83    HD1  HIS  10           HD1      HIS  10  -7.109   4.998   6.595
   84    HD2  HIS  10           HD2      HIS  10  -3.331   6.469   5.706
   85    HE1  HIS  10           HE1      HIS  10  -7.426   6.504   4.607
   86    HE2  HIS  10           HE2      HIS  10  -5.107   7.285   4.014
   87    H    ASN  11           H        ASN  11  -2.523   7.528   8.621
   88    HA   ASN  11           HA       ASN  11  -2.646   9.136  10.223
   89   1HB   ASN  11          2HB       ASN  11  -5.308   7.801  10.340
   90   2HB   ASN  11          1HB       ASN  11  -4.906   8.930  11.627
   91   1HD2  ASN  11          1HD2      ASN  11  -6.891   9.053   9.429
   92   2HD2  ASN  11          2HD2      ASN  11  -6.567  10.540   8.613
   93    H    GLY  12           H        GLY  12  -1.190   6.768  10.930
   94   1HA   GLY  12          2HA       GLY  12   0.031   6.386  12.917
   95   2HA   GLY  12          1HA       GLY  12  -1.305   7.049  13.842
   96    H    GLU  13           H        GLU  13  -3.267   5.346  12.351
   97    HA   GLU  13           HA       GLU  13  -3.324   3.162  14.134
   98   1HB   GLU  13          2HB       GLU  13  -5.214   4.325  12.705
   99   2HB   GLU  13          1HB       GLU  13  -4.810   3.075  11.538
  100   1HG   GLU  13          2HG       GLU  13  -5.128   1.440  13.500
  101   2HG   GLU  13          1HG       GLU  13  -5.952   2.785  14.288
  102    H    ARG  14           H        ARG  14  -3.056   0.927  13.750
  103    HA   ARG  14           HA       ARG  14  -1.407   0.252  11.403
  104   1HB   ARG  14          2HB       ARG  14  -1.040  -0.601  14.275
  105   2HB   ARG  14          1HB       ARG  14  -0.248  -1.406  12.927
  106   1HG   ARG  14          2HG       ARG  14   0.223   1.386  12.686
  107   2HG   ARG  14          1HG       ARG  14   0.579   0.901  14.344
  108   1HD   ARG  14          2HD       ARG  14   1.668  -0.436  11.868
  109   2HD   ARG  14          1HD       ARG  14   2.541   0.736  12.854
  110    HE   ARG  14           HE       ARG  14   2.104  -2.043  13.439
  111   1HH1  ARG  14          1HH1      ARG  14   2.757   1.098  14.848
  112   2HH1  ARG  14          2HH1      ARG  14   3.468   0.444  16.284
  113   1HH2  ARG  14          1HH2      ARG  14   3.040  -2.901  15.342
  114   2HH2  ARG  14          2HH2      ARG  14   3.629  -1.826  16.566
  115    H    ARG  15           H        ARG  15  -1.740  -1.742  10.440
  116    HA   ARG  15           HA       ARG  15  -3.618  -3.623  11.620
  117   1HB   ARG  15          2HB       ARG  15  -4.384  -1.756   9.558
  118   2HB   ARG  15          1HB       ARG  15  -4.491  -3.402   8.950
  119   1HG   ARG  15          2HG       ARG  15  -5.715  -3.756  11.293
  120   2HG   ARG  15          1HG       ARG  15  -6.067  -2.043  11.052
  121   1HD   ARG  15          2HD       ARG  15  -7.792  -2.729   9.813
  122   2HD   ARG  15          1HD       ARG  15  -6.594  -3.128   8.581
  123    HE   ARG  15           HE       ARG  15  -6.675  -5.351  10.140
  124   1HH1  ARG  15          1HH1      ARG  15  -9.126  -3.504   8.446
  125   2HH1  ARG  15          2HH1      ARG  15 -10.162  -4.869   8.206
  126   1HH2  ARG  15          1HH2      ARG  15  -8.048  -7.148   9.810
  127   2HH2  ARG  15          2HH2      ARG  15  -9.552  -6.934   8.978
  128    H    ILE  16           H        ILE  16  -3.105  -5.679  11.149
  129    HA   ILE  16           HA       ILE  16  -1.054  -6.140   9.082
  130    HB   ILE  16           HB       ILE  16  -1.704  -7.938  11.421
  131   1HG1  ILE  16          2HG1      ILE  16   0.877  -6.560  11.478
  132   2HG1  ILE  16          1HG1      ILE  16  -0.488  -5.455  11.594
  133   1HG2  ILE  16          1HG2      ILE  16   0.443  -7.936   9.325
  134   2HG2  ILE  16          2HG2      ILE  16  -0.679  -9.226   9.758
  135   3HG2  ILE  16          3HG2      ILE  16   0.632  -8.793  10.854
  136   1HD1  ILE  16          1HD1      ILE  16  -1.344  -7.008  13.433
  137   2HD1  ILE  16          2HD1      ILE  16   0.034  -5.971  13.798
  138   3HD1  ILE  16          3HD1      ILE  16   0.287  -7.679  13.439
  139    H    ILE  17           H        ILE  17  -1.660  -7.210   7.310
  140    HA   ILE  17           HA       ILE  17  -3.881  -9.135   7.493
  141    HB   ILE  17           HB       ILE  17  -3.531  -7.237   5.171
  142   1HG1  ILE  17          2HG1      ILE  17  -5.694  -7.086   7.273
  143   2HG1  ILE  17          1HG1      ILE  17  -4.216  -6.135   7.368
  144   1HG2  ILE  17          1HG2      ILE  17  -5.300  -8.246   4.183
  145   2HG2  ILE  17          2HG2      ILE  17  -6.087  -8.622   5.714
  146   3HG2  ILE  17          3HG2      ILE  17  -4.752  -9.620   5.141
  147   1HD1  ILE  17          1HD1      ILE  17  -6.607  -5.618   5.903
  148   2HD1  ILE  17          2HD1      ILE  17  -5.242  -5.731   4.791
  149   3HD1  ILE  17          3HD1      ILE  17  -5.194  -4.589   6.134
  150    H    ALA  18           H        ALA  18  -3.467 -11.055   6.568
  151    HA   ALA  18           HA       ALA  18  -0.974 -11.353   5.058
  152   1HB   ALA  18          1HB       ALA  18  -0.856 -12.977   6.638
  153   2HB   ALA  18          2HB       ALA  18  -1.742 -13.885   5.414
  154   3HB   ALA  18          3HB       ALA  18  -2.607 -13.143   6.760
  155    H    PHE  19           H        PHE  19  -0.921 -11.829   2.949
  156    HA   PHE  19           HA       PHE  19  -3.478 -12.427   1.607
  157   1HB   PHE  19          2HB       PHE  19  -1.080 -10.834   0.729
  158   2HB   PHE  19          1HB       PHE  19  -2.193 -11.512  -0.453
  159    HD1  PHE  19           HD2      PHE  19  -2.040  -9.295   2.521
  160    HD2  PHE  19           HD1      PHE  19  -4.166 -10.398  -0.998
  161    HE1  PHE  19           HE2      PHE  19  -3.521  -7.353   2.811
  162    HE2  PHE  19           HE1      PHE  19  -5.650  -8.457  -0.715
  163    HZ   PHE  19           HZ       PHE  19  -5.330  -6.931   1.193
  164    H    SER  20           H        SER  20  -3.650 -14.449   0.928
  165    HA   SER  20           HA       SER  20  -1.418 -16.221   0.772
  166   1HB   SER  20          2HB       SER  20  -3.958 -17.021  -0.532
  167   2HB   SER  20          1HB       SER  20  -2.963 -17.894   0.634
  168    HG   SER  20           HG       SER  20  -5.169 -16.899   1.235
  169    H    ARG  21           H        ARG  21  -0.361 -17.038  -0.994
  170    HA   ARG  21           HA       ARG  21  -0.316 -15.449  -3.355
  171   1HB   ARG  21          2HB       ARG  21   1.233 -17.642  -2.222
  172   2HB   ARG  21          1HB       ARG  21   1.037 -17.804  -3.961
  173   1HG   ARG  21          2HG       ARG  21   3.089 -16.611  -3.350
  174   2HG   ARG  21          1HG       ARG  21   1.997 -15.619  -4.317
  175   1HD   ARG  21          2HD       ARG  21   1.693 -14.129  -2.663
  176   2HD   ARG  21          1HD       ARG  21   1.588 -15.379  -1.425
  177    HE   ARG  21           HE       ARG  21   3.760 -14.950  -0.913
  178   1HH1  ARG  21          1HH1      ARG  21   3.236 -13.903  -4.219
  179   2HH1  ARG  21          2HH1      ARG  21   4.823 -13.231  -4.387
  180   1HH2  ARG  21          1HH2      ARG  21   5.851 -14.069  -1.147
  181   2HH2  ARG  21          2HH2      ARG  21   6.309 -13.325  -2.643
  182    HA   PRO  22           HA       PRO  22   0.415 -15.799  -5.497
  183   1HB   PRO  22          2HB       PRO  22  -0.680 -14.990  -7.814
  184   2HB   PRO  22          1HB       PRO  22   0.072 -16.581  -7.643
  185   1HG   PRO  22          2HG       PRO  22  -2.825 -15.835  -7.589
  186   2HG   PRO  22          1HG       PRO  22  -2.039 -17.216  -8.375
  187   1HD   PRO  22          2HD       PRO  22  -3.337 -17.362  -5.963
  188   2HD   PRO  22          1HD       PRO  22  -2.027 -18.455  -6.450
  189    H    VAL  23           H        VAL  23   0.669 -13.736  -4.885
  190    HA   VAL  23           HA       VAL  23  -1.688 -12.155  -4.234
  191    HB   VAL  23           HB       VAL  23   0.153 -12.306  -2.587
  192   1HG1  VAL  23          1HG1      VAL  23   1.781 -10.583  -4.436
  193   2HG1  VAL  23          2HG1      VAL  23   1.975 -12.332  -4.340
  194   3HG1  VAL  23          3HG1      VAL  23   2.277 -11.332  -2.920
  195   1HG2  VAL  23          1HG2      VAL  23   0.110  -9.449  -3.431
  196   2HG2  VAL  23          2HG2      VAL  23  -0.108 -10.156  -1.831
  197   3HG2  VAL  23          3HG2      VAL  23  -1.413 -10.236  -3.014
  198    H    LYS  24           H        LYS  24  -2.482 -10.630  -5.514
  199    HA   LYS  24           HA       LYS  24  -0.799  -9.624  -7.716
  200   1HB   LYS  24          2HB       LYS  24  -3.519 -10.647  -7.618
  201   2HB   LYS  24          1HB       LYS  24  -3.454  -9.048  -8.346
  202   1HG   LYS  24          2HG       LYS  24  -2.383  -9.779 -10.187
  203   2HG   LYS  24          1HG       LYS  24  -1.434 -10.973  -9.297
  204   1HD   LYS  24          2HD       LYS  24  -3.110 -12.566  -9.392
  205   2HD   LYS  24          1HD       LYS  24  -4.379 -11.364  -9.633
  206   1HE   LYS  24          2HE       LYS  24  -3.209 -10.897 -11.879
  207   2HE   LYS  24          1HE       LYS  24  -2.400 -12.442 -11.614
  208   1HZ   LYS  24          1HZ       LYS  24  -4.705 -12.234 -12.883
  209   2HZ   LYS  24          2HZ       LYS  24  -5.302 -12.407 -11.310
  210   3HZ   LYS  24          3HZ       LYS  24  -4.296 -13.597 -11.967
  211    H    TYR  25           H        TYR  25  -0.494  -7.470  -7.940
  212    HA   TYR  25           HA       TYR  25  -0.944  -5.715  -5.821
  213   1HB   TYR  25          2HB       TYR  25   0.718  -5.442  -7.730
  214   2HB   TYR  25          1HB       TYR  25  -0.625  -4.827  -8.688
  215    HD1  TYR  25           HD2      TYR  25  -1.913  -2.803  -7.735
  216    HD2  TYR  25           HD1      TYR  25   1.934  -3.991  -6.358
  217    HE1  TYR  25           HE2      TYR  25  -1.565  -0.565  -6.789
  218    HE2  TYR  25           HE1      TYR  25   2.290  -1.754  -5.407
  219    HH   TYR  25           HH       TYR  25   0.610   0.880  -6.208
  220    H    GLU  26           H        GLU  26  -2.767  -6.080  -8.858
  221    HA   GLU  26           HA       GLU  26  -4.602  -4.008  -8.473
  222   1HB   GLU  26          2HB       GLU  26  -4.176  -5.675 -10.496
  223   2HB   GLU  26          1HB       GLU  26  -5.516  -6.544  -9.760
  224   1HG   GLU  26          2HG       GLU  26  -6.333  -3.879  -9.858
  225   2HG   GLU  26          1HG       GLU  26  -5.537  -4.183 -11.400
  226    H    ASP  27           H        ASP  27  -4.776  -7.424  -7.485
  227    HA   ASP  27           HA       ASP  27  -7.371  -7.297  -6.382
  228   1HB   ASP  27          2HB       ASP  27  -5.762  -9.349  -6.937
  229   2HB   ASP  27          1HB       ASP  27  -5.373  -9.191  -5.229
  230    H    VAL  28           H        VAL  28  -4.152  -6.926  -4.903
  231    HA   VAL  28           HA       VAL  28  -5.125  -6.604  -2.254
  232    HB   VAL  28           HB       VAL  28  -2.506  -5.586  -3.375
  233   1HG1  VAL  28          1HG1      VAL  28  -1.959  -6.156  -0.828
  234   2HG1  VAL  28          2HG1      VAL  28  -3.667  -5.760  -0.652
  235   3HG1  VAL  28          3HG1      VAL  28  -2.554  -4.575  -1.336
  236   1HG2  VAL  28          1HG2      VAL  28  -1.610  -7.651  -3.213
  237   2HG2  VAL  28          2HG2      VAL  28  -3.282  -8.180  -3.392
  238   3HG2  VAL  28          3HG2      VAL  28  -2.562  -8.066  -1.787
  239    H    GLU  29           H        GLU  29  -4.130  -4.261  -4.748
  240    HA   GLU  29           HA       GLU  29  -4.560  -1.939  -3.234
  241   1HB   GLU  29          2HB       GLU  29  -3.516  -2.337  -5.643
  242   2HB   GLU  29          1HB       GLU  29  -5.139  -1.902  -6.160
  243   1HG   GLU  29          2HG       GLU  29  -4.828   0.139  -4.602
  244   2HG   GLU  29          1HG       GLU  29  -3.114  -0.256  -4.703
  245    H    HIS  30           H        HIS  30  -6.756  -3.769  -5.350
  246    HA   HIS  30           HA       HIS  30  -8.954  -2.050  -5.230
  247   1HB   HIS  30          2HB       HIS  30  -8.729  -4.015  -6.761
  248   2HB   HIS  30          1HB       HIS  30  -9.052  -5.070  -5.389
  249    HD1  HIS  30           HD1      HIS  30 -11.012  -1.906  -5.740
  250    HD2  HIS  30           HD2      HIS  30 -11.442  -5.955  -6.578
  251    HE1  HIS  30           HE1      HIS  30 -13.449  -2.231  -6.258
  252    HE2  HIS  30           HE2      HIS  30 -13.695  -4.694  -6.723
  253    H    LYS  31           H        LYS  31  -7.929  -4.601  -2.986
  254    HA   LYS  31           HA       LYS  31 -10.273  -4.495  -1.376
  255   1HB   LYS  31          2HB       LYS  31  -8.222  -6.242  -1.539
  256   2HB   LYS  31          1HB       LYS  31  -7.724  -5.338  -0.116
  257   1HG   LYS  31          2HG       LYS  31 -10.231  -5.773   0.600
  258   2HG   LYS  31          1HG       LYS  31 -10.056  -7.131  -0.512
  259   1HD   LYS  31          2HD       LYS  31  -7.734  -7.225   0.968
  260   2HD   LYS  31          1HD       LYS  31  -8.944  -6.737   2.155
  261   1HE   LYS  31          2HE       LYS  31  -9.477  -9.022   0.291
  262   2HE   LYS  31          1HE       LYS  31  -8.496  -9.263   1.736
  263   1HZ   LYS  31          1HZ       LYS  31 -10.569  -8.028   2.811
  264   2HZ   LYS  31          2HZ       LYS  31 -10.521  -9.706   2.607
  265   3HZ   LYS  31          3HZ       LYS  31 -11.357  -8.745   1.496
  266    H    VAL  32           H        VAL  32  -7.007  -3.098  -0.965
  267    HA   VAL  32           HA       VAL  32  -7.626  -1.755   1.457
  268    HB   VAL  32           HB       VAL  32  -5.459  -0.980  -0.498
  269   1HG1  VAL  32          1HG1      VAL  32  -4.333  -0.334   1.717
  270   2HG1  VAL  32          2HG1      VAL  32  -5.953  -0.424   2.409
  271   3HG1  VAL  32          3HG1      VAL  32  -5.615   0.712   1.104
  272   1HG2  VAL  32          1HG2      VAL  32  -4.754  -3.101  -0.165
  273   2HG2  VAL  32          2HG2      VAL  32  -5.707  -3.303   1.305
  274   3HG2  VAL  32          3HG2      VAL  32  -4.168  -2.444   1.363
  275    H    THR  33           H        THR  33  -7.600  -0.678  -1.933
  276    HA   THR  33           HA       THR  33  -8.096   2.033  -1.459
  277    HB   THR  33           HB       THR  33  -7.392   0.983  -3.649
  278    HG1  THR  33           HG1      THR  33  -8.318   2.623  -4.802
  279   1HG2  THR  33          1HG2      THR  33 -10.317   0.681  -4.218
  280   2HG2  THR  33          2HG2      THR  33  -9.316  -0.675  -3.703
  281   3HG2  THR  33          3HG2      THR  33  -8.938   0.180  -5.198
  282    H    THR  34           H        THR  34 -10.365  -0.681  -1.764
  283    HA   THR  34           HA       THR  34 -12.692   0.977  -1.734
  284    HB   THR  34           HB       THR  34 -12.429  -1.974  -1.112
  285    HG1  THR  34           HG1      THR  34 -12.161  -2.107  -3.174
  286   1HG2  THR  34          1HG2      THR  34 -14.624  -0.474  -0.574
  287   2HG2  THR  34          2HG2      THR  34 -14.647  -2.188  -0.981
  288   3HG2  THR  34          3HG2      THR  34 -14.937  -0.981  -2.233
  289    H    VAL  35           H        VAL  35 -10.889  -0.769   0.785
  290    HA   VAL  35           HA       VAL  35 -12.726  -0.405   2.876
  291    HB   VAL  35           HB       VAL  35  -9.711  -0.560   3.099
  292   1HG1  VAL  35          1HG1      VAL  35 -11.891  -0.922   5.148
  293   2HG1  VAL  35          2HG1      VAL  35 -10.598   0.278   5.150
  294   3HG1  VAL  35          3HG1      VAL  35 -10.220  -1.428   5.391
  295   1HG2  VAL  35          1HG2      VAL  35 -11.455  -2.485   2.137
  296   2HG2  VAL  35          2HG2      VAL  35 -11.206  -2.938   3.822
  297   3HG2  VAL  35          3HG2      VAL  35  -9.823  -2.758   2.745
  298    H    PHE  36           H        PHE  36  -9.814   1.537   2.124
  299    HA   PHE  36           HA       PHE  36 -10.645   3.596   3.979
  300   1HB   PHE  36          2HB       PHE  36  -8.272   3.410   2.124
  301   2HB   PHE  36          1HB       PHE  36  -8.548   4.731   3.254
  302    HD1  PHE  36           HD2      PHE  36  -9.258   3.647   5.722
  303    HD2  PHE  36           HD1      PHE  36  -6.630   1.979   2.818
  304    HE1  PHE  36           HE2      PHE  36  -8.114   2.375   7.492
  305    HE2  PHE  36           HE1      PHE  36  -5.485   0.705   4.583
  306    HZ   PHE  36           HZ       PHE  36  -6.227   0.904   6.920
  307    H    GLY  37           H        GLY  37 -11.022   3.001   0.591
  308   1HA   GLY  37          2HA       GLY  37 -12.494   4.221  -0.785
  309   2HA   GLY  37          1HA       GLY  37 -12.367   5.582   0.317
  310    H    GLN  38           H        GLN  38 -12.237   6.358  -2.152
  311    HA   GLN  38           HA       GLN  38  -9.369   6.770  -2.695
  312   1HB   GLN  38          2HB       GLN  38 -11.480   5.776  -4.466
  313   2HB   GLN  38          1HB       GLN  38 -10.584   7.131  -5.144
  314   1HG   GLN  38          2HG       GLN  38  -8.590   5.532  -4.150
  315   2HG   GLN  38          1HG       GLN  38  -9.776   4.366  -4.731
  316   1HE2  GLN  38          1HE2      GLN  38 -10.055   4.085  -6.889
  317   2HE2  GLN  38          2HE2      GLN  38  -9.131   4.907  -8.095
  318    HA   PRO  39           HA       PRO  39  -8.538   7.841  -4.614
  319   1HB   PRO  39          2HB       PRO  39  -6.917   9.922  -5.023
  320   2HB   PRO  39          1HB       PRO  39  -8.398   9.713  -5.963
  321   1HG   PRO  39          2HG       PRO  39  -7.858  11.529  -3.654
  322   2HG   PRO  39          1HG       PRO  39  -8.790  11.838  -5.130
  323   1HD   PRO  39          2HD       PRO  39  -9.870  11.152  -2.665
  324   2HD   PRO  39          1HD       PRO  39 -10.695  10.980  -4.226
  325    H    LEU  40           H        LEU  40  -6.602   6.991  -3.936
  326    HA   LEU  40           HA       LEU  40  -5.348   8.093  -1.524
  327   1HB   LEU  40          2HB       LEU  40  -6.391   5.309  -1.906
  328   2HB   LEU  40          1HB       LEU  40  -5.004   5.588  -0.872
  329    HG   LEU  40           HG       LEU  40  -7.774   6.730  -0.505
  330   1HD1  LEU  40          1HD1      LEU  40  -8.137   5.159   1.073
  331   2HD1  LEU  40          2HD1      LEU  40  -6.446   5.103   1.567
  332   3HD1  LEU  40          3HD1      LEU  40  -6.968   4.249   0.115
  333   1HD2  LEU  40          1HD2      LEU  40  -6.602   8.432   0.418
  334   2HD2  LEU  40          2HD2      LEU  40  -5.164   7.446   0.689
  335   3HD2  LEU  40          3HD2      LEU  40  -6.539   7.320   1.786
  336    H    ASP  41           H        ASP  41  -3.128   7.724  -1.340
  337    HA   ASP  41           HA       ASP  41  -1.850   6.588  -3.744
  338   1HB   ASP  41          2HB       ASP  41  -1.630   9.096  -3.359
  339   2HB   ASP  41          1HB       ASP  41  -0.635   8.699  -1.962
  340    H    LEU  42           H        LEU  42  -0.324   5.040  -3.497
  341    HA   LEU  42           HA       LEU  42   0.135   4.030  -0.799
  342   1HB   LEU  42          2HB       LEU  42   0.431   2.920  -3.554
  343   2HB   LEU  42          1HB       LEU  42   1.391   2.222  -2.264
  344    HG   LEU  42           HG       LEU  42  -1.354   2.445  -1.422
  345   1HD1  LEU  42          1HD1      LEU  42  -0.866   1.348  -4.145
  346   2HD1  LEU  42          2HD1      LEU  42  -2.255   2.226  -3.511
  347   3HD1  LEU  42          3HD1      LEU  42  -2.022   0.530  -3.095
  348   1HD2  LEU  42          1HD2      LEU  42   0.469   0.959  -0.541
  349   2HD2  LEU  42          2HD2      LEU  42   0.270  -0.024  -1.991
  350   3HD2  LEU  42          3HD2      LEU  42  -1.067   0.156  -0.858
  351    H    HIS  43           H        HIS  43   1.833   4.754   0.308
  352    HA   HIS  43           HA       HIS  43   4.280   5.481  -1.169
  353   1HB   HIS  43          2HB       HIS  43   2.792   7.111   0.410
  354   2HB   HIS  43          1HB       HIS  43   3.930   6.479   1.594
  355    HD1  HIS  43           HD1      HIS  43   6.183   7.553   1.658
  356    HD2  HIS  43           HD2      HIS  43   4.095   8.455  -1.822
  357    HE1  HIS  43           HE1      HIS  43   7.568   9.286   0.473
  358    HE2  HIS  43           HE2      HIS  43   6.263   9.848  -1.609
  359    H    TYR  44           H        TYR  44   5.771   3.917  -1.002
  360    HA   TYR  44           HA       TYR  44   5.866   2.257   1.397
  361   1HB   TYR  44          2HB       TYR  44   5.943   0.993  -0.621
  362   2HB   TYR  44          1HB       TYR  44   7.165   2.047  -1.320
  363    HD1  TYR  44           HD1      TYR  44   9.498   1.950  -0.478
  364    HD2  TYR  44           HD2      TYR  44   6.547  -0.843   0.774
  365    HE1  TYR  44           HE1      TYR  44  11.273   0.449   0.327
  366    HE2  TYR  44           HE2      TYR  44   8.310  -2.352   1.585
  367    HH   TYR  44           HH       TYR  44  11.094  -2.534   0.779
  368    H    MET  45           H        MET  45   7.226   2.698   2.999
  369    HA   MET  45           HA       MET  45   9.676   4.223   2.392
  370   1HB   MET  45          2HB       MET  45   9.469   5.285   4.621
  371   2HB   MET  45          1HB       MET  45   8.140   5.694   3.548
  372   1HG   MET  45          2HG       MET  45   6.619   4.396   4.734
  373   2HG   MET  45          1HG       MET  45   7.887   3.459   5.523
  374   1HE   MET  45          1HE       MET  45   6.955   3.430   7.498
  375   2HE   MET  45          2HE       MET  45   6.240   4.752   8.421
  376   3HE   MET  45          3HE       MET  45   7.950   4.362   8.618
  377    H    ASN  46           H        ASN  46  11.554   3.386   3.116
  378    HA   ASN  46           HA       ASN  46  11.400   0.901   4.671
  379   1HB   ASN  46          2HB       ASN  46  12.724   1.244   2.417
  380   2HB   ASN  46          1HB       ASN  46  13.954   1.920   3.479
  381   1HD2  ASN  46          1HD2      ASN  46  14.864  -0.123   2.229
  382   2HD2  ASN  46          2HD2      ASN  46  14.858  -1.572   3.169
  383    H    ASN  47           H        ASN  47  13.151   3.992   4.599
  384    HA   ASN  47           HA       ASN  47  13.133   4.205   7.446
  385   1HB   ASN  47          2HB       ASN  47  15.512   3.103   6.111
  386   2HB   ASN  47          1HB       ASN  47  15.852   4.475   7.158
  387   1HD2  ASN  47          1HD2      ASN  47  15.606   1.200   7.063
  388   2HD2  ASN  47          2HD2      ASN  47  15.322   0.886   8.739
  389    H    GLU  48           H        GLU  48  15.412   5.314   4.949
  390    HA   GLU  48           HA       GLU  48  14.605   8.080   5.539
  391   1HB   GLU  48          2HB       GLU  48  16.932   7.595   6.068
  392   2HB   GLU  48          1HB       GLU  48  17.203   6.993   4.439
  393   1HG   GLU  48          2HG       GLU  48  18.110   9.117   4.386
  394   2HG   GLU  48          1HG       GLU  48  16.511   9.350   3.682
  395    H    LEU  49           H        LEU  49  14.887   5.682   3.014
  396    HA   LEU  49           HA       LEU  49  14.263   7.692   0.970
  397   1HB   LEU  49          2HB       LEU  49  16.039   5.573   0.952
  398   2HB   LEU  49          1HB       LEU  49  14.670   4.947   0.055
  399    HG   LEU  49           HG       LEU  49  16.129   7.508  -0.606
  400   1HD1  LEU  49          1HD1      LEU  49  16.293   4.766  -1.849
  401   2HD1  LEU  49          2HD1      LEU  49  17.570   5.601  -0.966
  402   3HD1  LEU  49          3HD1      LEU  49  17.016   6.228  -2.519
  403   1HD2  LEU  49          1HD2      LEU  49  14.107   7.866  -1.590
  404   2HD2  LEU  49          2HD2      LEU  49  13.728   6.145  -1.699
  405   3HD2  LEU  49          3HD2      LEU  49  14.848   6.876  -2.849
  406    H    SER  50           H        SER  50  12.421   7.615  -0.236
  407    HA   SER  50           HA       SER  50  10.388   5.653   0.599
  408   1HB   SER  50          2HB       SER  50  10.070   8.501  -0.377
  409   2HB   SER  50          1HB       SER  50   8.723   7.382  -0.168
  410    HG   SER  50           HG       SER  50  10.481   8.379   1.820
  411    H    ILE  51           H        ILE  51   9.486   4.366  -0.900
  412    HA   ILE  51           HA       ILE  51  10.185   4.852  -3.726
  413    HB   ILE  51           HB       ILE  51   9.542   2.177  -2.481
  414   1HG1  ILE  51          2HG1      ILE  51  11.623   3.067  -1.513
  415   2HG1  ILE  51          1HG1      ILE  51  11.944   1.691  -2.562
  416   1HG2  ILE  51          1HG2      ILE  51   9.197   2.568  -4.971
  417   2HG2  ILE  51          2HG2      ILE  51  10.211   1.203  -4.506
  418   3HG2  ILE  51          3HG2      ILE  51  10.953   2.695  -5.079
  419   1HD1  ILE  51          1HD1      ILE  51  13.616   3.350  -2.941
  420   2HD1  ILE  51          2HD1      ILE  51  12.396   4.597  -3.190
  421   3HD1  ILE  51          3HD1      ILE  51  12.570   3.290  -4.359
  422    H    LEU  52           H        LEU  52   8.570   4.969  -5.202
  423    HA   LEU  52           HA       LEU  52   5.831   4.854  -4.210
  424   1HB   LEU  52          2HB       LEU  52   7.184   6.470  -6.071
  425   2HB   LEU  52          1HB       LEU  52   6.056   5.512  -7.012
  426    HG   LEU  52           HG       LEU  52   5.160   7.718  -6.311
  427   1HD1  LEU  52          1HD1      LEU  52   3.880   5.124  -5.682
  428   2HD1  LEU  52          2HD1      LEU  52   3.395   6.391  -6.809
  429   3HD1  LEU  52          3HD1      LEU  52   3.085   6.579  -5.084
  430   1HD2  LEU  52          1HD2      LEU  52   4.981   8.398  -4.163
  431   2HD2  LEU  52          2HD2      LEU  52   6.347   7.305  -3.943
  432   3HD2  LEU  52          3HD2      LEU  52   4.713   6.765  -3.550
  433    H    LEU  53           H        LEU  53   4.610   3.110  -4.459
  434    HA   LEU  53           HA       LEU  53   5.354   1.131  -6.503
  435   1HB   LEU  53          2HB       LEU  53   3.558   0.766  -4.101
  436   2HB   LEU  53          1HB       LEU  53   4.120  -0.492  -5.184
  437    HG   LEU  53           HG       LEU  53   5.953   1.145  -3.430
  438   1HD1  LEU  53          1HD1      LEU  53   5.127  -1.694  -2.919
  439   2HD1  LEU  53          2HD1      LEU  53   4.249  -0.330  -2.226
  440   3HD1  LEU  53          3HD1      LEU  53   5.953  -0.570  -1.840
  441   1HD2  LEU  53          1HD2      LEU  53   7.303  -1.088  -3.926
  442   2HD2  LEU  53          2HD2      LEU  53   7.366   0.309  -5.002
  443   3HD2  LEU  53          3HD2      LEU  53   6.314  -1.053  -5.385
  444    H    LYS  54           H        LYS  54   4.092   0.883  -8.239
  445    HA   LYS  54           HA       LYS  54   1.286   1.752  -8.088
  446   1HB   LYS  54          2HB       LYS  54   2.487   3.464  -9.290
  447   2HB   LYS  54          1HB       LYS  54   3.258   2.263 -10.314
  448   1HG   LYS  54          2HG       LYS  54   1.009   1.667 -11.198
  449   2HG   LYS  54          1HG       LYS  54   0.346   3.022 -10.282
  450   1HD   LYS  54          2HD       LYS  54   2.636   3.837 -11.846
  451   2HD   LYS  54          1HD       LYS  54   1.409   3.083 -12.865
  452   1HE   LYS  54          2HE       LYS  54   0.757   5.304 -12.866
  453   2HE   LYS  54          1HE       LYS  54  -0.241   4.619 -11.585
  454   1HZ   LYS  54          1HZ       LYS  54   0.645   6.628 -10.761
  455   2HZ   LYS  54          2HZ       LYS  54   2.210   6.259 -11.288
  456   3HZ   LYS  54          3HZ       LYS  54   1.527   5.396 -10.003
  457    H    ASN  55           H        ASN  55   3.576  -0.020 -10.149
  458    HA   ASN  55           HA       ASN  55   1.437  -1.924 -10.816
  459   1HB   ASN  55          2HB       ASN  55   3.868  -0.953 -12.242
  460   2HB   ASN  55          1HB       ASN  55   3.384  -2.620 -12.524
  461   1HD2  ASN  55          1HD2      ASN  55   3.410  -0.772 -14.555
  462   2HD2  ASN  55          2HD2      ASN  55   1.789  -0.441 -15.054
  463    H    GLN  56           H        GLN  56   2.402  -4.212 -11.306
  464    HA   GLN  56           HA       GLN  56   3.232  -5.325  -8.881
  465   1HB   GLN  56          2HB       GLN  56   2.124  -6.422 -10.979
  466   2HB   GLN  56          1HB       GLN  56   3.783  -6.695 -11.489
  467   1HG   GLN  56          2HG       GLN  56   3.416  -8.645 -10.406
  468   2HG   GLN  56          1HG       GLN  56   4.001  -7.680  -9.054
  469   1HE2  GLN  56          1HE2      GLN  56   2.894  -9.190  -7.697
  470   2HE2  GLN  56          2HE2      GLN  56   1.192  -9.039  -7.438
  471    H    ASP  57           H        ASP  57   5.089  -4.186 -11.651
  472    HA   ASP  57           HA       ASP  57   7.552  -5.356 -11.177
  473   1HB   ASP  57          2HB       ASP  57   6.657  -2.828 -12.471
  474   2HB   ASP  57          1HB       ASP  57   8.370  -2.966 -12.082
  475    H    ASP  58           H        ASP  58   6.298  -2.299  -9.826
  476    HA   ASP  58           HA       ASP  58   8.579  -1.675  -8.287
  477   1HB   ASP  58          2HB       ASP  58   5.737  -0.906  -7.593
  478   2HB   ASP  58          1HB       ASP  58   7.213  -0.053  -7.160
  479    H    LEU  59           H        LEU  59   5.559  -3.352  -7.447
  480    HA   LEU  59           HA       LEU  59   6.172  -3.810  -4.737
  481   1HB   LEU  59          2HB       LEU  59   3.909  -3.974  -5.634
  482   2HB   LEU  59          1HB       LEU  59   4.375  -5.360  -6.602
  483    HG   LEU  59           HG       LEU  59   4.932  -6.502  -4.363
  484   1HD1  LEU  59          1HD1      LEU  59   4.268  -5.605  -2.396
  485   2HD1  LEU  59          2HD1      LEU  59   2.909  -4.743  -3.115
  486   3HD1  LEU  59          3HD1      LEU  59   4.541  -4.096  -3.265
  487   1HD2  LEU  59          1HD2      LEU  59   2.467  -7.008  -4.008
  488   2HD2  LEU  59          2HD2      LEU  59   3.114  -7.303  -5.622
  489   3HD2  LEU  59          3HD2      LEU  59   2.153  -5.859  -5.307
  490    H    ASP  60           H        ASP  60   6.791  -5.739  -7.650
  491    HA   ASP  60           HA       ASP  60   7.719  -8.068  -6.377
  492   1HB   ASP  60          2HB       ASP  60   8.015  -6.891  -9.104
  493   2HB   ASP  60          1HB       ASP  60   9.104  -8.198  -8.650
  494    H    LYS  61           H        LYS  61   9.440  -5.150  -7.449
  495    HA   LYS  61           HA       LYS  61  12.036  -6.051  -6.788
  496   1HB   LYS  61          2HB       LYS  61  10.798  -3.579  -7.663
  497   2HB   LYS  61          1HB       LYS  61  12.039  -3.272  -6.455
  498   1HG   LYS  61          2HG       LYS  61  13.702  -3.787  -7.854
  499   2HG   LYS  61          1HG       LYS  61  12.844  -5.175  -8.525
  500   1HD   LYS  61          2HD       LYS  61  12.001  -3.988 -10.243
  501   2HD   LYS  61          1HD       LYS  61  11.725  -2.554  -9.251
  502   1HE   LYS  61          2HE       LYS  61  13.533  -1.613 -10.131
  503   2HE   LYS  61          1HE       LYS  61  14.521  -2.905  -9.451
  504   1HZ   LYS  61          1HZ       LYS  61  14.906  -2.836 -11.779
  505   2HZ   LYS  61          2HZ       LYS  61  13.252  -2.839 -12.133
  506   3HZ   LYS  61          3HZ       LYS  61  13.978  -4.220 -11.478
  507    H    ALA  62           H        ALA  62   9.494  -4.493  -4.906
  508    HA   ALA  62           HA       ALA  62  11.026  -3.799  -2.645
  509   1HB   ALA  62          1HB       ALA  62   8.630  -4.182  -1.529
  510   2HB   ALA  62          2HB       ALA  62   8.139  -4.133  -3.222
  511   3HB   ALA  62          3HB       ALA  62   9.008  -2.770  -2.515
  512    H    ILE  63           H        ILE  63   9.456  -6.809  -3.603
  513    HA   ILE  63           HA       ILE  63   9.600  -8.178  -1.157
  514    HB   ILE  63           HB       ILE  63   9.903  -9.433  -3.892
  515   1HG1  ILE  63          2HG1      ILE  63   7.915  -8.075  -3.944
  516   2HG1  ILE  63          1HG1      ILE  63   7.418  -9.751  -3.756
  517   1HG2  ILE  63          1HG2      ILE  63   8.931 -10.533  -1.256
  518   2HG2  ILE  63          2HG2      ILE  63  10.432 -10.950  -2.086
  519   3HG2  ILE  63          3HG2      ILE  63   8.878 -11.395  -2.795
  520   1HD1  ILE  63          1HD1      ILE  63   6.142  -8.164  -2.358
  521   2HD1  ILE  63          2HD1      ILE  63   7.630  -7.773  -1.498
  522   3HD1  ILE  63          3HD1      ILE  63   6.973  -9.407  -1.423
  523    H    ASP  64           H        ASP  64  11.927  -7.988  -3.844
  524    HA   ASP  64           HA       ASP  64  13.876  -9.718  -2.898
  525   1HB   ASP  64          2HB       ASP  64  13.793  -8.447  -5.129
  526   2HB   ASP  64          1HB       ASP  64  14.545  -7.112  -4.262
  527    H    ILE  65           H        ILE  65  13.392  -6.286  -2.162
  528    HA   ILE  65           HA       ILE  65  15.686  -5.958  -0.549
  529    HB   ILE  65           HB       ILE  65  13.112  -4.394  -0.311
  530   1HG1  ILE  65          2HG1      ILE  65  15.462  -3.922  -2.166
  531   2HG1  ILE  65          1HG1      ILE  65  13.863  -4.469  -2.660
  532   1HG2  ILE  65          1HG2      ILE  65  15.723  -3.084   0.030
  533   2HG2  ILE  65          2HG2      ILE  65  15.303  -4.261   1.272
  534   3HG2  ILE  65          3HG2      ILE  65  14.231  -2.900   0.948
  535   1HD1  ILE  65          1HD1      ILE  65  13.070  -2.266  -1.521
  536   2HD1  ILE  65          2HD1      ILE  65  13.765  -2.233  -3.142
  537   3HD1  ILE  65          3HD1      ILE  65  14.749  -1.778  -1.751
  538    H    LEU  66           H        LEU  66  12.322  -6.797   0.259
  539    HA   LEU  66           HA       LEU  66  12.718  -6.834   3.080
  540   1HB   LEU  66          2HB       LEU  66  10.533  -6.755   1.641
  541   2HB   LEU  66          1HB       LEU  66  10.656  -8.501   1.685
  542    HG   LEU  66           HG       LEU  66   9.221  -8.068   3.425
  543   1HD1  LEU  66          1HD1      LEU  66  10.349  -8.532   5.486
  544   2HD1  LEU  66          2HD1      LEU  66  11.878  -7.944   4.833
  545   3HD1  LEU  66          3HD1      LEU  66  11.149  -9.416   4.190
  546   1HD2  LEU  66          1HD2      LEU  66   9.006  -5.834   3.734
  547   2HD2  LEU  66          2HD2      LEU  66  10.745  -5.548   3.689
  548   3HD2  LEU  66          3HD2      LEU  66   9.995  -6.188   5.150
  549    H    ASP  67           H        ASP  67  12.599  -9.398   0.621
  550    HA   ASP  67           HA       ASP  67  12.981 -11.598   2.288
  551   1HB   ASP  67          2HB       ASP  67  13.578 -11.095  -0.611
  552   2HB   ASP  67          1HB       ASP  67  14.082 -12.605   0.141
  553    H    ARG  68           H        ARG  68  15.405  -9.472   0.787
  554    HA   ARG  68           HA       ARG  68  17.648 -11.009   1.612
  555   1HB   ARG  68          2HB       ARG  68  19.000  -9.106   0.974
  556   2HB   ARG  68          1HB       ARG  68  17.758  -9.388  -0.237
  557   1HG   ARG  68          2HG       ARG  68  16.601  -7.473   0.306
  558   2HG   ARG  68          1HG       ARG  68  17.269  -7.402   1.935
  559   1HD   ARG  68          2HD       ARG  68  19.476  -6.848   0.962
  560   2HD   ARG  68          1HD       ARG  68  18.735  -6.825  -0.637
  561    HE   ARG  68           HE       ARG  68  17.882  -4.755  -0.174
  562   1HH1  ARG  68          1HH1      ARG  68  18.902  -6.230   2.839
  563   2HH1  ARG  68          2HH1      ARG  68  18.652  -4.793   3.771
  564   1HH2  ARG  68          1HH2      ARG  68  17.562  -2.859   1.059
  565   2HH2  ARG  68          2HH2      ARG  68  17.886  -2.876   2.760
  566    H    SER  69           H        SER  69  15.730  -8.536   3.191
  567    HA   SER  69           HA       SER  69  17.646  -8.026   5.264
  568   1HB   SER  69          2HB       SER  69  15.965  -6.641   6.275
  569   2HB   SER  69          1HB       SER  69  15.888  -6.381   4.535
  570    HG   SER  69           HG       SER  69  14.191  -8.167   5.953
  571    H    SER  70           H        SER  70  18.135  -9.385   6.838
  572    HA   SER  70           HA       SER  70  16.534 -11.681   7.432
  573   1HB   SER  70          2HB       SER  70  18.268 -12.100   9.198
  574   2HB   SER  70          1HB       SER  70  18.936 -11.883   7.579
  575    HG   SER  70           HG       SER  70  19.484 -10.507   9.791
  576    H    SER  71           H        SER  71  17.395  -8.739   9.257
  577    HA   SER  71           HA       SER  71  15.897  -9.362  11.564
  578   1HB   SER  71          2HB       SER  71  16.215  -6.492  10.877
  579   2HB   SER  71          1HB       SER  71  16.586  -7.344  12.373
  580    HG   SER  71           HG       SER  71  18.210  -6.736  10.276
  581    H    MET  72           H        MET  72  15.094  -7.334   8.745
  582    HA   MET  72           HA       MET  72  12.475  -6.695   9.668
  583   1HB   MET  72          2HB       MET  72  14.151  -5.976   7.474
  584   2HB   MET  72          1HB       MET  72  12.606  -6.508   6.826
  585   1HG   MET  72          2HG       MET  72  12.924  -4.421   8.967
  586   2HG   MET  72          1HG       MET  72  12.744  -4.078   7.248
  587   1HE   MET  72          1HE       MET  72  10.121  -2.540   8.340
  588   2HE   MET  72          2HE       MET  72   9.307  -3.348   6.999
  589   3HE   MET  72          3HE       MET  72  11.010  -2.905   6.862
  590    H    LYS  73           H        LYS  73  10.480  -7.518   9.035
  591    HA   LYS  73           HA       LYS  73  10.469  -9.979   7.435
  592   1HB   LYS  73          2HB       LYS  73   9.594  -9.665  10.265
  593   2HB   LYS  73          1HB       LYS  73   8.623 -10.694   9.222
  594   1HG   LYS  73          2HG       LYS  73  10.594 -12.041   8.708
  595   2HG   LYS  73          1HG       LYS  73  11.573 -11.001   9.746
  596   1HD   LYS  73          2HD       LYS  73  10.133 -11.621  11.662
  597   2HD   LYS  73          1HD       LYS  73   9.248 -12.724  10.605
  598   1HE   LYS  73          2HE       LYS  73  10.992 -13.825  12.009
  599   2HE   LYS  73          1HE       LYS  73  11.184 -14.084  10.277
  600   1HZ   LYS  73          1HZ       LYS  73  12.649 -11.942  11.710
  601   2HZ   LYS  73          2HZ       LYS  73  12.990 -12.611  10.195
  602   3HZ   LYS  73          3HZ       LYS  73  13.254 -13.518  11.597
  603    H    SER  74           H        SER  74   8.364  -7.627   9.121
  604    HA   SER  74           HA       SER  74   6.209  -8.064   7.249
  605   1HB   SER  74          2HB       SER  74   6.216  -5.716   9.100
  606   2HB   SER  74          1HB       SER  74   4.891  -6.787   8.653
  607    HG   SER  74           HG       SER  74   5.938  -8.413   9.950
  608    H    LEU  75           H        LEU  75   5.167  -6.138   6.153
  609    HA   LEU  75           HA       LEU  75   7.269  -4.579   4.819
  610   1HB   LEU  75          2HB       LEU  75   4.671  -5.705   3.992
  611   2HB   LEU  75          1HB       LEU  75   5.027  -4.109   3.356
  612    HG   LEU  75           HG       LEU  75   7.144  -6.185   3.105
  613   1HD1  LEU  75          1HD1      LEU  75   5.871  -6.633   0.806
  614   2HD1  LEU  75          2HD1      LEU  75   4.474  -6.341   1.840
  615   3HD1  LEU  75          3HD1      LEU  75   5.619  -7.620   2.245
  616   1HD2  LEU  75          1HD2      LEU  75   7.114  -4.972   0.771
  617   2HD2  LEU  75          2HD2      LEU  75   7.854  -4.215   2.181
  618   3HD2  LEU  75          3HD2      LEU  75   6.234  -3.737   1.674
  619    H    ARG  76           H        ARG  76   7.466  -2.455   5.140
  620    HA   ARG  76           HA       ARG  76   5.455  -1.090   6.760
  621   1HB   ARG  76          2HB       ARG  76   8.316  -0.522   6.054
  622   2HB   ARG  76          1HB       ARG  76   7.285   0.772   6.647
  623   1HG   ARG  76          2HG       ARG  76   6.797  -1.127   8.503
  624   2HG   ARG  76          1HG       ARG  76   8.462  -1.515   8.066
  625   1HD   ARG  76          2HD       ARG  76   8.703   1.132   8.302
  626   2HD   ARG  76          1HD       ARG  76   7.352   0.886   9.407
  627    HE   ARG  76           HE       ARG  76   9.175  -0.990  10.161
  628   1HH1  ARG  76          1HH1      ARG  76   9.291   2.493   9.775
  629   2HH1  ARG  76          2HH1      ARG  76  10.503   2.708  10.992
  630   1HH2  ARG  76          1HH2      ARG  76  10.768  -0.693  11.765
  631   2HH2  ARG  76          2HH2      ARG  76  11.341   0.901  12.122
  632    H    ILE  77           H        ILE  77   3.862  -0.946   5.089
  633    HA   ILE  77           HA       ILE  77   4.487   0.975   2.949
  634    HB   ILE  77           HB       ILE  77   2.073  -0.833   3.099
  635   1HG1  ILE  77          2HG1      ILE  77   4.502  -1.300   1.370
  636   2HG1  ILE  77          1HG1      ILE  77   4.341  -2.027   2.966
  637   1HG2  ILE  77          1HG2      ILE  77   1.911  -0.345   0.689
  638   2HG2  ILE  77          2HG2      ILE  77   3.273   0.765   0.840
  639   3HG2  ILE  77          3HG2      ILE  77   1.762   1.105   1.683
  640   1HD1  ILE  77          1HD1      ILE  77   1.995  -2.451   1.312
  641   2HD1  ILE  77          2HD1      ILE  77   2.979  -3.607   2.207
  642   3HD1  ILE  77          3HD1      ILE  77   3.469  -3.099   0.594
  643    H    LEU  78           H        LEU  78   3.915   2.995   3.396
  644    HA   LEU  78           HA       LEU  78   1.647   3.493   5.197
  645   1HB   LEU  78          2HB       LEU  78   4.119   4.499   5.337
  646   2HB   LEU  78          1HB       LEU  78   3.420   5.692   4.262
  647    HG   LEU  78           HG       LEU  78   1.887   5.073   6.724
  648   1HD1  LEU  78          1HD1      LEU  78   3.298   5.977   8.244
  649   2HD1  LEU  78          2HD1      LEU  78   4.072   7.035   7.065
  650   3HD1  LEU  78          3HD1      LEU  78   4.512   5.328   7.143
  651   1HD2  LEU  78          1HD2      LEU  78   1.594   6.877   4.755
  652   2HD2  LEU  78          2HD2      LEU  78   2.564   7.822   5.885
  653   3HD2  LEU  78          3HD2      LEU  78   1.025   7.138   6.404
  654    H    LEU  79           H        LEU  79  -0.241   3.948   4.273
  655    HA   LEU  79           HA       LEU  79  -0.241   5.135   1.583
  656   1HB   LEU  79          2HB       LEU  79  -2.730   4.421   1.691
  657   2HB   LEU  79          1HB       LEU  79  -1.496   3.215   1.391
  658    HG   LEU  79           HG       LEU  79  -2.252   3.595   4.226
  659   1HD1  LEU  79          1HD1      LEU  79  -4.374   2.816   4.152
  660   2HD1  LEU  79          2HD1      LEU  79  -4.106   1.895   2.672
  661   3HD1  LEU  79          3HD1      LEU  79  -4.359   3.639   2.593
  662   1HD2  LEU  79          1HD2      LEU  79  -0.802   1.843   3.989
  663   2HD2  LEU  79          2HD2      LEU  79  -1.416   1.405   2.395
  664   3HD2  LEU  79          3HD2      LEU  79  -2.336   0.988   3.839
  665    H    LEU  80           H        LEU  80  -1.167   7.059   1.175
  666    HA   LEU  80           HA       LEU  80  -2.746   8.360   3.270
  667   1HB   LEU  80          2HB       LEU  80  -1.435  10.499   2.754
  668   2HB   LEU  80          1HB       LEU  80  -0.685   9.305   3.792
  669    HG   LEU  80           HG       LEU  80   0.064   8.817   1.054
  670   1HD1  LEU  80          1HD1      LEU  80  -0.438  11.439   1.276
  671   2HD1  LEU  80          2HD1      LEU  80   0.868  10.784   0.288
  672   3HD1  LEU  80          3HD1      LEU  80   1.209  11.404   1.905
  673   1HD2  LEU  80          1HD2      LEU  80   2.015   9.855   3.009
  674   2HD2  LEU  80          2HD2      LEU  80   2.072   8.411   2.002
  675   3HD2  LEU  80          3HD2      LEU  80   1.127   8.409   3.489
  676    H    SER  81           H        SER  81  -4.044  10.131   2.515
  677    HA   SER  81           HA       SER  81  -5.135   9.671  -0.077
  678   1HB   SER  81          2HB       SER  81  -5.640  11.920   1.887
  679   2HB   SER  81          1HB       SER  81  -6.612  11.590   0.453
  680    HG   SER  81           HG       SER  81  -6.377  10.102   2.830
  681    H    GLN  82           H        GLN  82  -5.035  10.899  -1.934
  682    HA   GLN  82           HA       GLN  82  -2.695  12.580  -2.167
  683   1HB   GLN  82          2HB       GLN  82  -4.256  10.956  -3.971
  684   2HB   GLN  82          1HB       GLN  82  -4.015  12.565  -4.641
  685   1HG   GLN  82          2HG       GLN  82  -1.694  11.065  -3.514
  686   2HG   GLN  82          1HG       GLN  82  -2.298  10.680  -5.124
  687   1HE2  GLN  82          1HE2      GLN  82  -1.023  13.273  -3.108
  688   2HE2  GLN  82          2HE2      GLN  82  -0.389  14.217  -4.407
  689    H    ASP  83           H        ASP  83  -5.582  13.274  -1.062
  690    HA   ASP  83           HA       ASP  83  -6.158  15.666  -2.584
  691   1HB   ASP  83          2HB       ASP  83  -7.473  14.170  -0.376
  692   2HB   ASP  83          1HB       ASP  83  -7.809  15.893  -0.484
  693    H    ARG  84           H        ARG  84  -3.706  16.109  -1.867
  694    HA   ARG  84           HA       ARG  84  -3.705  17.647   0.632
  695   1HB   ARG  84          2HB       ARG  84  -1.913  15.985   0.389
  696   2HB   ARG  84          1HB       ARG  84  -1.390  16.755  -1.101
  697   1HG   ARG  84          2HG       ARG  84  -0.238  18.333  -0.020
  698   2HG   ARG  84          1HG       ARG  84  -1.508  18.576   1.180
  699   1HD   ARG  84          2HD       ARG  84  -0.583  17.127   2.646
  700   2HD   ARG  84          1HD       ARG  84  -0.053  16.022   1.379
  701    HE   ARG  84           HE       ARG  84   1.554  18.267   1.184
  702   1HH1  ARG  84          1HH1      ARG  84   0.908  15.791   3.583
  703   2HH1  ARG  84          2HH1      ARG  84   2.491  15.882   4.277
  704   1HH2  ARG  84          1HH2      ARG  84   3.639  18.374   2.112
  705   2HH2  ARG  84          2HH2      ARG  84   4.037  17.345   3.446
  706    H    ASN  85           H        ASN  85  -3.035  17.902  -2.828
  707    HA   ASN  85           HA       ASN  85  -3.808  20.643  -2.876
  708   1HB   ASN  85          2HB       ASN  85  -1.456  20.787  -1.983
  709   2HB   ASN  85          1HB       ASN  85  -0.901  20.103  -3.505
  710   1HD2  ASN  85          1HD2      ASN  85  -1.065  21.334  -5.400
  711   2HD2  ASN  85          2HD2      ASN  85  -1.288  23.047  -5.349
  712    H    LEU  86           H        LEU  86  -1.509  18.678  -4.770
  713    HA   LEU  86           HA       LEU  86  -1.463  18.003  -6.928
  714   1HB   LEU  86          2HB       LEU  86  -4.245  17.716  -6.113
  715   2HB   LEU  86          1HB       LEU  86  -4.076  17.958  -7.842
  716    HG   LEU  86           HG       LEU  86  -2.397  16.067  -7.836
  717   1HD1  LEU  86          1HD1      LEU  86  -1.650  15.568  -5.779
  718   2HD1  LEU  86          2HD1      LEU  86  -3.087  14.546  -5.713
  719   3HD1  LEU  86          3HD1      LEU  86  -3.114  16.155  -4.989
  720   1HD2  LEU  86          1HD2      LEU  86  -4.368  14.358  -7.283
  721   2HD2  LEU  86          2HD2      LEU  86  -4.343  15.342  -8.747
  722   3HD2  LEU  86          3HD2      LEU  86  -5.312  15.847  -7.361
  723    H    GLU  87           H        GLU  87  -2.204  18.568  -9.225
  724    HA   GLU  87           HA       GLU  87  -3.263  21.128  -9.797
  725   1HB   GLU  87          2HB       GLU  87  -0.963  21.649  -8.754
  726   2HB   GLU  87          1HB       GLU  87  -0.285  21.001 -10.240
  727   1HG   GLU  87          2HG       GLU  87  -1.077  22.744 -11.520
  728   2HG   GLU  87          1HG       GLU  87  -2.360  23.139 -10.377
  729    H    HIS  88           H        HIS  88  -0.794  18.813 -10.950
  730    HA   HIS  88           HA       HIS  88  -2.384  18.172 -13.254
  731   1HB   HIS  88          2HB       HIS  88  -0.556  20.295 -13.513
  732   2HB   HIS  88          1HB       HIS  88   0.205  18.916 -14.299
  733    HD1  HIS  88           HD1      HIS  88  -0.135  19.496 -16.711
  734    HD2  HIS  88           HD2      HIS  88  -3.643  19.779 -14.499
  735    HE1  HIS  88           HE1      HIS  88  -1.962  19.883 -18.394
  736    HE2  HIS  88           HE2      HIS  88  -4.082  20.012 -17.038
  737    H    HIS  89           H        HIS  89  -2.230  16.102 -12.262
  738    HA   HIS  89           HA       HIS  89   0.406  14.820 -12.564
  739   1HB   HIS  89          2HB       HIS  89  -1.086  14.940 -10.277
  740   2HB   HIS  89          1HB       HIS  89  -1.595  13.392 -10.944
  741    HD1  HIS  89           HD1      HIS  89   1.790  15.106 -10.527
  742    HD2  HIS  89           HD2      HIS  89  -0.055  11.433  -9.914
  743    HE1  HIS  89           HE1      HIS  89   3.572  13.607  -9.579
  744    HE2  HIS  89           HE2      HIS  89   2.459  11.364  -9.311
  745    H    HIS  90           H        HIS  90  -3.094  14.321 -13.013
  746    HA   HIS  90           HA       HIS  90  -2.627  11.902 -14.547
  747   1HB   HIS  90          2HB       HIS  90  -4.683  12.646 -12.949
  748   2HB   HIS  90          1HB       HIS  90  -5.332  13.118 -14.514
  749    HD1  HIS  90           HD1      HIS  90  -3.581  10.432 -15.664
  750    HD2  HIS  90           HD2      HIS  90  -6.797  10.669 -13.040
  751    HE1  HIS  90           HE1      HIS  90  -4.674   8.172 -15.734
  752    HE2  HIS  90           HE2      HIS  90  -6.569   8.313 -14.079
  753    H    HIS  91           H        HIS  91  -1.292  13.828 -15.831
  754    HA   HIS  91           HA       HIS  91  -2.562  13.896 -18.392
  755   1HB   HIS  91          2HB       HIS  91  -3.189  16.046 -16.776
  756   2HB   HIS  91          1HB       HIS  91  -1.833  16.656 -17.718
  757    HD1  HIS  91           HD1      HIS  91  -5.311  16.720 -17.825
  758    HD2  HIS  91           HD2      HIS  91  -2.414  15.818 -20.666
  759    HE1  HIS  91           HE1      HIS  91  -6.433  17.037 -20.054
  760    HE2  HIS  91           HE2      HIS  91  -4.641  16.554 -21.757
  761    H    HIS  92           H        HIS  92  -0.128  12.818 -17.317
  762    HA   HIS  92           HA       HIS  92   1.833  14.316 -18.924
  763   1HB   HIS  92          2HB       HIS  92   2.171  14.457 -16.396
  764   2HB   HIS  92          1HB       HIS  92   2.541  12.738 -16.446
  765    HD1  HIS  92           HD1      HIS  92   3.803  14.824 -19.260
  766    HD2  HIS  92           HD2      HIS  92   5.180  13.352 -15.625
  767    HE1  HIS  92           HE1      HIS  92   6.293  15.166 -19.293
  768    HE2  HIS  92           HE2      HIS  92   7.096  14.334 -17.056
  769    H    HIS  93           H        HIS  93   1.731  13.063 -20.738
  770    HA   HIS  93           HA       HIS  93   3.117  10.584 -20.721
  771   1HB   HIS  93          2HB       HIS  93   1.205   9.246 -21.742
  772   2HB   HIS  93          1HB       HIS  93   1.126   9.528 -20.011
  773    HD1  HIS  93           HD1      HIS  93  -1.475   8.827 -20.825
  774    HD2  HIS  93           HD2      HIS  93  -0.134  12.686 -21.568
  775    HE1  HIS  93           HE1      HIS  93  -3.550  10.201 -21.183
  776    HE2  HIS  93           HE2      HIS  93  -2.704  12.502 -21.767